data_2lq3_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 2lq3 _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 ' 40' ' ' THR . . . . . . . . . . . . . 68.1 p . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 121.493 0.663 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.789 HG21 ' HB1' ' A' ' 82' ' ' ALA . 53.2 t -134.44 111.1 14.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.602 1.161 . . . . 0.0 109.516 175.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 78.2 m -107.44 106.69 17.21 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 169.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.538 ' HB2' HD11 ' A' ' 80' ' ' LEU . . . -143.76 152.39 41.19 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.679 1.191 . . . . 0.0 108.904 -175.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -117.54 109.57 16.87 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 121.638 -0.663 . . . . 0.0 111.71 -176.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.445 ' HB3' HD12 ' A' ' 50' ' ' LEU . 89.7 mmm -93.02 141.98 27.8 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.983 0.913 . . . . 0.0 110.838 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.4 p -93.78 156.84 16.45 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.025 0.53 . . . . 0.0 111.497 -176.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -68.15 -33.64 74.84 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.124 0.569 . . . . 0.0 111.713 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -53.61 -49.17 68.4 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 124.194 0.998 . . . . 0.0 111.307 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -77.48 -33.45 54.52 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.087 0.955 . . . . 0.0 111.864 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.445 HD12 ' HB3' ' A' ' 45' ' ' MET . 5.2 mp -77.6 -33.71 53.68 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 113.55 0.945 . . . . 0.0 113.55 -176.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 61.0 mt -71.97 -34.67 69.15 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.901 0.481 . . . . 0.0 110.713 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.418 ' CD2' ' SD ' ' A' ' 93' ' ' MET . 81.9 t80 -63.44 -52.55 61.01 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.074 0.549 . . . . 0.0 110.688 175.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.7 t . . . . . 0 N--CA 1.487 1.383 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.853 -178.57 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.027 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 109.3 -1.17 31.11 Favored Glycine 0 N--CA 1.474 1.208 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 175.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -74.77 93.8 2.65 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 117.55 0.675 . . . . 0.0 110.991 173.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -85.63 85.0 7.43 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 173.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.6 t90 163.11 127.7 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 125.27 1.428 . . . . 0.0 108.552 -171.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 51.4 t 52.28 27.3 4.64 Favored 'General case' 0 N--CA 1.505 2.294 0 C-N-CA 124.184 0.994 . . . . 0.0 112.744 174.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' A' ' 43' ' ' ALA . 2.6 tm? -66.11 130.41 43.14 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.216 -176.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.4 t -57.22 104.44 0.16 Allowed 'General case' 0 N--CA 1.474 0.732 0 O-C-N 123.638 0.586 . . . . 0.0 110.957 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.789 ' HB1' HG21 ' A' ' 41' ' ' VAL . . . -51.72 -35.72 44.13 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.652 1.181 . . . . 0.0 112.897 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.8 m -63.97 -32.81 74.48 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.055 0.942 . . . . 0.0 112.286 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -71.6 -47.75 52.72 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.246 0.618 . . . . 0.0 112.041 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.433 ' HE1' HD21 ' A' ' 115' ' ' LEU . 8.3 t-105 -59.21 -47.77 84.11 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.284 0.564 . . . . 0.0 109.966 174.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -60.31 -39.15 85.99 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.923 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -65.32 -43.28 91.47 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.137 0.575 . . . . 0.0 111.556 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.86 -24.98 60.94 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.244 0.217 . . . . 0.0 111.446 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.591 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 49.1 t80 -66.87 -48.52 68.55 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-O 120.909 0.385 . . . . 0.0 110.331 171.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -65.5 -27.05 68.2 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.807 0.843 . . . . 0.0 112.109 177.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.73 -2.31 22.83 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.348 0.659 . . . . 0.0 112.465 174.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.39 23.0 63.79 Favored Glycine 0 C--N 1.355 1.631 0 CA-C-N 116.662 -0.245 . . . . 0.0 113.542 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' MET . . . . . 0.418 ' SD ' ' CD2' ' A' ' 52' ' ' PHE . 67.9 mtp -114.6 -86.06 0.6 Allowed 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 123.571 0.749 . . . . 0.0 111.129 -175.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.591 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 63.71 108.47 0.03 OUTLIER Pre-proline 0 CA--C 1.573 1.83 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 175.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -67.59 167.68 20.27 Favored 'Trans proline' 0 C--N 1.386 2.52 0 C-N-CA 123.367 2.711 . . . . 0.0 113.809 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.05 105.54 0.85 Allowed 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.396 2.064 . . . . 0.0 111.97 171.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.5 p -95.16 142.58 13.36 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 C-N-CA 123.631 0.773 . . . . 0.0 110.934 -176.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.9 m -75.14 94.55 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.834 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.442 HD13 ' HG2' ' A' ' 116' ' ' GLN . 3.3 mm? -58.9 -27.49 65.28 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 123.585 0.754 . . . . 0.0 112.352 173.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -69.62 -47.01 64.94 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.742 0.817 . . . . 0.0 112.085 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.6 t -92.97 -30.47 15.33 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -171.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.8 p -56.6 121.03 8.76 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 170.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -84.83 172.55 11.34 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.893 0.877 . . . . 0.0 112.106 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -72.55 -28.24 62.71 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 122.972 0.509 . . . . 0.0 111.015 -172.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.2 t -59.64 -25.97 65.13 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.63 0.772 . . . . 0.0 112.367 176.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.52 -37.65 70.73 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.885 0.874 . . . . 0.0 113.299 177.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.0 mp -65.81 2.78 0.93 Allowed 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -173.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 -98.4 -20.24 17.26 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 123.107 0.563 . . . . 0.0 111.618 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -109.07 -32.01 7.4 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.57 HG12 ' H ' ' A' ' 111' ' ' SER . 2.5 t -110.09 -166.06 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 CA-C-N 112.395 -2.184 . . . . 0.0 108.529 -178.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' SER . . . . . 0.57 ' H ' HG12 ' A' ' 110' ' ' VAL . 58.2 p -140.73 156.05 46.29 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 121.591 -0.693 . . . . 0.0 109.594 164.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.2 tt -53.5 -45.47 69.7 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.275 0.63 . . . . 0.0 112.114 173.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.17 -39.47 82.6 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.314 0.645 . . . . 0.0 111.997 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -64.52 -36.22 83.49 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.543 0.737 . . . . 0.0 112.02 175.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.433 HD21 ' HE1' ' A' ' 85' ' ' TRP . 39.2 mt -66.82 -55.58 14.2 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-O 121.214 0.53 . . . . 0.0 109.671 177.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . 0.442 ' HG2' HD13 ' A' ' 99' ' ' LEU . 2.8 mt-30 -64.75 -34.88 79.37 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.27 1.028 . . . . 0.0 112.213 -172.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.8 -40.69 69.77 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.901 0.88 . . . . 0.0 112.656 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -123.76 47.61 2.01 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.288 0.635 . . . . 0.0 110.36 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.967 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 175.975 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 26.4 m . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.961 0.41 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.515 HG22 ' HB1' ' A' ' 82' ' ' ALA . 26.2 t -131.37 112.98 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 124.267 1.027 . . . . 0.0 110.426 -177.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 81.6 m -107.09 108.04 19.32 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 171.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.402 ' HB2' HD13 ' A' ' 80' ' ' LEU . . . -145.12 153.74 41.72 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.28 1.032 . . . . 0.0 109.138 -176.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.669 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 27.8 tt0 -119.12 107.76 13.86 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 118.708 0.685 . . . . 0.0 111.88 177.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.606 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 81.5 mmm -84.8 114.47 22.1 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.102 0.961 . . . . 0.0 109.035 166.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.6 t -80.94 151.61 28.45 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 122.86 0.464 . . . . 0.0 110.301 -176.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.413 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 28.8 tt0 -56.84 -33.62 66.97 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 123.558 0.536 . . . . 0.0 111.706 -175.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -50.76 -55.69 15.56 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 124.165 0.986 . . . . 0.0 110.99 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -79.67 -29.61 40.93 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 124.661 1.185 . . . . 0.0 113.189 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.1 tp -82.69 -24.49 33.65 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.304 0.641 . . . . 0.0 111.894 -173.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.403 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 63.8 mt -64.92 -34.03 77.42 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 122.885 0.474 . . . . 0.0 110.55 171.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -58.31 -44.46 88.6 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.13 0.572 . . . . 0.0 110.899 169.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.1 m . . . . . 0 N--CA 1.491 1.577 0 C-N-CA 123.201 0.6 . . . . 0.0 111.777 175.495 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.413 ' HB2' ' HA ' ' A' ' 47' ' ' GLU . . . . . . . . 0 CA--C 1.553 1.07 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 82.43 56.94 2.71 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.952 -174.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -147.03 107.21 4.02 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 123.683 0.793 . . . . 0.0 110.462 176.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.669 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 4.8 ptp180 -79.78 89.83 5.23 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.245 0.618 . . . . 0.0 111.606 -176.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 31.3 t-105 -178.06 122.07 0.1 Allowed 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.789 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 42.3 t 52.36 53.82 11.72 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.155 0.982 . . . . 0.0 112.226 174.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.402 HD13 ' HB2' ' A' ' 43' ' ' ALA . 3.3 tm? -92.99 124.24 36.82 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.626 -175.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 61.5 m -59.39 111.97 1.58 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.023 0.529 . . . . 0.0 109.995 173.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.515 ' HB1' HG22 ' A' ' 41' ' ' VAL . . . -57.47 -27.29 62.36 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -171.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.8 m -69.59 -28.76 66.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.396 0.679 . . . . 0.0 112.266 176.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -61.89 -45.11 95.18 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.803 0.841 . . . . 0.0 111.325 175.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.606 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 1.3 t-105 -70.85 -47.92 56.73 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.63 174.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.435 HE21 ' HG3' ' A' ' 90' ' ' GLU . 21.2 tp60 -56.15 -42.79 77.56 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.098 0.959 . . . . 0.0 111.665 -177.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -55.31 -45.54 76.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.724 0.81 . . . . 0.0 111.574 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.21 -37.76 86.57 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.457 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.555 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 51.6 t80 -71.9 -34.41 69.11 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 122.439 0.296 . . . . 0.0 111.649 178.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.435 ' HG3' HE21 ' A' ' 86' ' ' GLN . 58.3 mt-10 -69.45 -23.11 63.63 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.206 0.602 . . . . 0.0 111.754 178.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.61 -11.37 59.66 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.558 0.743 . . . . 0.0 111.99 170.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.81 8.8 86.31 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-N 116.496 -0.32 . . . . 0.0 112.995 -174.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 25.9 ttt -88.13 -77.95 0.34 Allowed 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 124.313 1.045 . . . . 0.0 110.135 -174.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.555 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 61.94 114.18 0.02 OUTLIER Pre-proline 0 N--CA 1.497 1.905 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 167.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.423 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 92.6 Cg_endo -74.6 171.46 18.12 Favored 'Trans proline' 0 CA--C 1.572 2.39 0 C-N-CA 122.824 2.349 . . . . 0.0 113.152 171.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.38 111.15 2.65 Favored 'Trans proline' 0 C--N 1.383 2.394 0 C-N-CA 122.057 1.838 . . . . 0.0 111.778 171.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -97.35 134.26 35.96 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 123.065 0.546 . . . . 0.0 110.525 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.1 m -67.97 98.78 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 123.954 0.902 . . . . 0.0 113.231 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.478 HD22 ' HB3' ' A' ' 115' ' ' LEU . 3.6 mm? -73.57 -13.4 61.02 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.743 -0.598 . . . . 0.0 112.062 172.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -83.18 -12.45 56.89 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 124.273 1.029 . . . . 0.0 112.418 176.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.2 t -130.73 -26.35 2.23 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -174.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.3 p -55.33 106.0 0.21 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.407 0.622 . . . . 0.0 112.098 170.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -61.77 141.28 58.0 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 125.09 1.356 . . . . 0.0 110.968 168.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.447 ' HA ' HD12 ' A' ' 107' ' ' LEU . 21.5 ptmt -61.33 -17.52 54.19 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -177.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 69.6 m -58.19 -27.33 63.78 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 123.186 0.594 . . . . 0.0 112.594 171.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.05 -28.29 68.96 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.573 0.749 . . . . 0.0 112.712 173.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 104' ' ' LYS . 7.9 mp -70.31 1.99 4.31 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 124.29 1.036 . . . . 0.0 113.65 -175.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 48.3 mtp180 -88.75 -35.29 16.77 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.143 0.577 . . . . 0.0 111.235 167.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -91.34 -49.47 6.33 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.212 1.005 . . . . 0.0 110.361 -174.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.546 HG23 ' HE1' ' A' ' 85' ' ' TRP . 6.9 p -106.08 176.02 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.367 0 C-N-CA 124.407 1.083 . . . . 0.0 108.496 169.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 47.0 m -116.17 153.26 32.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.975 -1.078 . . . . 0.0 109.992 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.8 tt -57.09 -36.5 70.67 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.511 0.724 . . . . 0.0 112.603 179.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.22 -34.16 73.26 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.5 -36.72 79.31 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.499 0.719 . . . . 0.0 110.526 175.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.478 ' HB3' HD22 ' A' ' 99' ' ' LEU . 85.6 mt -68.35 -52.74 29.91 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.376 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -73.77 -27.86 61.37 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 114.73 -1.123 . . . . 0.0 112.672 -172.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -66.97 -17.16 64.79 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 175.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -130.42 20.01 5.24 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 123.383 0.673 . . . . 0.0 111.955 172.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.959 0 C-N-CA 123.644 0.778 . . . . 0.0 110.475 168.497 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 60.3 p . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 121.461 0.648 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.7 HG13 ' HB1' ' A' ' 82' ' ' ALA . 39.3 t -136.26 102.65 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 C-N-CA 123.615 0.766 . . . . 0.0 109.982 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.568 ' SG ' ' HA ' ' A' ' 78' ' ' TRP . 80.2 m -111.18 107.39 16.71 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 174.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.475 ' HB1' HD13 ' A' ' 80' ' ' LEU . . . -138.57 150.4 46.28 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -172.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.501 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 20.7 tt0 -116.96 130.24 56.57 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.775 0.322 . . . . 0.0 111.246 -175.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.433 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 37.6 mtm -116.33 154.24 30.56 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.409 173.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.5 HG21 ' HB3' ' A' ' 95' ' ' PRO . 9.2 t -92.91 156.22 17.08 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.755 0.822 . . . . 0.0 110.517 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.443 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 37.1 tt0 -54.38 -32.69 57.63 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.198 0.599 . . . . 0.0 112.313 -175.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -48.99 -53.17 21.05 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.622 1.169 . . . . 0.0 112.351 -176.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.466 ' HA ' ' HD2' ' A' ' 52' ' ' PHE . 53.8 t80 -71.05 -40.6 71.58 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 177.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.407 HD11 ' HB2' ' A' ' 45' ' ' MET . 8.9 mp -63.78 -24.52 67.79 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.827 0.451 . . . . 0.0 111.36 -178.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.443 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 92.8 mt -71.28 -45.87 62.15 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.924 0.889 . . . . 0.0 110.939 170.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.466 ' HD2' ' HA ' ' A' ' 49' ' ' PHE . 25.9 m-85 -58.35 -31.76 67.9 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 123.121 0.568 . . . . 0.0 111.258 174.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 58.5 m . . . . . 0 CA--C 1.548 0.884 0 CA-C-N 115.542 -0.753 . . . . 0.0 110.979 173.533 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.81 0 CA-C-O 120.648 0.261 . . . . 0.0 111.592 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.75 -2.61 70.03 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 114.41 0.524 . . . . 0.0 114.41 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -97.09 123.06 40.74 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.079 0.551 . . . . 0.0 110.539 173.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.501 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.1 OUTLIER -114.89 91.22 3.55 Favored 'General case' 0 CA--C 1.574 1.88 0 CA-C-O 121.919 0.866 . . . . 0.0 110.437 176.643 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.568 ' HA ' ' SG ' ' A' ' 42' ' ' CYS . 75.0 t90 -172.28 124.49 0.5 Allowed 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.318 0.647 . . . . 0.0 110.098 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 86.9 m 50.59 26.13 2.31 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.475 HD13 ' HB1' ' A' ' 43' ' ' ALA . 3.2 tm? -66.31 118.52 10.1 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 6.4 p -61.98 105.92 0.64 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 122.993 0.517 . . . . 0.0 110.564 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.7 ' HB1' HG13 ' A' ' 41' ' ' VAL . . . -55.16 -23.61 22.37 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.953 1.301 . . . . 0.0 113.775 -176.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.7 m -58.92 -38.77 79.7 Favored 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 123.503 0.721 . . . . 0.0 112.425 173.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.3 mmm-85 -74.97 -36.12 62.05 Favored 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 123.726 0.81 . . . . 0.0 112.433 178.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.519 ' HE1' HD21 ' A' ' 115' ' ' LEU . 7.7 t-105 -64.88 -45.8 84.47 Favored 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 173.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -57.94 -43.89 86.6 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.85 0.86 . . . . 0.0 110.792 173.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -55.28 -38.32 68.44 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.515 1.126 . . . . 0.0 112.024 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.34 94.03 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 174.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -68.26 -40.25 81.95 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 122.586 0.354 . . . . 0.0 111.48 174.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -63.48 -33.34 75.35 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.016 0.926 . . . . 0.0 111.785 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.29 -15.97 25.24 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 123.843 0.857 . . . . 0.0 112.138 175.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.87 -20.93 37.5 Favored Glycine 0 CA--C 1.542 1.779 0 N-CA-C 115.202 0.841 . . . . 0.0 115.202 175.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -89.79 33.08 0.86 Allowed 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 118.054 0.927 . . . . 0.0 113.023 -174.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.22 112.79 4.54 Favored Pre-proline 0 CA--C 1.569 1.679 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.5 ' HB3' HG21 ' A' ' 46' ' ' THR . 57.4 Cg_exo -59.83 171.51 2.8 Favored 'Trans proline' 0 CA--C 1.568 2.182 0 C-N-CA 123.947 3.098 . . . . 0.0 114.825 172.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -80.1 113.15 2.92 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.719 2.279 . . . . 0.0 111.983 168.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 9.7 p -99.25 156.78 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 123.884 0.873 . . . . 0.0 110.642 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.497 HG23 ' HB3' ' A' ' 101' ' ' SER . 33.3 m -81.44 164.32 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.096 0 CA-C-O 121.608 0.718 . . . . 0.0 112.228 173.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 83.5 mt -112.55 -13.78 13.28 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.973 0.909 . . . . 0.0 110.056 163.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -71.6 -70.47 0.32 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.735 0.814 . . . . 0.0 111.208 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.497 ' HB3' HG23 ' A' ' 98' ' ' VAL . 34.6 t -66.26 -31.55 72.43 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.219 0.608 . . . . 0.0 112.061 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 76.2 m -62.67 127.38 31.04 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.61 0.764 . . . . 0.0 111.938 175.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -98.97 164.27 12.25 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.891 0.877 . . . . 0.0 110.842 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.438 ' HD3' HD21 ' A' ' 107' ' ' LEU . 3.0 tppp? -53.5 -32.83 52.01 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 125.422 1.489 . . . . 0.0 113.595 176.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 56.7 m -60.5 -26.06 66.54 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 178.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.68 -33.45 72.87 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.393 0.677 . . . . 0.0 112.667 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.438 HD21 ' HD3' ' A' ' 104' ' ' LYS . 8.8 mp -61.65 -24.46 66.75 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.923 0.889 . . . . 0.0 112.264 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -74.34 -11.49 60.27 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.978 0.911 . . . . 0.0 112.81 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -116.3 -48.99 2.69 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.041 0.937 . . . . 0.0 111.708 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.473 HG23 ' CD1' ' A' ' 85' ' ' TRP . 14.8 p -113.25 -24.33 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -169.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 46.2 t 75.2 148.17 0.1 Allowed 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 125.112 1.365 . . . . 0.0 112.607 -173.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.479 ' HA ' HD12 ' A' ' 115' ' ' LEU . 3.8 tt -58.59 -39.05 79.29 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.487 1.115 . . . . 0.0 112.149 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.72 -38.83 70.28 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.278 0.631 . . . . 0.0 112.686 -176.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -67.17 -44.74 78.96 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.589 0.756 . . . . 0.0 110.373 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.519 HD21 ' HE1' ' A' ' 85' ' ' TRP . 63.8 mt -58.99 -46.86 87.09 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.814 0.816 . . . . 0.0 110.114 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -74.98 -29.96 61.05 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 114.131 -1.395 . . . . 0.0 112.828 -176.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.91 -19.31 60.34 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.341 170.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -123.33 6.49 9.05 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.788 0.835 . . . . 0.0 112.489 178.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.431 0 C-N-CA 123.374 0.669 . . . . 0.0 111.296 177.101 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.414 ' HG1' ' HB3' ' A' ' 103' ' ' GLU . 56.4 p . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 121.313 0.578 . . . . 0.0 111.229 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.42 HG12 ' N ' ' A' ' 82' ' ' ALA . 28.6 t -123.8 103.47 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.434 0.694 . . . . 0.0 110.126 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 80.8 m -113.78 108.17 16.72 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 173.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -142.28 152.55 43.12 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.084 0.953 . . . . 0.0 109.384 -167.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.466 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 27.0 tt0 -122.74 126.8 48.21 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.558 ' HB2' HD11 ' A' ' 50' ' ' LEU . 18.7 mtm -119.89 136.67 54.41 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.617 0.767 . . . . 0.0 109.509 173.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 6.2 t -98.68 160.73 14.07 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 123.005 0.522 . . . . 0.0 111.764 -172.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -53.13 -35.38 59.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.345 1.058 . . . . 0.0 113.051 -171.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -55.17 -46.68 75.78 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 122.266 1.031 . . . . 0.0 110.529 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -79.6 -35.82 38.99 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.949 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.558 HD11 ' HB2' ' A' ' 45' ' ' MET . 10.5 mp -68.57 -36.89 79.36 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 117.709 0.231 . . . . 0.0 111.589 178.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.9 mt -64.02 -31.7 72.99 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.312 0.645 . . . . 0.0 111.579 177.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.518 ' HE2' ' HB2' ' A' ' 91' ' ' ALA . 87.2 t80 -61.71 -46.77 88.26 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.621 0.368 . . . . 0.0 110.871 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 45.2 m . . . . . 0 N--CA 1.483 1.221 0 C-N-CA 123.298 0.639 . . . . 0.0 112.386 -178.138 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.977 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.59 38.71 4.9 Favored Glycine 0 N--CA 1.475 1.251 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.998 -177.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -122.73 107.59 12.09 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.385 1.074 . . . . 0.0 110.681 -176.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.466 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 16.4 ptt-85 -84.06 89.98 7.37 Favored 'General case' 0 CA--C 1.555 1.172 0 CA-C-O 122.027 0.918 . . . . 0.0 111.559 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -138.16 -163.77 1.51 Allowed 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 125.251 1.421 . . . . 0.0 108.844 175.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 26.0 p -55.9 81.09 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 122.167 0.984 . . . . 0.0 111.246 169.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -85.28 -25.84 26.99 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.919 1.288 . . . . 0.0 110.118 -175.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 52.4 t 68.02 123.36 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.041 1.336 . . . . 0.0 111.148 -173.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.42 ' N ' HG12 ' A' ' 41' ' ' VAL . . . -55.69 -24.47 34.52 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.79 0.836 . . . . 0.0 112.658 -177.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.4 t -54.12 -47.08 72.21 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.985 0.914 . . . . 0.0 112.693 173.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -41.55 85.42 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 123.531 0.732 . . . . 0.0 112.536 -178.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.44 ' NE1' HG23 ' A' ' 110' ' ' VAL . 9.8 t-105 -71.35 -43.69 66.49 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 124.043 0.937 . . . . 0.0 110.535 -177.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -65.77 -37.66 86.92 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.936 0.895 . . . . 0.0 111.633 175.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.72 -44.16 97.46 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.54 0.736 . . . . 0.0 111.06 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.51 -30.1 71.13 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.46 0.704 . . . . 0.0 111.461 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.524 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 86.8 t80 -68.77 -46.4 68.87 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 123.01 0.524 . . . . 0.0 111.299 174.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -71.79 -16.6 62.19 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.459 0.704 . . . . 0.0 112.242 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.518 ' HB2' ' HE2' ' A' ' 52' ' ' PHE . . . -75.21 -2.7 29.14 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 123.7 0.8 . . . . 0.0 111.589 168.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 84.61 15.65 67.83 Favored Glycine 0 C--N 1.355 1.623 0 C-N-CA 123.63 0.634 . . . . 0.0 113.72 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.2 mmm -118.81 -79.04 0.59 Allowed 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.142 0.577 . . . . 0.0 112.057 -171.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.524 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 63.99 102.26 0.04 OUTLIER Pre-proline 0 N--CA 1.493 1.683 0 C-N-CA 125.0 1.32 . . . . 0.0 113.8 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.422 ' HG3' ' HB3' ' A' ' 45' ' ' MET . 59.6 Cg_endo -67.94 168.98 17.32 Favored 'Trans proline' 0 N--CA 1.504 2.131 0 C-N-CA 123.84 3.027 . . . . 0.0 114.954 177.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.99 109.69 1.77 Allowed 'Trans proline' 0 C--N 1.379 2.177 0 C-N-CA 122.658 2.239 . . . . 0.0 112.197 168.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.7 p -95.2 152.31 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.222 0.609 . . . . 0.0 110.592 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.5 p -90.75 105.42 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.422 0 CA-C-O 121.734 0.778 . . . . 0.0 110.937 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.532 HD22 ' HA ' ' A' ' 116' ' ' GLN . 5.8 mp -69.32 -40.54 77.55 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.737 1.215 . . . . 0.0 112.262 -171.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -68.62 -27.54 66.11 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.367 0.667 . . . . 0.0 111.86 -176.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 30.6 t -84.09 -29.64 26.63 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.198 0.599 . . . . 0.0 110.685 174.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 90.6 m -74.63 101.49 4.26 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.17 0.588 . . . . 0.0 110.414 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.414 ' HB3' ' HG1' ' A' ' 40' ' ' THR . 10.5 tp10 -67.97 156.6 36.92 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.56 0.744 . . . . 0.0 111.126 178.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.581 ' HA ' HD11 ' A' ' 107' ' ' LEU . 0.6 OUTLIER -63.12 -14.32 47.18 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.092 0.957 . . . . 0.0 113.129 -174.902 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 40.4 t -57.16 -39.22 74.83 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.226 0.61 . . . . 0.0 111.814 171.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.43 -22.37 61.11 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.916 0.886 . . . . 0.0 112.877 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.581 HD11 ' HA ' ' A' ' 104' ' ' LYS . 7.2 mp -63.97 -22.4 66.91 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 123.93 0.892 . . . . 0.0 112.199 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -78.55 -15.08 58.98 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.251 0.62 . . . . 0.0 111.268 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -110.97 -17.06 13.38 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.621 1.168 . . . . 0.0 113.334 -175.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.44 HG23 ' NE1' ' A' ' 85' ' ' TRP . 7.4 p -144.52 -23.76 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.0 t 80.34 139.74 0.07 Allowed 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 125.461 1.504 . . . . 0.0 112.851 -176.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.82 -38.19 87.26 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.535 1.134 . . . . 0.0 112.298 173.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.87 -32.43 69.46 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.153 0.581 . . . . 0.0 112.303 -175.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.78 -39.34 76.68 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.894 174.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.414 ' HB3' ' HG ' ' A' ' 99' ' ' LEU . 64.5 mt -69.16 -45.39 70.17 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.586 0.754 . . . . 0.0 110.298 -172.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . 0.532 ' HA ' HD22 ' A' ' 99' ' ' LEU . 61.1 mm-40 -62.64 -43.74 98.04 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.621 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -61.46 -29.83 70.21 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 115.264 -0.88 . . . . 0.0 113.216 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -91.67 -17.37 25.59 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 121.253 0.549 . . . . 0.0 111.002 168.02 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.0 p . . . . . 0 CA--C 1.563 1.447 0 CA-C-O 121.243 0.544 . . . . 0.0 112.16 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.1 t -131.53 137.08 56.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.282 0.633 . . . . 0.0 110.261 174.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 74.7 m -131.03 111.24 11.84 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.775 0.83 . . . . 0.0 110.051 174.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.554 ' HB3' HD11 ' A' ' 80' ' ' LEU . . . -141.28 151.92 44.06 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.826 0.851 . . . . 0.0 109.54 -172.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.618 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 23.8 tt0 -119.86 108.35 14.26 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 122.245 -0.284 . . . . 0.0 111.642 -176.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.543 ' SD ' ' HG3' ' A' ' 84' ' ' ARG . 56.2 mtp -93.38 130.02 39.32 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.053 0.541 . . . . 0.0 110.228 170.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.8 p -83.3 167.71 17.35 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.568 0.747 . . . . 0.0 109.578 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -62.75 -37.01 84.9 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 118.403 0.547 . . . . 0.0 110.842 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -54.31 -55.53 27.49 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 124.018 0.927 . . . . 0.0 111.544 176.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -78.13 -29.98 49.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.796 -176.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.11 -38.87 60.98 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.471 0.708 . . . . 0.0 110.237 -177.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 28.1 mt -62.91 -47.68 82.21 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.634 0.774 . . . . 0.0 110.778 169.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -65.01 -42.05 94.79 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -174.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 N--CA 1.492 1.665 0 C-N-CA 123.263 0.625 . . . . 0.0 110.773 177.559 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.394 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 67.57 40.9 90.68 Favored Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.627 -0.589 . . . . 0.0 111.627 -168.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -138.27 97.42 3.38 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 124.152 0.981 . . . . 0.0 109.013 -174.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.618 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 39.0 ptt85 -89.14 85.33 6.63 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.709 0.766 . . . . 0.0 112.716 -174.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 -159.26 120.42 3.27 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.474 0.71 . . . . 0.0 110.122 -173.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.0 t 62.47 9.83 3.63 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 170.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.554 HD11 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -67.6 110.63 3.78 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 44.1 t -61.44 132.41 53.34 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.372 0.669 . . . . 0.0 111.199 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.42 -22.81 62.0 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.6 m -58.27 -41.58 84.64 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 118.362 0.528 . . . . 0.0 112.04 172.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.543 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 6.9 tpm_? -69.2 -41.49 77.04 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.334 1.054 . . . . 0.0 111.841 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.46 ' NE1' HG11 ' A' ' 110' ' ' VAL . 0.5 OUTLIER -74.25 -54.6 7.38 Favored 'General case' 0 CA--C 1.563 1.457 0 C-N-CA 123.6 0.76 . . . . 0.0 110.841 179.571 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.497 ' HB2' HG13 ' A' ' 110' ' ' VAL . 32.4 tp60 -49.95 -40.68 44.54 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 177.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -61.79 -41.1 97.3 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 120.68 0.276 . . . . 0.0 111.049 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.5 70.6 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.927 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.655 ' HA ' ' HB1' ' A' ' 94' ' ' ALA . 54.0 t80 -67.03 -43.45 82.74 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.75 0.82 . . . . 0.0 110.782 171.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -69.4 -31.59 70.06 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.167 0.587 . . . . 0.0 112.466 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -78.96 -11.51 60.01 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.654 0.782 . . . . 0.0 111.577 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 107.1 -16.79 38.62 Favored Glycine 0 C--N 1.352 1.439 0 N-CA-C 114.934 0.734 . . . . 0.0 114.934 170.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -73.97 -70.43 0.39 Allowed 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 117.918 0.859 . . . . 0.0 111.021 -177.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.655 ' HB1' ' HA ' ' A' ' 89' ' ' PHE . . . 60.52 97.98 0.04 OUTLIER Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 124.745 1.218 . . . . 0.0 113.291 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.438 ' HB2' ' O ' ' A' ' 44' ' ' GLU . 94.5 Cg_endo -71.28 168.97 21.89 Favored 'Trans proline' 0 CA--C 1.568 2.182 0 C-N-CA 123.391 2.727 . . . . 0.0 113.563 175.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -66.46 118.64 5.69 Favored 'Trans proline' 0 C--N 1.381 2.276 0 C-N-CA 122.421 2.081 . . . . 0.0 112.784 176.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.539 HG12 ' HB3' ' A' ' 119' ' ' ALA . 7.7 p -105.97 158.27 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 123.497 0.719 . . . . 0.0 109.323 173.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.549 HG11 ' HD2' ' A' ' 77' ' ' ARG . 3.4 p -115.65 108.24 24.76 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 O-C-N 121.675 -0.641 . . . . 0.0 112.508 -170.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 97.0 mt -69.07 -28.91 66.95 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -83.67 40.0 0.71 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.607 0.763 . . . . 0.0 111.748 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.475 ' HB3' HG12 ' A' ' 98' ' ' VAL . 22.4 t -170.12 -24.67 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 124.521 1.129 . . . . 0.0 110.852 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 33.6 p -74.77 -176.84 3.0 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.729 0.776 . . . . 0.0 112.186 172.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -148.76 171.85 15.56 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.03 -177.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.521 ' HA ' HD12 ' A' ' 107' ' ' LEU . 0.5 OUTLIER -62.74 -17.72 61.38 Favored 'General case' 0 CA--C 1.564 1.512 0 C-N-CA 124.256 1.022 . . . . 0.0 110.98 167.888 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.2 m -57.56 -36.18 71.33 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.495 1.118 . . . . 0.0 112.255 169.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.439 ' O ' HG23 ' A' ' 110' ' ' VAL . . . -63.49 -36.36 83.51 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.948 0.499 . . . . 0.0 111.236 176.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 104' ' ' LYS . 9.5 mp -68.05 5.75 0.86 Allowed 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 124.906 1.282 . . . . 0.0 113.584 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -86.86 -23.72 25.16 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.526 0.73 . . . . 0.0 110.182 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -107.71 -50.92 2.98 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.717 1.207 . . . . 0.0 108.758 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.497 HG13 ' HB2' ' A' ' 86' ' ' GLN . 33.8 m -97.06 -172.67 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 CA-C-O 122.289 1.042 . . . . 0.0 111.919 176.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.1 t -113.97 158.52 21.04 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.347 158.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.5 ' HA ' HD13 ' A' ' 115' ' ' LEU . 2.5 tt -55.95 -34.98 66.16 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 122.518 0.327 . . . . 0.0 110.761 170.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.35 73.72 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.185 0.594 . . . . 0.0 112.308 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -73.09 -33.91 65.88 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 120.841 0.353 . . . . 0.0 110.183 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.5 HD13 ' HA ' ' A' ' 112' ' ' LEU . 87.7 mt -68.35 -56.88 6.99 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 123.73 0.812 . . . . 0.0 110.634 178.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -64.62 -30.94 71.96 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.418 1.087 . . . . 0.0 112.315 -170.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -52.3 -30.42 28.1 Favored 'General case' 0 CA--C 1.563 1.443 0 C-N-CA 123.89 0.876 . . . . 0.0 112.87 171.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -135.72 27.7 3.31 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 123.886 0.874 . . . . 0.0 112.488 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.539 ' HB3' HG12 ' A' ' 97' ' ' VAL . . . . . . . . 0 N--CA 1.497 1.89 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -177.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 40.7 p . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 121.325 0.583 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.49 HG21 ' HB2' ' A' ' 82' ' ' ALA . 21.4 t -135.16 102.22 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 C-N-CA 123.974 0.91 . . . . 0.0 109.334 171.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 61.6 m -108.03 104.3 13.72 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 170.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.402 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.73 144.01 32.5 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.325 1.05 . . . . 0.0 109.778 -173.449 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.507 ' HG3' ' HB3' ' A' ' 77' ' ' ARG . 1.7 mp0 -102.63 107.5 18.43 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 122.165 -0.335 . . . . 0.0 110.611 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.574 ' SD ' HD21 ' A' ' 80' ' ' LEU . 63.8 mtp -91.06 137.75 32.13 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 169.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.7 p -82.77 159.51 22.49 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 121.339 0.59 . . . . 0.0 111.713 -174.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -60.85 -28.6 68.95 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.54 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -50.98 -54.4 24.78 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.975 0.91 . . . . 0.0 112.096 174.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -74.86 -36.43 62.33 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.46 -26.8 65.67 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -78.59 -34.39 46.83 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.69 0.796 . . . . 0.0 110.877 168.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -62.31 -31.49 72.11 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 122.552 0.341 . . . . 0.0 110.631 170.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.3 m . . . . . 0 N--CA 1.485 1.297 0 C-N-CA 123.412 0.685 . . . . 0.0 110.757 175.932 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.373 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 83.53 -7.82 67.44 Favored Glycine 0 CA--C 1.543 1.809 0 N-CA-C 114.973 0.749 . . . . 0.0 114.973 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -113.02 148.18 35.66 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.33 0.652 . . . . 0.0 111.073 -178.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.507 ' HB3' ' HG3' ' A' ' 44' ' ' GLU . 27.1 ptt180 -111.12 101.76 10.26 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.544 0.738 . . . . 0.0 111.282 -177.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -163.41 118.83 1.68 Allowed 'General case' 0 N--CA 1.483 1.203 0 O-C-N 121.712 -0.617 . . . . 0.0 111.599 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.6 t 51.61 27.96 4.36 Favored 'General case' 0 N--CA 1.5 2.033 0 C-N-CA 123.93 0.892 . . . . 0.0 112.391 174.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.574 HD21 ' SD ' ' A' ' 45' ' ' MET . 3.1 tm? -66.3 126.69 29.55 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.939 0.895 . . . . 0.0 110.56 -171.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.421 ' SG ' ' HB2' ' A' ' 83' ' ' SER . 43.4 t -64.16 101.3 0.4 Allowed 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 122.924 0.49 . . . . 0.0 110.863 177.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.49 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -56.86 -24.74 53.79 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.86 0.864 . . . . 0.0 113.018 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . 0.421 ' HB2' ' SG ' ' A' ' 81' ' ' CYS . 54.4 m -61.61 -48.88 78.9 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.851 0.46 . . . . 0.0 111.296 171.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -59.35 -39.01 81.83 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 122.707 0.403 . . . . 0.0 112.061 179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.687 ' HE1' HD21 ' A' ' 115' ' ' LEU . 13.1 t-105 -66.63 -52.71 42.13 Favored 'General case' 0 CA--C 1.569 1.689 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.132 174.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.465 ' HB2' HG13 ' A' ' 110' ' ' VAL . 34.2 tp60 -49.54 -47.28 49.17 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 176.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -35.44 77.52 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.576 0.75 . . . . 0.0 111.903 177.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.9 -39.12 90.9 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.097 0.559 . . . . 0.0 111.89 176.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.597 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 68.8 t80 -60.42 -51.73 68.24 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.164 0.507 . . . . 0.0 110.771 175.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -71.6 -19.49 62.12 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.476 -177.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.28 -11.45 46.44 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.692 0.797 . . . . 0.0 112.36 175.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.96 10.4 85.12 Favored Glycine 0 CA--C 1.542 1.757 0 N-CA-C 114.091 0.396 . . . . 0.0 114.091 -176.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 94.2 mmm -112.83 27.98 9.17 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.346 1.058 . . . . 0.0 110.725 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.597 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -67.76 117.45 48.15 Favored Pre-proline 0 CA--C 1.558 1.276 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 -178.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -67.05 174.81 6.35 Favored 'Trans proline' 0 CA--C 1.566 2.093 0 C-N-CA 123.074 2.516 . . . . 0.0 113.079 168.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.1 145.62 55.7 Favored 'Trans proline' 0 C--N 1.376 1.981 0 C-N-CA 121.522 1.481 . . . . 0.0 112.169 166.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.8 p -131.62 153.37 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.735 0.814 . . . . 0.0 108.99 174.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.519 HG23 ' HB3' ' A' ' 101' ' ' SER . 30.8 m -85.63 165.84 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-O 121.144 0.497 . . . . 0.0 111.302 173.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 86.4 mt -107.13 -26.06 11.28 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.609 0.764 . . . . 0.0 110.676 169.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -74.39 -60.33 2.32 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.503 0.721 . . . . 0.0 111.479 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.519 ' HB3' HG23 ' A' ' 98' ' ' VAL . 40.8 t -77.35 -25.33 50.94 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 179.297 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.459 ' H ' HG21 ' A' ' 98' ' ' VAL . 88.6 m -73.83 105.39 5.09 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 172.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -78.26 160.61 27.81 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.454 -175.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.521 ' HA ' HD11 ' A' ' 107' ' ' LEU . 27.9 mmtp -71.66 -12.85 61.54 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -169.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 16.6 t -61.94 -25.54 67.65 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 122.983 0.513 . . . . 0.0 111.369 170.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.419 ' O ' HG23 ' A' ' 110' ' ' VAL . . . -57.02 -33.99 67.73 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.626 0.77 . . . . 0.0 112.888 172.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.521 HD11 ' HA ' ' A' ' 104' ' ' LYS . 9.4 mp -65.73 5.64 0.43 Allowed 'General case' 0 N--CA 1.503 2.224 0 C-N-CA 124.813 1.245 . . . . 0.0 113.588 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 46.2 mtp180 -94.57 -19.15 20.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.714 0.805 . . . . 0.0 110.28 175.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 34.7 m-85 -106.94 -51.4 2.93 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.099 1.359 . . . . 0.0 108.673 178.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.465 HG13 ' HB2' ' A' ' 86' ' ' GLN . 33.0 m -92.55 -170.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.017 170.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.3 t -120.27 163.46 17.76 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 114.638 -1.164 . . . . 0.0 108.103 155.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.401 ' HB2' HD21 ' A' ' 107' ' ' LEU . 2.7 tt -56.79 -31.87 65.1 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.571 0.349 . . . . 0.0 111.238 173.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.2 -41.44 79.36 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.702 0.801 . . . . 0.0 112.756 178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -70.09 -33.54 72.01 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.192 0.597 . . . . 0.0 110.519 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.687 HD21 ' HE1' ' A' ' 85' ' ' TRP . 80.4 mt -67.69 -54.88 15.89 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.639 178.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -63.45 -37.07 85.89 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.341 1.056 . . . . 0.0 112.056 -175.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.78 -21.94 12.71 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -130.12 21.5 5.31 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.6 0.76 . . . . 0.0 111.681 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.552 0 C-N-CA 123.837 0.855 . . . . 0.0 111.926 176.742 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.52 ' HB ' ' HB3' ' A' ' 105' ' ' SER . 1.7 m . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.545 HG23 ' HA ' ' A' ' 106' ' ' ALA . 34.5 t -138.41 100.4 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.978 0 C-N-CA 124.662 1.185 . . . . 0.0 110.206 -174.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 62.8 m -101.14 103.63 14.7 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 166.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.404 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -134.55 147.48 50.29 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 -176.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 26.1 tt0 -120.29 109.55 15.52 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.213 0.53 . . . . 0.0 111.258 -169.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.598 ' HB2' HD12 ' A' ' 50' ' ' LEU . 73.6 mmm -93.94 150.93 19.93 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.22 1.008 . . . . 0.0 110.656 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 70.2 p -82.94 155.88 23.79 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 171.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.565 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 24.5 tt0 -58.98 -27.37 65.33 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.837 0.455 . . . . 0.0 112.015 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -49.06 -38.4 24.06 Favored 'General case' 0 CA--C 1.566 1.591 0 C-N-CA 123.923 0.889 . . . . 0.0 111.816 170.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.573 ' HA ' ' HE1' ' A' ' 93' ' ' MET . 72.3 t80 -73.56 -53.03 11.5 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 172.176 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.598 HD12 ' HB2' ' A' ' 45' ' ' MET . 6.0 mp -66.76 -25.51 66.53 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -170.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.565 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 92.1 mt -73.57 -40.5 63.87 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.891 0.876 . . . . 0.0 110.76 171.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -60.71 -46.73 89.26 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.312 0.645 . . . . 0.0 110.958 174.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.1 t . . . . . 0 N--CA 1.481 1.094 0 C-N-CA 123.627 0.771 . . . . 0.0 111.805 -179.638 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.94 0 CA-C-O 121.18 0.514 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 116.16 31.29 1.9 Allowed Glycine 0 CA--C 1.539 1.556 0 CA-C-N 115.67 -0.695 . . . . 0.0 113.776 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -122.15 113.78 19.97 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-N 117.28 0.54 . . . . 0.0 110.592 169.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.437 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 13.0 ptp180 -69.8 89.82 0.58 Allowed 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 121.935 0.874 . . . . 0.0 111.178 177.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 26.4 t90 -177.61 140.81 0.27 Allowed 'General case' 0 N--CA 1.491 1.612 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.976 -171.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 44.9 t 50.79 31.85 6.47 Favored 'General case' 0 N--CA 1.508 2.459 0 C-N-CA 124.773 1.229 . . . . 0.0 113.702 167.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.477 HD21 ' HD2' ' A' ' 84' ' ' ARG . 3.0 tm? -81.62 -33.29 31.54 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 118.847 -0.597 . . . . 0.0 111.889 -171.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 37.6 t 65.12 121.8 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 123.463 0.705 . . . . 0.0 111.58 -175.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.468 ' H ' HG21 ' A' ' 41' ' ' VAL . . . -61.23 -29.88 70.1 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -170.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.5 m -57.76 -33.5 68.58 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.668 0.787 . . . . 0.0 112.551 176.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.477 ' HD2' HD21 ' A' ' 80' ' ' LEU . 30.2 ttm180 -73.43 -45.43 54.51 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.791 0.836 . . . . 0.0 111.324 -174.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.532 ' HE1' HD22 ' A' ' 115' ' ' LEU . 1.6 t-105 -74.23 -52.08 13.44 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.55 0.74 . . . . 0.0 111.277 176.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.418 ' OE1' HG13 ' A' ' 110' ' ' VAL . 34.2 tp60 -51.67 -37.73 51.86 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.044 0.938 . . . . 0.0 112.948 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -62.72 -42.74 99.81 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.768 0.427 . . . . 0.0 111.395 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.71 -33.8 76.45 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.338 0.655 . . . . 0.0 111.913 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -61.17 -51.4 69.22 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.51 0.724 . . . . 0.0 111.041 174.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.72 -25.56 63.91 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.411 0.685 . . . . 0.0 112.266 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.38 -14.39 58.99 Favored 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 123.54 0.736 . . . . 0.0 111.699 171.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.73 -20.18 29.31 Favored Glycine 0 C--N 1.353 1.48 0 N-CA-C 114.448 0.539 . . . . 0.0 114.448 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' MET . . . . . 0.573 ' HE1' ' HA ' ' A' ' 49' ' ' PHE . 4.5 ppp? -84.56 5.18 28.76 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -171.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.465 ' HB3' ' CZ3' ' A' ' 85' ' ' TRP . . . -54.14 131.99 60.02 Favored Pre-proline 0 CA--C 1.564 1.518 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.9 174.89 10.49 Favored 'Trans proline' 0 CA--C 1.565 2.055 0 C-N-CA 123.484 2.789 . . . . 0.0 113.585 172.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.95 124.46 13.58 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.151 1.901 . . . . 0.0 112.446 166.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.09 137.86 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.581 0.752 . . . . 0.0 110.597 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.503 HG13 ' HB3' ' A' ' 101' ' ' SER . 4.5 p -68.44 103.4 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.572 1.812 0 CA-C-O 121.902 0.858 . . . . 0.0 112.066 179.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 86.7 mt -58.41 -40.89 83.67 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 124.845 1.258 . . . . 0.0 112.694 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -78.52 7.04 7.31 Favored 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -175.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.503 ' HB3' HG13 ' A' ' 98' ' ' VAL . 40.9 t -118.42 -25.31 6.55 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 122.952 0.501 . . . . 0.0 111.973 173.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.2 p -69.16 115.21 8.19 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.583 0.353 . . . . 0.0 111.14 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.6 mp0 -64.44 160.8 18.4 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.007 0.523 . . . . 0.0 111.978 175.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.408 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 3.3 tmtp? -66.06 -27.63 68.23 Favored 'General case' 0 CA--C 1.561 1.402 0 CA-C-O 121.191 0.52 . . . . 0.0 109.754 174.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.52 ' HB3' ' HB ' ' A' ' 40' ' ' THR . 45.3 t -60.12 -28.76 68.13 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.248 0.619 . . . . 0.0 111.794 173.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.545 ' HA ' HG23 ' A' ' 41' ' ' VAL . . . -65.2 -44.21 89.08 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 122.813 0.445 . . . . 0.0 111.282 171.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.421 ' HA ' HG22 ' A' ' 110' ' ' VAL . 9.5 mp -64.45 6.19 0.22 Allowed 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 125.463 1.505 . . . . 0.0 113.741 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -95.99 -14.71 22.8 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.475 0.71 . . . . 0.0 110.459 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.403 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 19.7 m-85 -114.39 -41.21 3.49 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.664 1.186 . . . . 0.0 108.469 178.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.521 HG21 HD21 ' A' ' 115' ' ' LEU . 1.7 m -92.99 -168.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.861 0.839 . . . . 0.0 110.739 164.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.3 t -131.01 156.01 45.85 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.949 1.3 . . . . 0.0 107.886 160.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 tt -49.28 -39.21 29.9 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.995 0.518 . . . . 0.0 111.625 170.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.1 77.05 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.206 0.602 . . . . 0.0 112.495 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -68.43 -32.86 73.18 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.792 0.437 . . . . 0.0 111.025 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.532 HD22 ' HE1' ' A' ' 85' ' ' TRP . 29.5 mt -73.26 -55.64 6.16 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.902 -178.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -66.0 -24.31 66.75 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.78 1.232 . . . . 0.0 112.993 -176.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -53.21 -34.27 56.35 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 174.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 69.3 m-70 -115.19 -23.02 9.16 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.365 0.666 . . . . 0.0 112.415 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.256 0 C-N-CA 123.321 0.648 . . . . 0.0 112.157 -179.64 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' A' ' 103' ' ' GLU . 4.9 t . . . . . 0 N--CA 1.484 1.243 0 CA-C-O 120.983 0.42 . . . . 0.0 110.695 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.6 t -138.34 111.89 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 C-N-CA 123.255 0.622 . . . . 0.0 110.353 -178.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 72.2 m -101.42 106.41 17.55 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 171.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.545 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -139.53 147.92 41.9 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.36 0.664 . . . . 0.0 109.689 -175.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -106.61 112.79 25.94 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.461 0.304 . . . . 0.0 111.375 -172.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.576 ' HE2' ' HG2' ' A' ' 84' ' ' ARG . 29.7 mtm -110.0 137.68 47.43 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.044 170.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.1 p -83.7 167.98 16.69 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.602 0.761 . . . . 0.0 111.689 -171.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.416 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 28.4 tt0 -61.12 -30.37 70.33 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.506 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -49.56 -55.33 13.85 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.962 0.905 . . . . 0.0 111.509 174.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -76.22 -37.6 57.53 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.451 HD11 ' HB2' ' A' ' 45' ' ' MET . 10.9 mp -67.41 -33.74 75.8 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 118.351 0.523 . . . . 0.0 111.706 -177.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.416 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 68.6 mt -72.61 -27.88 62.43 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.239 0.616 . . . . 0.0 111.245 170.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -73.83 -34.07 64.41 Favored 'General case' 0 CA--C 1.563 1.47 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 172.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 73.3 m . . . . . 0 N--CA 1.494 1.771 0 C-N-CA 123.312 0.645 . . . . 0.0 112.599 -175.362 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.047 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.79 -1.38 58.09 Favored Glycine 0 N--CA 1.475 1.272 0 CA-C-N 115.704 -0.68 . . . . 0.0 113.883 177.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.03 104.42 6.55 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.184 0.516 . . . . 0.0 111.675 178.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.541 ' HD3' HG11 ' A' ' 98' ' ' VAL . 13.7 ptt180 -81.19 91.65 6.2 Favored 'General case' 0 CA--C 1.557 1.221 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.03 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -168.51 120.88 0.82 Allowed 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.232 0.613 . . . . 0.0 110.271 176.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 48.5 t 51.62 25.23 2.69 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 124.166 0.986 . . . . 0.0 112.648 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.545 HD13 ' HB3' ' A' ' 43' ' ' ALA . 3.4 tm? -66.86 123.4 20.05 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.081 0.952 . . . . 0.0 109.536 -177.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.435 ' SG ' ' HB3' ' A' ' 83' ' ' SER . 42.6 t -59.01 102.35 0.12 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.224 0.609 . . . . 0.0 110.924 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.96 -26.89 62.89 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.922 0.889 . . . . 0.0 112.223 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . 0.435 ' HB3' ' SG ' ' A' ' 81' ' ' CYS . 45.7 t -67.25 -41.46 85.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.566 0.746 . . . . 0.0 111.483 172.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.576 ' HG2' ' HE2' ' A' ' 45' ' ' MET . 56.4 ttm-85 -73.89 -31.62 63.2 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.004 0.522 . . . . 0.0 111.843 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.593 ' HE1' HD22 ' A' ' 115' ' ' LEU . 6.0 t-105 -64.45 -42.1 96.16 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 169.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -58.18 -38.08 76.0 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.708 0.403 . . . . 0.0 110.85 174.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 83' ' ' SER . 41.6 mm-40 -62.18 -39.13 91.66 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.893 0.477 . . . . 0.0 111.774 176.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.53 -41.23 96.51 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.152 0.501 . . . . 0.0 111.393 174.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.721 ' HA ' ' HB1' ' A' ' 94' ' ' ALA . 40.2 t80 -67.41 -42.59 82.99 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.41 -176.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -77.03 -32.24 56.9 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.324 0.649 . . . . 0.0 111.988 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.88 -22.93 62.22 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.028 0.531 . . . . 0.0 111.74 176.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 106.33 -11.01 43.44 Favored Glycine 0 N--CA 1.476 1.328 0 CA-C-O 119.717 -0.491 . . . . 0.0 114.275 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' MET . . . . . 0.414 ' N ' ' SD ' ' A' ' 93' ' ' MET . 1.1 mpt? -66.79 -66.91 0.49 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 117.41 0.605 . . . . 0.0 109.947 176.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.721 ' HB1' ' HA ' ' A' ' 89' ' ' PHE . . . 48.14 87.34 0.13 Allowed Pre-proline 0 CA--C 1.558 1.269 0 C-N-CA 125.135 1.374 . . . . 0.0 114.018 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -64.85 158.22 52.23 Favored 'Trans proline' 0 CA--C 1.566 2.076 0 C-N-CA 123.18 2.586 . . . . 0.0 113.409 172.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -68.29 109.44 2.0 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.362 2.042 . . . . 0.0 112.35 173.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.7 p -95.99 137.01 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 123.672 0.789 . . . . 0.0 110.916 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.541 HG11 ' HD3' ' A' ' 77' ' ' ARG . 5.5 p -77.34 107.77 9.4 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.741 0 C-N-CA 123.953 0.901 . . . . 0.0 113.076 -174.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 98.6 mt -67.79 -36.81 81.1 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.823 0.849 . . . . 0.0 112.52 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -78.43 20.51 0.41 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.624 0.77 . . . . 0.0 112.769 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.0 t -142.79 -44.23 0.31 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.688 0.795 . . . . 0.0 111.324 175.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.7 m -56.88 121.49 10.02 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 123.862 0.865 . . . . 0.0 112.737 -173.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' THR . 1.9 mp0 -74.14 166.8 22.79 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.034 0.933 . . . . 0.0 113.071 -173.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -68.59 -13.42 62.33 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.101 0.96 . . . . 0.0 113.034 -177.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.5 t -57.35 -48.68 78.38 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 122.971 0.509 . . . . 0.0 110.613 172.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.58 -32.49 63.09 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.536 0.734 . . . . 0.0 112.82 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.469 ' HG ' ' HB2' ' A' ' 112' ' ' LEU . 8.6 mp -66.16 -22.81 66.38 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.007 0.523 . . . . 0.0 112.371 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.2 mtt85 -89.32 -7.49 55.23 Favored 'General case' 0 CA--C 1.561 1.393 0 C-N-CA 123.686 0.794 . . . . 0.0 112.78 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -117.9 -57.97 2.05 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 123.331 0.652 . . . . 0.0 112.057 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.437 HG23 ' CD1' ' A' ' 85' ' ' TRP . 13.3 p -98.66 -25.75 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 C-N-CA 123.589 0.756 . . . . 0.0 111.767 -176.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 46.8 t 77.58 149.46 0.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 125.689 1.596 . . . . 0.0 112.394 -173.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.546 ' HA ' HD13 ' A' ' 115' ' ' LEU . 4.6 tt -61.31 -37.12 82.08 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.713 1.205 . . . . 0.0 113.021 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.47 -34.8 76.08 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -173.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.35 -34.0 72.12 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.103 0.961 . . . . 0.0 111.481 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.593 HD22 ' HE1' ' A' ' 85' ' ' TRP . 57.4 mt -69.15 -48.01 63.45 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 121.943 0.877 . . . . 0.0 110.434 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -70.26 -37.87 74.99 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.848 -175.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -57.69 -16.74 11.79 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -132.35 39.12 3.42 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.392 0.677 . . . . 0.0 111.56 173.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.193 0 C-N-CA 123.175 0.59 . . . . 0.0 111.294 170.471 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.8 p . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 121.462 0.649 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.564 HG12 ' HB1' ' A' ' 82' ' ' ALA . 18.6 t -127.23 127.81 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.686 0.794 . . . . 0.0 109.954 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 78' ' ' TRP . 93.6 m -136.39 108.86 7.38 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 168.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.591 ' HB1' HD12 ' A' ' 80' ' ' LEU . . . -140.43 150.77 44.25 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.123 0.969 . . . . 0.0 109.22 -170.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.468 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 20.2 tt0 -114.76 124.5 51.94 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.984 0.421 . . . . 0.0 111.812 -177.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.466 ' HE3' ' HG2' ' A' ' 95' ' ' PRO . 67.1 mmm -108.21 138.46 44.45 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.079 0.951 . . . . 0.0 109.775 175.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 7.0 t -85.5 156.44 20.78 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.865 0.466 . . . . 0.0 110.398 174.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.538 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 37.6 tt0 -61.25 -29.29 69.75 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.065 0.546 . . . . 0.0 111.624 -175.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -48.3 -45.92 35.54 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 124.327 1.051 . . . . 0.0 111.845 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -76.93 -39.96 48.85 Favored 'General case' 0 CA--C 1.558 1.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.274 174.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.28 -26.1 68.34 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.538 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 95.9 mt -74.27 -47.47 34.72 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.691 0.796 . . . . 0.0 109.763 172.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -58.4 -31.77 68.01 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.642 0.777 . . . . 0.0 111.9 174.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.488 1.465 0 C-N-CA 123.535 0.734 . . . . 0.0 110.857 177.307 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.78 0 CA-C-O 120.332 0.111 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 109.86 -10.46 32.14 Favored Glycine 0 N--CA 1.477 1.429 0 CA-C-N 116.743 -0.208 . . . . 0.0 113.521 -174.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -85.61 83.98 7.73 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.306 0.642 . . . . 0.0 111.211 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.468 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -85.04 86.28 7.4 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-O 121.236 0.541 . . . . 0.0 111.57 179.592 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.41 ' HA ' ' SG ' ' A' ' 42' ' ' CYS . 42.3 t90 179.32 122.62 0.05 Allowed 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.916 0.886 . . . . 0.0 109.449 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 84.9 m 57.9 25.81 12.56 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 124.138 0.975 . . . . 0.0 113.209 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.591 HD12 ' HB1' ' A' ' 43' ' ' ALA . 2.8 tm? -66.38 124.16 21.97 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.389 0.676 . . . . 0.0 109.423 175.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 59.0 m -61.39 105.68 0.54 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.309 0.644 . . . . 0.0 109.506 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.564 ' HB1' HG12 ' A' ' 41' ' ' VAL . . . -59.22 -23.63 62.47 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -169.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.9 m -63.77 -30.19 71.31 Favored 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 123.325 0.65 . . . . 0.0 112.347 175.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -57.3 -47.43 81.5 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 124.304 1.041 . . . . 0.0 110.291 171.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.668 ' HE1' HD22 ' A' ' 115' ' ' LEU . 13.5 t-105 -71.74 -41.26 68.68 Favored 'General case' 0 CA--C 1.565 1.532 0 CA-C-N 114.325 -1.307 . . . . 0.0 111.964 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -63.4 -48.08 79.32 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.959 0.904 . . . . 0.0 111.114 -177.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.73 -28.59 67.77 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.348 0.659 . . . . 0.0 111.57 178.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.55 -41.06 96.57 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.208 0.603 . . . . 0.0 111.67 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.74 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 84.9 t80 -67.09 -48.36 68.41 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.977 176.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.28 -25.19 67.94 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.67 0.788 . . . . 0.0 112.354 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.55 -22.62 50.76 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.639 0.775 . . . . 0.0 111.78 175.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.92 -4.74 42.12 Favored Glycine 0 C--N 1.351 1.402 0 N-CA-C 114.259 0.464 . . . . 0.0 114.259 176.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' MET . . . . . 0.443 ' N ' ' SD ' ' A' ' 93' ' ' MET . 1.5 mpt? -84.57 -73.62 0.42 Allowed 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 117.314 0.557 . . . . 0.0 109.963 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.74 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 58.07 95.17 0.05 OUTLIER Pre-proline 0 CA--C 1.565 1.541 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 178.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.466 ' HG2' ' HE3' ' A' ' 45' ' ' MET . 86.6 Cg_exo -55.62 161.58 7.6 Favored 'Trans proline' 0 CA--C 1.564 1.981 0 C-N-CA 123.748 2.965 . . . . 0.0 114.972 169.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.01 117.42 5.09 Favored 'Trans proline' 0 C--N 1.372 1.795 0 C-N-CA 122.332 2.021 . . . . 0.0 111.759 169.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.473 HG11 ' HA ' ' A' ' 115' ' ' LEU . 14.2 p -99.68 159.71 3.54 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 123.691 0.796 . . . . 0.0 110.609 -177.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 m -92.67 99.98 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 124.215 1.006 . . . . 0.0 112.346 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.588 HD13 ' HG2' ' A' ' 116' ' ' GLN . 4.7 mt -74.23 -16.81 60.95 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.305 -0.872 . . . . 0.0 111.717 170.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -74.42 -12.31 60.47 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 123.817 0.847 . . . . 0.0 112.205 174.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.9 t -128.37 -40.53 1.61 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.016 0.526 . . . . 0.0 112.079 -175.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 55.0 p -55.34 99.3 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 CA-C-O 121.172 0.51 . . . . 0.0 111.838 171.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.51 ' HG3' ' H ' ' A' ' 105' ' ' SER . 12.7 tp10 -66.17 154.6 39.3 Favored 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 123.937 0.895 . . . . 0.0 110.781 172.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -56.54 -23.27 38.82 Favored 'General case' 0 CA--C 1.565 1.525 0 C-N-CA 124.237 1.015 . . . . 0.0 112.055 177.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.51 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 25.1 m -58.2 -27.66 64.1 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.99 0.916 . . . . 0.0 112.649 176.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.522 ' HA ' HG22 ' A' ' 41' ' ' VAL . . . -61.78 -23.43 66.18 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.229 1.012 . . . . 0.0 113.045 178.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.416 HD21 ' HB2' ' A' ' 112' ' ' LEU . 9.6 mp -67.37 -3.7 8.97 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -178.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -70.88 -33.38 70.54 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 122.059 -0.401 . . . . 0.0 111.533 167.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.529 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 49.5 m-85 -112.43 -23.43 10.32 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.054 0.942 . . . . 0.0 111.582 -171.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.461 HG21 ' H ' ' A' ' 111' ' ' SER . 4.9 p -129.69 -178.43 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.456 0 C-N-CA 123.832 0.853 . . . . 0.0 109.613 177.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' SER . . . . . 0.461 ' H ' HG21 ' A' ' 110' ' ' VAL . 27.2 p -109.89 164.2 12.81 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.494 -0.754 . . . . 0.0 110.739 170.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.416 ' HB2' HD21 ' A' ' 107' ' ' LEU . 4.6 tt -66.02 -39.45 90.23 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.433 0.693 . . . . 0.0 111.075 171.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.5 -33.83 74.46 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.437 0.695 . . . . 0.0 112.282 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.93 -50.22 73.27 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.269 0.628 . . . . 0.0 111.074 169.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.668 HD22 ' HE1' ' A' ' 85' ' ' TRP . 20.2 mt -65.8 -48.77 70.62 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.077 -172.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . 0.588 ' HG2' HD13 ' A' ' 99' ' ' LEU . 7.0 mt-30 -71.49 -26.81 62.84 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.1 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -61.35 -35.76 78.32 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 173.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -126.47 27.71 6.1 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.338 0.655 . . . . 0.0 112.215 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.232 0 C-N-CA 124.157 0.983 . . . . 0.0 110.643 172.258 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 26.1 p . . . . . 0 N--CA 1.499 1.987 0 CA-C-O 121.533 0.683 . . . . 0.0 111.778 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.6 t -136.8 107.45 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 C-N-CA 124.659 1.184 . . . . 0.0 109.102 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 93.5 m -113.28 110.72 20.84 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.702 -0.624 . . . . 0.0 111.271 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.523 ' HB1' HD12 ' A' ' 80' ' ' LEU . . . -139.12 149.9 45.04 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.934 1.294 . . . . 0.0 108.392 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.607 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 22.1 tt0 -121.53 114.88 21.84 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.139 0.495 . . . . 0.0 111.447 -178.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.449 ' HB2' HD11 ' A' ' 50' ' ' LEU . 72.2 mmm -89.0 142.82 27.31 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.216 1.006 . . . . 0.0 111.205 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 51.9 p -86.58 151.3 23.57 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.059 0.544 . . . . 0.0 109.641 178.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -54.87 -33.49 61.93 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 123.218 0.607 . . . . 0.0 112.465 -174.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -49.12 -46.95 45.71 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 125.231 1.412 . . . . 0.0 111.911 174.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -77.89 -33.99 51.7 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.449 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.2 mp -71.25 -31.79 67.95 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 120.869 0.366 . . . . 0.0 110.448 174.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 48.7 mt -75.54 -29.9 59.56 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.028 0.931 . . . . 0.0 111.52 174.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -65.03 -49.28 70.77 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.3 t . . . . . 0 N--CA 1.492 1.629 0 C-N-CA 123.563 0.745 . . . . 0.0 110.805 175.985 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.924 0 CA-C-O 120.661 0.267 . . . . 0.0 111.558 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.49 22.31 14.73 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 114.164 0.425 . . . . 0.0 114.164 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -114.45 96.22 5.65 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.199 0.599 . . . . 0.0 110.129 169.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.607 ' HB2' ' HB2' ' A' ' 44' ' ' GLU . 56.2 ttp180 -92.26 85.8 5.54 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 174.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 6.7 m-90 -167.4 119.48 0.91 Allowed 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 124.195 0.998 . . . . 0.0 109.071 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 31.1 p 44.93 33.76 1.08 Allowed 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.651 1.18 . . . . 0.0 113.143 175.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.523 HD12 ' HB1' ' A' ' 43' ' ' ALA . 3.0 tm? -63.28 118.08 7.51 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.161 0.984 . . . . 0.0 110.117 -176.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 41.4 t -53.1 119.22 4.45 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.593 0.757 . . . . 0.0 110.552 175.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.66 -31.59 26.17 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.834 0.853 . . . . 0.0 112.848 -174.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 73.1 m -57.27 -36.89 71.57 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 176.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.423 ' HG2' HD21 ' A' ' 80' ' ' LEU . 11.3 tpp180 -59.83 -53.35 58.94 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.194 0.597 . . . . 0.0 111.83 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.527 ' CD1' HG23 ' A' ' 110' ' ' VAL . 2.8 t-105 -75.26 -51.51 13.11 Favored 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 123.597 0.759 . . . . 0.0 111.007 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.568 ' HB2' HG21 ' A' ' 110' ' ' VAL . 47.0 tp60 -61.65 -42.25 98.64 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.603 0.761 . . . . 0.0 112.928 -172.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -69.86 -30.37 67.82 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 117.706 0.23 . . . . 0.0 111.594 -178.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.99 -34.85 78.41 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 122.92 0.488 . . . . 0.0 110.755 170.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.638 ' HA ' ' HB1' ' A' ' 94' ' ' ALA . 80.6 t80 -72.55 -43.49 63.39 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.998 0.919 . . . . 0.0 111.462 176.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 86' ' ' GLN . 49.8 mt-10 -66.52 -38.27 86.84 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.858 0.863 . . . . 0.0 111.404 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.13 -20.41 62.32 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.751 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 122.94 -20.87 7.57 Favored Glycine 0 C--N 1.357 1.738 0 N-CA-C 115.179 0.831 . . . . 0.0 115.179 170.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -81.76 -79.97 0.16 Allowed 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 117.721 0.761 . . . . 0.0 111.751 -171.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.638 ' HB1' ' HA ' ' A' ' 89' ' ' PHE . . . 65.91 124.51 0.03 OUTLIER Pre-proline 0 N--CA 1.499 1.999 0 C-N-CA 125.022 1.329 . . . . 0.0 114.409 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -77.39 172.08 16.55 Favored 'Trans proline' 0 CA--C 1.567 2.14 0 C-N-CA 122.959 2.439 . . . . 0.0 113.011 172.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.35 108.27 2.16 Favored 'Trans proline' 0 CA--C 1.565 2.058 0 C-N-CA 122.106 1.87 . . . . 0.0 112.324 169.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.6 p -96.65 151.14 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 123.576 0.75 . . . . 0.0 110.633 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.586 HG23 ' HB3' ' A' ' 101' ' ' SER . 19.2 m -75.84 162.75 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 CA-C-O 121.559 0.695 . . . . 0.0 111.637 173.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 96.3 mt -118.9 -9.42 10.1 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.782 0.833 . . . . 0.0 110.631 168.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -87.15 -47.57 8.77 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.95 0.9 . . . . 0.0 110.341 -171.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.586 ' HB3' HG23 ' A' ' 98' ' ' VAL . 42.3 t -85.71 -32.48 21.9 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.969 179.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 19.4 m -59.61 114.6 2.81 Favored 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 122.657 0.383 . . . . 0.0 111.64 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -79.34 168.24 19.78 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.552 0.741 . . . . 0.0 112.864 -173.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -67.96 -25.23 65.34 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.998 0.919 . . . . 0.0 112.146 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 43.7 t -62.4 -32.98 73.89 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 122.664 0.386 . . . . 0.0 111.633 177.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.16 -34.89 70.79 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.707 0.803 . . . . 0.0 112.057 174.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.631 ' HG ' ' HB2' ' A' ' 112' ' ' LEU . 6.9 mp -64.57 -10.26 24.9 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.937 0.895 . . . . 0.0 113.388 -175.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 65.0 mtp85 -94.78 -28.5 15.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.494 0.717 . . . . 0.0 111.927 173.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -96.47 -53.81 3.47 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.145 0.578 . . . . 0.0 111.148 -173.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.568 HG21 ' HB2' ' A' ' 86' ' ' GLN . 14.0 p -100.13 -24.06 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 C-N-CA 123.91 0.884 . . . . 0.0 111.567 -178.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 43.4 t 69.53 147.32 0.06 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.102 1.361 . . . . 0.0 112.636 -173.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.631 ' HB2' ' HG ' ' A' ' 107' ' ' LEU . 5.8 tt -61.23 -40.78 95.28 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.168 178.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.17 -38.81 84.33 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.138 0.575 . . . . 0.0 112.127 -172.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -69.12 -33.19 73.07 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.524 0.729 . . . . 0.0 111.036 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.493 HD21 ' HE1' ' A' ' 85' ' ' TRP . 39.9 mt -66.03 -55.82 14.72 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 121.95 0.881 . . . . 0.0 109.916 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -68.55 -24.77 64.67 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 113.896 -1.502 . . . . 0.0 113.146 -173.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.53 -23.36 64.52 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 113.151 0.796 . . . . 0.0 113.151 175.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 11.1 m80 -116.53 -16.56 10.77 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 123.303 0.641 . . . . 0.0 112.57 174.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.222 0 C-N-CA 122.659 0.384 . . . . 0.0 110.419 170.455 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.488 HG22 ' HG2' ' A' ' 103' ' ' GLU . 3.5 t . . . . . 0 N--CA 1.486 1.34 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.725 HG21 ' HB1' ' A' ' 82' ' ' ALA . 40.1 t -120.89 111.27 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 123.189 0.596 . . . . 0.0 110.329 -175.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 82.5 m -105.97 107.54 18.6 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.564 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -142.6 151.31 41.38 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.911 0.884 . . . . 0.0 109.272 -176.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -126.95 115.3 19.05 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 122.458 0.303 . . . . 0.0 110.244 -173.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.459 ' HE1' ' HE3' ' A' ' 85' ' ' TRP . 63.9 mmm -98.91 152.77 19.4 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.217 0.607 . . . . 0.0 111.671 -174.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.659 HG21 ' HB3' ' A' ' 95' ' ' PRO . 6.8 t -89.11 157.48 18.29 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.468 0.707 . . . . 0.0 110.635 175.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 61.2 tt0 -53.57 -32.18 49.8 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.897 0.879 . . . . 0.0 112.419 -177.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -51.4 -44.88 62.32 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.143 0.977 . . . . 0.0 111.456 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -74.31 -47.42 34.77 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 177.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -65.28 -32.88 74.76 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.294 0.497 . . . . 0.0 111.543 -174.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.6 mt -76.63 -31.85 57.65 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.118 0.567 . . . . 0.0 112.139 173.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -57.62 -48.77 78.53 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 123.053 0.541 . . . . 0.0 110.666 171.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 CA--C 1.55 0.951 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.601 -179.514 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.201 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 79.23 35.99 28.6 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-N 115.085 -0.961 . . . . 0.0 113.347 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -118.31 98.9 6.52 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.506 0.723 . . . . 0.0 111.216 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -76.74 87.39 3.36 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 166.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -175.39 127.17 0.26 Allowed 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.944 -173.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 39.4 t 59.12 16.09 4.56 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.859 1.264 . . . . 0.0 113.776 171.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.564 HD13 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -75.05 108.83 8.04 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -175.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 62.2 m -65.1 135.31 55.37 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.449 0.7 . . . . 0.0 111.14 178.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.725 ' HB1' HG21 ' A' ' 41' ' ' VAL . . . -51.32 -49.37 61.48 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.187 0.995 . . . . 0.0 113.31 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.6 m -57.3 -29.52 63.98 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.931 0.892 . . . . 0.0 112.943 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -70.06 -51.55 31.03 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.431 0.692 . . . . 0.0 110.767 -177.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.459 ' HE3' ' HE1' ' A' ' 45' ' ' MET . 3.8 t-105 -62.93 -41.32 99.45 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 123.665 0.786 . . . . 0.0 110.802 172.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -41.77 86.18 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.374 1.069 . . . . 0.0 111.997 -176.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -62.43 -37.33 85.43 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.722 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.7 -39.01 89.94 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.285 0.634 . . . . 0.0 111.65 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.588 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 75.4 t80 -68.23 -51.82 41.05 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.1 0.56 . . . . 0.0 111.23 175.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.86 -19.15 65.68 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.438 0.695 . . . . 0.0 112.42 -174.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.85 -26.97 21.35 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 123.153 0.581 . . . . 0.0 111.529 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 129.18 -21.76 5.15 Favored Glycine 0 N--CA 1.482 1.751 0 N-CA-C 115.697 1.039 . . . . 0.0 115.697 171.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -72.42 -67.89 0.51 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 118.17 0.985 . . . . 0.0 111.456 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.588 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 54.87 81.07 0.27 Allowed Pre-proline 0 CA--C 1.564 1.496 0 C-N-CA 124.641 1.176 . . . . 0.0 113.139 -177.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.659 ' HB3' HG21 ' A' ' 46' ' ' THR . 93.9 Cg_exo -53.4 163.95 2.26 Favored 'Trans proline' 0 N--CA 1.504 2.105 0 C-N-CA 124.352 3.368 . . . . 0.0 115.804 173.418 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -63.86 103.53 0.42 Allowed 'Trans proline' 0 C--N 1.384 2.429 0 C-N-CA 122.927 2.418 . . . . 0.0 112.667 174.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.6 p -94.26 138.01 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 123.299 0.64 . . . . 0.0 109.949 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 7.5 p -79.13 89.11 1.3 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-O 121.852 0.834 . . . . 0.0 112.862 -171.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -60.65 -34.37 74.2 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 124.628 1.171 . . . . 0.0 113.544 -177.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -71.33 -12.24 61.33 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 179.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 50.4 m -128.54 -7.11 5.18 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.248 0.619 . . . . 0.0 112.576 -176.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 99.5 m -72.62 120.96 18.97 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 122.552 0.341 . . . . 0.0 110.156 175.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.544 ' HG3' ' H ' ' A' ' 105' ' ' SER . 13.8 tp10 -64.55 149.71 48.21 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 123.131 0.572 . . . . 0.0 111.587 178.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -68.0 -34.18 76.02 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.369 0.667 . . . . 0.0 110.865 177.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.544 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 84.9 p -61.96 -23.86 66.64 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 122.902 0.481 . . . . 0.0 111.987 175.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.02 -36.06 74.33 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.044 0.538 . . . . 0.0 112.356 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.1 mp -55.73 -13.7 1.85 Allowed 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 124.978 1.311 . . . . 0.0 113.431 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -61.95 -34.48 76.2 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.422 1.089 . . . . 0.0 112.376 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -109.76 -21.82 12.21 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.578 1.151 . . . . 0.0 110.247 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.447 HG11 HD23 ' A' ' 115' ' ' LEU . 48.7 t -109.67 -51.67 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 CA-C-N 114.048 -1.433 . . . . 0.0 112.715 -159.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 26.6 m 71.26 140.86 0.05 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 125.746 1.618 . . . . 0.0 112.79 -168.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.42 -39.8 92.1 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.274 1.03 . . . . 0.0 113.372 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.6 -32.5 70.45 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.86 0.464 . . . . 0.0 111.73 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.89 -36.95 85.01 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 124.382 1.073 . . . . 0.0 111.185 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.447 HD23 HG11 ' A' ' 110' ' ' VAL . 71.5 mt -75.0 -51.58 13.24 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.637 1.175 . . . . 0.0 110.874 -177.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -70.78 -23.06 62.33 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 114.4 -1.273 . . . . 0.0 112.321 -175.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -50.07 -28.68 7.5 Favored 'General case' 0 CA--C 1.562 1.412 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 171.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -128.73 22.63 5.85 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.507 0.723 . . . . 0.0 112.261 175.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.314 0 C-N-CA 123.239 0.615 . . . . 0.0 110.577 174.0 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.401 ' O ' ' HB3' ' A' ' 105' ' ' SER . 65.8 p . . . . . 0 CA--C 1.559 1.3 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.497 HG13 ' HB1' ' A' ' 82' ' ' ALA . 46.5 t -137.89 117.96 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.746 -0.596 . . . . 0.0 111.126 176.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 57.8 m -116.74 108.22 15.62 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 168.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.654 ' HB2' HD13 ' A' ' 80' ' ' LEU . . . -137.69 148.23 45.52 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -176.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.51 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 28.0 tt0 -115.49 116.56 28.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.843 0.354 . . . . 0.0 111.77 -171.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 52.5 mmm -103.5 123.41 46.85 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.272 175.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 79.3 p -81.39 167.04 19.87 Favored 'General case' 0 C--O 1.246 0.895 0 C-N-CA 123.13 0.572 . . . . 0.0 110.549 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -58.03 -29.57 65.45 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.382 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -49.64 -56.13 11.17 Favored 'General case' 0 CA--C 1.567 1.622 0 C-N-CA 124.826 1.25 . . . . 0.0 112.377 177.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -70.55 -38.81 74.21 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 176.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.9 mp -66.34 -25.09 66.66 Favored 'General case' 0 CA--C 1.566 1.569 0 O-C-N 122.129 -0.357 . . . . 0.0 111.481 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 39.3 mt -75.13 -35.44 61.68 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.227 1.011 . . . . 0.0 110.555 172.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -60.64 -51.34 69.81 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.95 0.5 . . . . 0.0 110.286 171.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.9 m . . . . . 0 N--CA 1.483 1.191 0 C-N-CA 124.193 0.997 . . . . 0.0 111.646 177.084 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.827 0 CA-C-O 120.945 0.402 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 108.27 27.66 4.95 Favored Glycine 0 CA--C 1.535 1.333 0 CA-C-N 115.814 -0.63 . . . . 0.0 113.581 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -105.47 111.18 23.79 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.186 0.594 . . . . 0.0 111.237 171.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.51 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 11.9 ptt85 -83.1 88.05 6.9 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 165.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.4 t-105 -172.46 121.1 0.42 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.289 -173.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 43.4 t 54.56 19.24 2.32 Favored 'General case' 0 N--CA 1.499 1.978 0 C-N-CA 124.702 1.201 . . . . 0.0 113.708 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.654 HD13 ' HB2' ' A' ' 43' ' ' ALA . 3.1 tm? -71.4 124.11 23.85 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.36 0.664 . . . . 0.0 109.772 -175.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 52.0 t -62.14 110.5 1.62 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.177 0.591 . . . . 0.0 110.162 174.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.497 ' HB1' HG13 ' A' ' 41' ' ' VAL . . . -57.22 -26.7 61.13 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 113.885 1.069 . . . . 0.0 113.885 -171.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 78.6 p -68.64 -30.47 69.19 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.132 0.573 . . . . 0.0 112.228 176.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -72.85 -31.36 64.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.576 0.75 . . . . 0.0 111.027 175.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.532 ' HD1' HG11 ' A' ' 110' ' ' VAL . 8.8 t-105 -67.29 -53.97 24.99 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.259 0.624 . . . . 0.0 110.114 171.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.413 HE21 ' HG3' ' A' ' 90' ' ' GLU . 18.2 tp60 -56.88 -34.97 68.39 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.865 0.866 . . . . 0.0 112.263 177.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -52.41 -39.02 60.44 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.674 0.79 . . . . 0.0 111.826 175.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.06 -36.31 81.75 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.443 0.697 . . . . 0.0 112.727 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -67.42 -46.46 73.1 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 120.913 0.387 . . . . 0.0 110.391 173.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.413 ' HG3' HE21 ' A' ' 86' ' ' GLN . 42.1 mt-10 -66.2 -19.62 65.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.834 0.854 . . . . 0.0 111.827 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.08 -25.77 31.73 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.208 1.003 . . . . 0.0 111.708 171.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 111.17 -12.88 28.8 Favored Glycine 0 CA--C 1.537 1.465 0 CA-C-N 116.235 -0.439 . . . . 0.0 114.052 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 58.8 mtp -89.17 -81.61 0.27 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.725 0.81 . . . . 0.0 111.659 -174.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 59.86 99.5 0.04 OUTLIER Pre-proline 0 CA--C 1.564 1.505 0 C-N-CA 125.184 1.394 . . . . 0.0 114.226 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -57.18 166.47 4.26 Favored 'Trans proline' 0 CA--C 1.567 2.172 0 C-N-CA 124.098 3.199 . . . . 0.0 114.655 171.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.58 129.27 20.81 Favored 'Trans proline' 0 CA--C 1.567 2.144 0 C-N-CA 122.168 1.912 . . . . 0.0 112.996 171.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.8 p -116.61 151.39 18.42 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.158 0 C-N-CA 123.945 0.898 . . . . 0.0 111.096 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.6 m -88.33 97.61 6.94 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 124.262 1.025 . . . . 0.0 113.5 -171.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 22.8 mt -59.97 -24.33 64.33 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.134 -0.979 . . . . 0.0 112.305 172.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -67.81 -32.38 72.89 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 124.144 0.977 . . . . 0.0 112.738 178.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.8 t -115.4 -45.69 2.91 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -174.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.1 m -48.12 112.75 0.62 Allowed 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 123.571 0.748 . . . . 0.0 112.398 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -83.5 175.42 9.81 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -169.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.622 ' HA ' HD11 ' A' ' 107' ' ' LEU . 14.7 mmmm -67.76 -21.09 65.28 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 124.043 0.937 . . . . 0.0 113.197 -175.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.401 ' HB3' ' O ' ' A' ' 40' ' ' THR . 31.3 t -68.54 -29.72 68.36 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 176.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.2 -31.19 70.95 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.05 0.54 . . . . 0.0 112.453 176.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.622 HD11 ' HA ' ' A' ' 104' ' ' LYS . 8.1 mp -61.38 -28.03 68.95 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 124.019 0.928 . . . . 0.0 111.935 176.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -74.5 -5.78 44.66 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.889 0.876 . . . . 0.0 112.624 -177.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -120.92 -45.67 2.37 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.031 0.932 . . . . 0.0 110.721 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.532 HG11 ' HD1' ' A' ' 85' ' ' TRP . 0.6 OUTLIER -103.6 -35.38 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 C-N-CA 122.917 0.487 . . . . 0.0 111.9 -172.777 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.3 t 77.05 134.68 0.06 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.616 1.567 . . . . 0.0 110.849 -166.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 tt -44.93 -28.16 0.63 Allowed 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 124.734 1.214 . . . . 0.0 113.827 -177.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.73 -37.26 70.74 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.613 0.765 . . . . 0.0 113.0 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -72.85 -40.98 65.25 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 120.891 0.377 . . . . 0.0 110.813 177.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.506 HD21 ' HE1' ' A' ' 85' ' ' TRP . 67.7 mt -57.6 -46.46 84.03 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.601 0.76 . . . . 0.0 111.74 177.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -76.06 -34.35 59.59 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.699 0.8 . . . . 0.0 112.409 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -57.72 -28.05 63.52 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.174 0.589 . . . . 0.0 112.435 173.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -126.48 26.62 6.31 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.789 0.836 . . . . 0.0 111.938 -177.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.025 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.055 172.207 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.87 0.367 . . . . 0.0 111.076 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.5 t -129.85 101.4 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 123.65 0.78 . . . . 0.0 109.311 176.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 75.5 m -96.96 105.68 17.87 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.641 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -138.58 137.31 36.87 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.82 0.848 . . . . 0.0 108.954 -177.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.482 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 14.4 tt0 -117.78 108.83 15.84 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.124 0.487 . . . . 0.0 110.977 -168.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.497 ' HB2' HD11 ' A' ' 50' ' ' LEU . 59.3 mmm -91.55 132.6 36.18 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.817 0.847 . . . . 0.0 109.359 -179.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.653 HG21 ' HB3' ' A' ' 95' ' ' PRO . 8.0 t -80.12 155.29 27.56 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 175.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.454 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 37.1 tt0 -51.83 -31.23 26.66 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 118.902 -0.571 . . . . 0.0 112.291 -174.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -49.86 -43.79 49.3 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.802 0.841 . . . . 0.0 112.427 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -71.57 -38.21 70.96 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.593 0.357 . . . . 0.0 111.804 175.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.0 mp -71.04 -21.54 62.25 Favored 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 122.491 0.317 . . . . 0.0 111.742 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 47' ' ' GLU . 90.4 mt -72.72 -31.61 65.11 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 124.177 0.991 . . . . 0.0 109.565 169.734 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -74.86 -31.42 61.63 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 123.49 0.716 . . . . 0.0 111.465 168.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.9 m . . . . . 0 N--CA 1.488 1.468 0 C-N-CA 123.387 0.675 . . . . 0.0 111.781 -179.298 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.096 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 77.01 28.59 58.38 Favored Glycine 0 C--N 1.349 1.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 113.971 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -131.51 102.94 6.14 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 123.601 0.761 . . . . 0.0 110.905 178.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.482 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 11.5 ptt180 -85.57 88.88 7.58 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.881 0.848 . . . . 0.0 111.905 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -160.05 119.73 2.86 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.144 0.977 . . . . 0.0 109.353 -177.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 85.9 m 57.98 20.65 6.97 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.157 0.983 . . . . 0.0 113.179 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.641 HD13 ' HB3' ' A' ' 43' ' ' ALA . 3.5 tm? -68.02 115.97 8.12 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 48.4 m -63.32 114.79 4.04 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 123.649 0.593 . . . . 0.0 109.434 177.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.553 ' HB2' HG11 ' A' ' 110' ' ' VAL . . . -51.83 -35.51 44.75 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.822 0.849 . . . . 0.0 112.695 -176.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.7 m -57.55 -34.95 69.69 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.855 0.862 . . . . 0.0 112.688 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -74.69 -29.5 61.24 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 177.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -67.83 -51.74 44.93 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 169.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.717 ' HB2' HG12 ' A' ' 110' ' ' VAL . 13.3 tp60 -49.9 -35.6 24.25 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.891 0.876 . . . . 0.0 112.79 171.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -56.02 -44.01 78.32 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.934 0.894 . . . . 0.0 111.974 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.72 83.57 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.917 0.887 . . . . 0.0 113.095 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.37 -47.08 87.5 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.313 0.577 . . . . 0.0 110.69 173.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -69.49 -28.39 66.02 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.123 0.969 . . . . 0.0 112.114 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.7 -25.79 49.66 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.279 0.632 . . . . 0.0 111.308 174.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.76 29.82 25.43 Favored Glycine 0 CA--C 1.537 1.444 0 CA-C-N 116.101 -0.499 . . . . 0.0 113.822 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 23.1 ptm -139.6 25.26 2.4 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.209 0.604 . . . . 0.0 111.83 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -40.13 112.6 0.85 Allowed Pre-proline 0 CA--C 1.572 1.802 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 177.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.653 ' HB3' HG21 ' A' ' 46' ' ' THR . 54.3 Cg_exo -60.48 161.61 20.08 Favored 'Trans proline' 0 C--N 1.382 2.296 0 C-N-CA 123.745 2.963 . . . . 0.0 114.157 168.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -73.83 115.1 4.21 Favored 'Trans proline' 0 C--N 1.374 1.9 0 C-N-CA 122.138 1.892 . . . . 0.0 111.237 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 9.0 p -97.17 164.55 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-O 121.394 0.616 . . . . 0.0 109.846 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p -107.86 96.9 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.325 0 C-N-CA 123.882 0.873 . . . . 0.0 110.448 -178.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 25.6 mt -52.27 -41.17 62.63 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 124.248 1.019 . . . . 0.0 113.165 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -74.14 -1.27 19.57 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -176.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.8 t -122.5 -26.18 4.62 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.516 0.726 . . . . 0.0 111.154 172.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 30.4 m -76.3 104.07 6.64 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.19 0.596 . . . . 0.0 109.922 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -65.8 152.32 44.63 Favored 'General case' 0 CA--C 1.564 1.518 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.612 -175.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.16 -14.58 56.05 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 125.155 1.382 . . . . 0.0 112.551 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 54.9 m -55.82 -31.14 62.42 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.996 0.918 . . . . 0.0 111.259 169.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.403 ' O ' HG21 ' A' ' 110' ' ' VAL . . . -56.32 -41.24 75.68 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.741 0.817 . . . . 0.0 112.004 175.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.7 -13.81 6.91 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 124.216 1.006 . . . . 0.0 113.502 -177.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -86.62 -8.7 57.25 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.469 0.708 . . . . 0.0 111.483 -179.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.533 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 44.8 m-85 -123.24 -45.41 2.1 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.826 1.251 . . . . 0.0 109.306 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.717 HG12 ' HB2' ' A' ' 86' ' ' GLN . 13.9 m -85.81 -167.81 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 CA-C-O 122.135 0.969 . . . . 0.0 111.608 167.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 43.9 t -115.03 150.85 35.23 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 114.323 -1.308 . . . . 0.0 108.713 156.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.1 tt -48.69 -39.28 23.91 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.079 0.552 . . . . 0.0 111.629 173.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.93 -31.49 65.0 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.15 0.98 . . . . 0.0 113.248 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -64.4 -46.05 85.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.043 0.537 . . . . 0.0 111.058 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.63 HD23 HG22 ' A' ' 110' ' ' VAL . 8.1 mt -66.17 -48.85 69.39 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.815 0.817 . . . . 0.0 109.83 -175.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -74.04 -24.84 59.6 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.26 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.95 -34.05 62.9 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 123.62 0.768 . . . . 0.0 112.704 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.28 33.62 3.06 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.1 0.56 . . . . 0.0 111.546 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.959 0 C-N-CA 123.227 0.611 . . . . 0.0 110.147 171.871 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.044 0.449 . . . . 0.0 111.459 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.547 HG13 ' HB1' ' A' ' 82' ' ' ALA . 40.9 t -128.13 120.51 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 169.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 81.5 m -116.61 109.14 16.83 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-O 121.192 0.52 . . . . 0.0 109.86 173.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.617 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -132.06 150.38 52.17 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.332 1.053 . . . . 0.0 108.512 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -117.58 109.18 16.37 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.968 0.413 . . . . 0.0 110.236 -176.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.566 ' HE1' ' HE3' ' A' ' 85' ' ' TRP . 60.5 mmm -84.97 131.42 34.48 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.481 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 5.4 t -81.95 153.71 26.13 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 174.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -49.06 -30.04 5.84 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.489 1.116 . . . . 0.0 113.106 -175.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -49.62 -48.41 49.06 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.65 1.18 . . . . 0.0 112.293 175.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.434 ' HB2' ' HG3' ' A' ' 95' ' ' PRO . 59.8 t80 -68.95 -41.35 78.15 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.034 0.533 . . . . 0.0 112.04 176.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.479 HD12 ' HB2' ' A' ' 45' ' ' MET . 6.3 mp -70.94 -29.45 65.47 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 122.592 0.357 . . . . 0.0 111.713 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 67.9 mt -76.38 -32.86 58.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.695 0.798 . . . . 0.0 110.527 171.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -68.27 -32.19 72.18 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.08 0.552 . . . . 0.0 111.08 171.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 70.0 m . . . . . 0 N--CA 1.483 1.215 0 C-N-CA 123.327 0.651 . . . . 0.0 110.658 179.254 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.892 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 102.34 14.73 27.36 Favored Glycine 0 CA--C 1.536 1.347 0 N-CA-C 114.456 0.543 . . . . 0.0 114.456 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -122.55 103.8 8.94 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 117.783 0.791 . . . . 0.0 111.815 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.425 ' HB3' HG11 ' A' ' 98' ' ' VAL . 0.0 OUTLIER -86.75 91.98 8.8 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.365 0.603 . . . . 0.0 111.324 168.712 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -166.71 121.01 1.07 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.278 0.631 . . . . 0.0 109.323 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 73.4 m 52.78 24.81 3.44 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 175.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.617 HD13 ' HB3' ' A' ' 43' ' ' ALA . 3.3 tm? -72.29 105.25 3.98 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 175.207 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 49.5 t -55.72 120.66 7.64 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 123.551 0.532 . . . . 0.0 110.567 175.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.547 ' HB1' HG13 ' A' ' 41' ' ' VAL . . . -56.84 -22.72 38.7 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.842 0.857 . . . . 0.0 113.131 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 64.6 m -54.1 -39.98 66.88 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.078 0.551 . . . . 0.0 112.348 170.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -66.84 -44.56 80.75 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.92 0.888 . . . . 0.0 111.552 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.604 ' HE1' HD21 ' A' ' 115' ' ' LEU . 5.3 t-105 -70.53 -54.02 13.82 Favored 'General case' 0 CA--C 1.566 1.559 0 C-N-CA 123.215 0.606 . . . . 0.0 110.99 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.701 ' HB2' HG12 ' A' ' 110' ' ' VAL . 6.5 tp60 -49.64 -42.51 45.33 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.31 0.644 . . . . 0.0 112.303 175.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.23 -32.7 62.49 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 123.56 0.744 . . . . 0.0 112.752 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.93 -43.12 91.13 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.111 0.564 . . . . 0.0 111.839 175.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -69.83 -41.24 75.22 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.483 0.713 . . . . 0.0 111.232 176.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 9.4 mm-40 -65.35 -23.71 67.06 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.458 0.703 . . . . 0.0 111.372 178.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.05 -25.63 29.7 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.865 0.866 . . . . 0.0 111.523 172.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 117.7 -12.92 13.36 Favored Glycine 0 N--CA 1.48 1.572 0 N-CA-C 114.187 0.435 . . . . 0.0 114.187 177.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 91.1 mmm -83.92 -80.84 0.18 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.336 0.654 . . . . 0.0 111.773 -176.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.46 92.17 0.07 OUTLIER Pre-proline 0 N--CA 1.487 1.422 0 C-N-CA 124.664 1.185 . . . . 0.0 113.043 -174.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.434 ' HG3' ' HB2' ' A' ' 49' ' ' PHE . 67.6 Cg_endo -77.6 179.27 6.67 Favored 'Trans proline' 0 CA--C 1.574 2.492 0 C-N-CA 123.215 2.61 . . . . 0.0 112.734 174.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -62.06 127.8 22.27 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 121.953 1.768 . . . . 0.0 113.971 174.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.7 p -104.01 145.4 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 124.119 0.968 . . . . 0.0 109.884 173.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.425 HG11 ' HB3' ' A' ' 77' ' ' ARG . 7.5 p -85.67 89.44 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.842 0 CA-C-O 122.192 0.996 . . . . 0.0 111.873 -176.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.442 HD22 ' HB3' ' A' ' 115' ' ' LEU . 7.9 mt -64.36 -24.06 67.51 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -177.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -73.27 -6.72 47.86 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 177.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.8 t -123.3 -12.99 7.76 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.679 0.791 . . . . 0.0 112.022 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 91.1 m -85.67 127.09 34.4 Favored 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 123.424 0.689 . . . . 0.0 112.171 -175.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -91.04 165.67 13.4 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.528 0.731 . . . . 0.0 111.518 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -63.32 -17.34 62.46 Favored 'General case' 0 CA--C 1.564 1.519 0 C-N-CA 124.398 1.079 . . . . 0.0 113.867 177.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 64.2 m -61.23 -24.91 66.7 Favored 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 122.696 0.398 . . . . 0.0 111.898 173.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.09 -38.9 68.68 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.418 0.687 . . . . 0.0 111.782 172.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.436 HD22 ' HB2' ' A' ' 112' ' ' LEU . 8.8 mp -67.47 3.4 1.33 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 124.647 1.179 . . . . 0.0 113.47 -176.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -95.72 -2.85 47.04 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.101 0.56 . . . . 0.0 110.357 174.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.472 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 75.6 m-85 -130.39 -53.24 1.1 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.122 1.369 . . . . 0.0 108.542 -177.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.701 HG12 ' HB2' ' A' ' 86' ' ' GLN . 17.0 m -89.07 177.87 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-O 122.256 1.027 . . . . 0.0 112.348 172.281 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.0 t -97.13 148.87 22.6 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 113.924 -1.489 . . . . 0.0 108.888 156.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.436 ' HB2' HD22 ' A' ' 107' ' ' LEU . 1.8 tt -57.99 -34.29 69.82 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 120.98 0.419 . . . . 0.0 109.958 170.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.91 -30.22 65.72 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.694 0.797 . . . . 0.0 112.524 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -71.57 -37.69 71.02 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.346 0.594 . . . . 0.0 110.131 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.604 HD21 ' HE1' ' A' ' 85' ' ' TRP . 75.9 mt -66.62 -50.0 64.44 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.652 0.781 . . . . 0.0 110.98 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -75.04 -37.7 61.65 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.065 -0.971 . . . . 0.0 112.582 -173.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -59.31 -25.65 64.33 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.469 173.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -120.05 19.84 12.22 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 123.526 0.731 . . . . 0.0 112.14 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.114 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 170.677 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.7 t . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 121.186 0.517 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.493 HG22 ' HB1' ' A' ' 82' ' ' ALA . 48.2 t -139.75 106.18 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.549 0.74 . . . . 0.0 109.871 -179.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 76.2 m -95.8 105.93 18.0 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.492 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -144.97 150.54 37.12 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.232 1.013 . . . . 0.0 108.793 -179.419 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -122.84 119.03 29.35 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 117.938 0.335 . . . . 0.0 110.632 -176.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 56.9 mtp -109.93 158.01 18.66 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.931 0.893 . . . . 0.0 111.274 178.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.404 ' OG1' ' HG2' ' A' ' 48' ' ' GLU . 25.6 p -96.86 158.85 15.23 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.971 0.908 . . . . 0.0 111.073 -177.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.607 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 23.7 tt0 -62.75 -29.12 70.45 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.973 -178.173 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.404 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 12.3 pt-20 -52.34 -45.41 65.65 Favored 'General case' 0 CA--C 1.565 1.548 0 C-N-CA 123.45 0.7 . . . . 0.0 112.73 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -79.38 -37.79 36.46 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 173.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.1 -20.16 64.91 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.73 -0.607 . . . . 0.0 111.616 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.607 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 76.4 mt -73.46 -30.74 63.37 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.536 1.134 . . . . 0.0 110.939 168.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.528 ' HE2' ' SD ' ' A' ' 93' ' ' MET . 13.7 m-85 -64.49 -47.65 78.15 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 118.319 0.509 . . . . 0.0 110.783 169.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.2 t . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.43 0.633 . . . . 0.0 111.577 176.044 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 68.87 26.33 74.69 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 116.69 -0.232 . . . . 0.0 113.118 -174.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -110.1 115.47 29.81 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.791 0.836 . . . . 0.0 110.065 176.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -99.17 84.89 3.11 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 171.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -158.76 116.63 2.88 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.244 0.618 . . . . 0.0 109.798 -175.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.0 t 43.84 33.86 0.8 Allowed 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 124.462 1.105 . . . . 0.0 113.218 175.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.492 HD13 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -62.85 123.42 18.44 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.97 0.908 . . . . 0.0 109.968 -174.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 63.0 m -62.6 105.44 0.64 Allowed 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.493 ' HB1' HG22 ' A' ' 41' ' ' VAL . . . -55.59 -26.05 41.71 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.208 1.003 . . . . 0.0 112.692 -177.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 65.2 m -58.87 -42.26 89.04 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.687 0.795 . . . . 0.0 112.474 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.7 mmt85 -69.68 -40.56 76.3 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.671 0.788 . . . . 0.0 112.04 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.576 ' HE1' HD21 ' A' ' 115' ' ' LEU . 15.9 t-105 -64.7 -54.14 36.37 Favored 'General case' 0 CA--C 1.559 1.296 0 C-N-CA 122.535 0.334 . . . . 0.0 110.162 175.502 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.723 ' HB2' HG13 ' A' ' 110' ' ' VAL . 29.5 tp60 -48.85 -43.64 38.9 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.906 0.882 . . . . 0.0 112.718 174.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -67.46 -33.48 75.21 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.839 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.22 -37.05 82.94 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 122.836 0.454 . . . . 0.0 111.361 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.644 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 81.5 t80 -58.13 -52.13 66.81 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.55 170.215 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -66.13 -23.97 66.59 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.749 0.819 . . . . 0.0 112.392 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.12 -5.89 59.32 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.783 0.833 . . . . 0.0 112.516 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.67 10.68 72.55 Favored Glycine 0 CA--C 1.538 1.496 0 N-CA-C 114.249 0.46 . . . . 0.0 114.249 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' MET . . . . . 0.528 ' SD ' ' HE2' ' A' ' 52' ' ' PHE . 97.2 mmm -97.98 -75.39 0.55 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.649 0.78 . . . . 0.0 110.902 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.644 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 53.95 82.85 0.24 Allowed Pre-proline 0 CA--C 1.565 1.553 0 C-N-CA 125.0 1.32 . . . . 0.0 113.494 -178.251 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -56.89 160.15 12.94 Favored 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.677 2.918 . . . . 0.0 114.557 170.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -63.79 106.32 0.62 Allowed 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 122.776 2.318 . . . . 0.0 113.234 174.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 10.6 p -96.05 154.25 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 C-N-CA 123.481 0.712 . . . . 0.0 110.261 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.537 HG23 ' HB3' ' A' ' 101' ' ' SER . 27.7 m -73.1 141.98 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.446 0 C-N-CA 123.472 0.709 . . . . 0.0 111.864 173.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 73.1 mt -105.32 -8.62 18.12 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 123.265 0.626 . . . . 0.0 111.252 167.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.15 2.73 29.53 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.531 1.132 . . . . 0.0 112.312 -170.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.537 ' HB3' HG23 ' A' ' 98' ' ' VAL . 21.8 t -132.51 -51.64 0.93 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.884 0.874 . . . . 0.0 110.989 -179.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 98.3 m -38.11 123.6 1.13 Allowed 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 125.222 1.409 . . . . 0.0 113.87 -177.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -83.54 174.54 10.49 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.314 1.045 . . . . 0.0 113.419 -171.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -61.32 -38.74 87.95 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.402 1.081 . . . . 0.0 112.468 177.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 39.3 t -63.36 -28.12 69.78 Favored 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.805 -176.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.47 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -64.55 -47.14 79.88 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.15 0.58 . . . . 0.0 111.725 173.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.62 -15.78 13.11 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 124.369 1.068 . . . . 0.0 113.117 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -75.93 -39.27 56.5 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.503 0.721 . . . . 0.0 110.189 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -87.38 -36.31 17.85 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.696 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.723 HG13 ' HB2' ' A' ' 86' ' ' GLN . 26.8 m -97.55 -56.42 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 -176.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 38.4 t 83.67 134.11 0.05 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 125.924 1.689 . . . . 0.0 110.579 -151.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.634 ' HA ' HD13 ' A' ' 115' ' ' LEU . 1.7 tt -50.07 -30.64 11.31 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.281 1.032 . . . . 0.0 113.628 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.85 -36.11 71.86 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.179 0.592 . . . . 0.0 112.436 -178.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.65 -31.07 57.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.755 0.822 . . . . 0.0 110.637 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.634 HD13 ' HA ' ' A' ' 112' ' ' LEU . 56.9 mt -63.88 -56.18 17.25 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 123.879 0.872 . . . . 0.0 110.013 173.005 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -65.72 -28.72 69.26 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.074 0.95 . . . . 0.0 112.371 -175.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -49.17 -38.53 25.94 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -138.36 39.49 2.27 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-O 121.224 0.535 . . . . 0.0 111.818 178.183 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.139 0 C-N-CA 123.55 0.74 . . . . 0.0 111.094 170.38 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.2 p . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 121.558 0.694 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.699 HG12 ' HB3' ' A' ' 82' ' ' ALA . 39.6 t -127.78 101.14 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.095 0.558 . . . . 0.0 109.831 174.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.5 m -111.38 106.59 15.57 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 171.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.415 ' HB2' HD13 ' A' ' 80' ' ' LEU . . . -139.32 150.67 45.65 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.36 1.064 . . . . 0.0 108.919 -176.454 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -116.62 108.54 16.07 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 122.065 -0.397 . . . . 0.0 110.584 -172.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.558 ' HB2' HD11 ' A' ' 50' ' ' LEU . 85.3 mmm -95.29 153.91 17.44 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.651 0.78 . . . . 0.0 111.024 177.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.405 ' OG1' ' HG2' ' A' ' 48' ' ' GLU . 73.0 p -90.94 156.47 17.96 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.898 0.879 . . . . 0.0 111.084 177.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.422 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 34.8 tt0 -62.7 -28.71 70.13 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.206 0.602 . . . . 0.0 112.146 -177.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.405 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 7.8 pt-20 -54.11 -38.05 64.97 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 122.825 0.45 . . . . 0.0 110.875 173.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.49 ' HB2' ' HG2' ' A' ' 95' ' ' PRO . 74.8 t80 -77.4 -45.59 25.4 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 123.658 0.783 . . . . 0.0 112.031 173.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.558 HD11 ' HB2' ' A' ' 45' ' ' MET . 9.0 mp -64.08 -41.12 97.42 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -174.171 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.422 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 88.6 mt -65.12 -31.33 72.48 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.768 0.427 . . . . 0.0 111.353 174.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -67.32 -44.07 80.05 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 123.647 0.779 . . . . 0.0 111.461 172.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.463 ' HG ' ' HA ' ' A' ' 50' ' ' LEU . 97.7 p . . . . . 0 N--CA 1.498 1.938 0 C-N-CA 123.499 0.72 . . . . 0.0 111.68 -179.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.998 0 CA-C-O 120.517 0.199 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 116.54 -11.17 16.27 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 116.193 -0.458 . . . . 0.0 113.668 -175.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -85.21 97.34 9.86 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 117.242 0.521 . . . . 0.0 110.59 175.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.502 ' HD2' HG22 ' A' ' 98' ' ' VAL . 44.8 ttp180 -96.66 84.12 3.58 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -174.95 120.7 0.21 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 125.873 1.669 . . . . 0.0 108.075 -174.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 36.2 m 59.47 27.99 17.26 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.511 0.724 . . . . 0.0 112.888 173.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.415 HD13 ' HB2' ' A' ' 43' ' ' ALA . 2.9 tm? -67.78 135.76 53.14 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 123.817 0.847 . . . . 0.0 110.559 -177.4 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.2 m -66.51 95.26 0.32 Allowed 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.845 0.858 . . . . 0.0 111.083 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.699 ' HB3' HG12 ' A' ' 41' ' ' VAL . . . -60.23 -29.42 68.74 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.847 0.859 . . . . 0.0 113.163 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.7 m -56.45 -35.21 67.62 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.553 0.741 . . . . 0.0 112.184 175.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -73.62 -41.56 62.64 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.136 0.974 . . . . 0.0 111.472 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 3.0 t-105 -66.54 -48.59 69.22 Favored 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 122.816 0.446 . . . . 0.0 110.366 176.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.564 ' HB2' HG13 ' A' ' 110' ' ' VAL . 11.0 tp60 -49.43 -43.28 44.61 Favored 'General case' 0 CA--C 1.564 1.481 0 C-N-CA 124.052 0.941 . . . . 0.0 111.885 169.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.11 -47.27 85.89 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.949 0.5 . . . . 0.0 111.765 175.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.05 -39.34 74.68 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -173.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.54 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 49.7 t80 -72.18 -45.06 61.92 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.354 0.261 . . . . 0.0 111.495 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -71.71 -21.59 61.75 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.253 0.621 . . . . 0.0 112.173 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.29 -24.59 29.81 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.036 0.934 . . . . 0.0 111.216 175.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.62 42.42 7.81 Favored Glycine 0 C--N 1.349 1.281 0 CA-C-N 116.418 -0.355 . . . . 0.0 113.474 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -142.05 12.54 2.02 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.032 0.933 . . . . 0.0 111.33 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.54 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -50.66 114.08 4.29 Favored Pre-proline 0 CA--C 1.566 1.586 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -176.028 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.49 ' HG2' ' HB2' ' A' ' 49' ' ' PHE . 12.0 Cg_exo -74.92 177.04 9.09 Favored 'Trans proline' 0 CA--C 1.57 2.296 0 C-N-CA 123.978 3.119 . . . . 0.0 112.651 170.165 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.455 ' HA ' ' HB3' ' A' ' 118' ' ' HIS . 65.5 Cg_endo -70.55 152.59 65.32 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.178 1.919 . . . . 0.0 113.715 174.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 14.9 p -138.1 167.68 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 124.294 1.038 . . . . 0.0 109.461 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.502 HG22 ' HD2' ' A' ' 77' ' ' ARG . 16.6 m -90.7 135.69 25.96 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 123.159 0.584 . . . . 0.0 111.231 169.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 12.5 mt -90.9 -36.9 13.89 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.598 0.713 . . . . 0.0 109.532 161.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -78.99 13.57 1.71 Allowed 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 125.093 1.357 . . . . 0.0 113.671 -171.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.478 ' HB3' HG22 ' A' ' 98' ' ' VAL . 46.3 t -147.01 -39.82 0.2 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.124 0.569 . . . . 0.0 111.279 179.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.7 m -61.78 130.14 44.32 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 122.697 0.399 . . . . 0.0 111.248 174.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -75.81 161.41 29.04 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.061 0.545 . . . . 0.0 111.957 -177.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.4 ' HA ' HD13 ' A' ' 107' ' ' LEU . 13.8 mptt -70.97 -17.5 62.65 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.532 0.733 . . . . 0.0 112.126 178.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.6 m -60.82 -26.94 67.69 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.269 0.628 . . . . 0.0 111.938 174.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.402 ' O ' HG21 ' A' ' 110' ' ' VAL . . . -61.72 -32.56 72.79 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.729 0.811 . . . . 0.0 112.587 176.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.5 mp -62.75 1.86 0.35 Allowed 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 125.027 1.331 . . . . 0.0 114.534 -174.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -96.12 -28.81 14.42 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.397 0.679 . . . . 0.0 110.214 177.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -97.64 -43.8 7.05 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.139 1.375 . . . . 0.0 109.139 -177.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.765 HG22 HD23 ' A' ' 115' ' ' LEU . 35.5 m -93.39 -171.25 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 122.087 0.946 . . . . 0.0 110.646 163.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 44.7 t -115.39 154.29 29.48 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 114.549 -1.205 . . . . 0.0 108.566 155.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.0 tt -48.8 -36.02 15.73 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.762 0.825 . . . . 0.0 111.513 170.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.64 74.63 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 123.937 0.895 . . . . 0.0 113.388 -177.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.72 -42.38 91.17 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.373 0.606 . . . . 0.0 110.463 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.765 HD23 HG22 ' A' ' 110' ' ' VAL . 6.4 mt -66.36 -52.43 46.98 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.791 -178.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.38 -25.11 63.1 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.173 0.989 . . . . 0.0 112.505 -174.126 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.78 -26.26 67.13 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 170.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 96' ' ' PRO . 78.0 m80 -132.54 26.68 4.41 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.76 0.824 . . . . 0.0 112.16 -177.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.215 0 C-N-CA 124.125 0.97 . . . . 0.0 110.387 176.13 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 121.038 0.447 . . . . 0.0 110.742 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.9 t -125.62 122.8 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.708 0.803 . . . . 0.0 110.448 176.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 79.4 m -121.08 107.29 12.44 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 168.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.496 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -136.18 142.89 44.17 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.147 0.979 . . . . 0.0 108.645 179.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.465 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 17.4 tt0 -122.02 110.02 15.3 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.808 0.337 . . . . 0.0 110.548 -171.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.625 ' HB2' HD12 ' A' ' 50' ' ' LEU . 42.7 mmm -89.56 136.02 33.27 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.803 0.841 . . . . 0.0 109.157 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 14.7 t -82.23 159.98 23.1 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 176.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.486 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 31.7 tt0 -54.57 -32.07 57.82 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.364 0.666 . . . . 0.0 112.601 -172.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -57.29 -37.55 72.6 Favored 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -175.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -76.01 -39.83 54.91 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.625 HD12 ' HB2' ' A' ' 45' ' ' MET . 6.3 mp -68.41 -25.02 64.83 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 120.97 0.414 . . . . 0.0 110.765 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.486 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 94.1 mt -74.98 -44.75 46.48 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.483 1.113 . . . . 0.0 109.835 170.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -55.99 -39.53 71.98 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.915 0.486 . . . . 0.0 111.006 174.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.478 0.932 0 C-N-CA 123.741 0.816 . . . . 0.0 111.892 -176.848 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.064 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 99.8 2.28 56.23 Favored Glycine 0 CA--C 1.537 1.465 0 N-CA-C 114.738 0.655 . . . . 0.0 114.738 -177.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -97.14 109.27 22.06 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 117.96 0.88 . . . . 0.0 111.834 173.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.465 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 27.6 ptt-85 -90.95 87.84 6.78 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-O 122.079 0.943 . . . . 0.0 109.482 168.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -166.75 118.67 0.97 Allowed 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.67 -167.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 73.5 m 50.03 22.47 0.91 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 178.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.496 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -59.08 -31.03 68.51 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.823 0.849 . . . . 0.0 112.103 -169.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 42.4 t 67.11 113.53 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.685 1.194 . . . . 0.0 110.613 -172.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.86 -29.42 66.95 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -172.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.7 t -63.69 -33.23 75.18 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.466 0.706 . . . . 0.0 112.417 177.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -66.09 -41.83 90.13 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.624 0.769 . . . . 0.0 111.406 177.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.49 ' NE1' HD21 ' A' ' 115' ' ' LEU . 1.5 t-105 -69.26 -49.34 56.99 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 123.107 0.563 . . . . 0.0 110.822 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -52.98 -41.79 64.92 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.783 0.833 . . . . 0.0 111.397 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -64.12 -24.57 67.74 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.596 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.43 82.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.086 0.555 . . . . 0.0 111.477 176.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -65.03 -43.59 91.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.197 0.599 . . . . 0.0 110.552 173.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -68.0 -22.64 64.99 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.95 0.9 . . . . 0.0 111.665 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.6 -3.68 56.49 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.916 0.886 . . . . 0.0 112.206 173.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.03 41.2 23.05 Favored Glycine 0 C--N 1.352 1.444 0 C-N-CA 122.937 0.303 . . . . 0.0 113.25 -178.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 1.8 mmt -130.19 -78.02 0.54 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.501 0.721 . . . . 0.0 110.879 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.74 94.39 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.262 0 C-N-CA 124.624 1.169 . . . . 0.0 112.69 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -74.27 158.02 45.3 Favored 'Trans proline' 0 CA--C 1.567 2.13 0 C-N-CA 122.533 2.155 . . . . 0.0 112.663 170.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -59.6 111.42 0.94 Allowed 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 122.295 1.997 . . . . 0.0 113.1 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 6.6 p -95.07 149.49 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.41 0 C-N-CA 123.914 0.886 . . . . 0.0 111.318 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.5 p -80.32 91.79 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.865 0 CA-C-O 122.259 1.028 . . . . 0.0 113.036 -173.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -70.48 -22.08 62.7 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -178.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -73.91 -17.61 61.01 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 71.6 m -124.92 -4.78 7.51 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 96.7 m -71.0 126.42 29.53 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.422 0.556 . . . . 0.0 111.388 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -85.38 157.74 20.43 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.549 0.74 . . . . 0.0 111.712 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -58.07 -31.83 67.45 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.804 1.242 . . . . 0.0 113.488 -176.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 73.4 m -60.87 -29.13 69.36 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.2 70.74 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.312 0.645 . . . . 0.0 112.611 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.18 -24.68 65.9 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.834 0.854 . . . . 0.0 111.995 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -68.42 -18.14 64.37 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.928 0.491 . . . . 0.0 111.678 178.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -102.81 -53.07 2.93 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.101 0.96 . . . . 0.0 110.803 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.7 HG21 ' HB3' ' A' ' 114' ' ' ASP . 0.9 OUTLIER -99.34 -37.22 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 C-N-CA 122.625 0.37 . . . . 0.0 111.901 -172.481 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.1 t 73.25 134.37 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 125.135 1.522 . . . . 0.0 110.817 -166.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.563 ' HA ' HD12 ' A' ' 115' ' ' LEU . 5.5 tt -45.88 -29.46 1.39 Allowed 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -175.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.62 -34.84 74.83 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.731 0.412 . . . . 0.0 112.07 -179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.7 ' HB3' HG21 ' A' ' 110' ' ' VAL . 27.7 t70 -73.74 -40.44 63.53 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.568 0.747 . . . . 0.0 111.073 177.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 112' ' ' LEU . 82.1 mt -54.93 -51.84 64.84 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.205 1.002 . . . . 0.0 111.36 173.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -75.34 -22.79 57.34 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.29 -1.323 . . . . 0.0 112.492 -176.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.23 -19.4 5.17 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 172.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -138.76 21.01 2.68 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 174.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.396 0 O-C-N 121.772 -0.58 . . . . 0.0 111.329 173.825 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.483 1.212 0 CA-C-O 121.448 0.642 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.429 HG13 ' HB1' ' A' ' 82' ' ' ALA . 82.2 t -140.38 110.33 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.214 1.006 . . . . 0.0 108.747 174.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 71.9 m -95.99 105.53 17.57 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.533 ' HB1' HD11 ' A' ' 80' ' ' LEU . . . -143.38 151.25 40.2 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.084 1.354 . . . . 0.0 108.26 -178.429 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.542 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 24.2 tt0 -125.24 108.52 11.82 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.013 0.824 . . . . 0.0 112.245 -174.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 70.6 mtp -87.41 135.22 33.42 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.355 0.662 . . . . 0.0 109.522 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.547 HG22 ' HD1' ' A' ' 49' ' ' PHE . 0.9 OUTLIER -91.63 155.18 18.52 Favored 'General case' 0 N--CA 1.502 2.142 0 CA-C-N 118.154 0.433 . . . . 0.0 110.734 -179.952 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -56.11 -32.1 63.89 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.944 0.898 . . . . 0.0 113.024 -169.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -53.69 -45.04 70.24 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.584 0.707 . . . . 0.0 110.621 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.547 ' HD1' HG22 ' A' ' 46' ' ' THR . 86.7 m-85 -78.58 -35.16 46.23 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.958 1.303 . . . . 0.0 113.899 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.9 mp -68.08 -42.22 80.71 Favored 'General case' 0 N--CA 1.499 2.011 0 CA-C-N 119.365 0.984 . . . . 0.0 110.727 177.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 83.5 mt -67.93 -37.34 81.53 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.072 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.412 ' HD2' ' SD ' ' A' ' 93' ' ' MET . 68.9 t80 -65.9 -39.35 90.52 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.261 0.624 . . . . 0.0 111.425 176.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 43.8 t . . . . . 0 N--CA 1.484 1.239 0 C-N-CA 123.612 0.765 . . . . 0.0 110.694 177.72 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.918 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 66.4 40.95 94.65 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.486 -0.779 . . . . 0.0 113.464 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -124.94 104.88 8.83 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 122.854 0.461 . . . . 0.0 110.247 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.542 ' HB2' ' HB2' ' A' ' 44' ' ' GLU . 0.1 OUTLIER -83.5 88.03 7.0 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 122.813 0.445 . . . . 0.0 110.024 174.934 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -168.61 120.79 0.81 Allowed 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 124.261 1.024 . . . . 0.0 110.115 177.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 39.3 t 53.36 26.4 5.32 Favored 'General case' 0 N--CA 1.5 2.066 0 C-N-CA 124.687 1.195 . . . . 0.0 112.937 174.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.533 HD11 ' HB1' ' A' ' 43' ' ' ALA . 3.1 tm? -62.77 131.39 48.73 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.451 1.1 . . . . 0.0 111.041 -176.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 42.6 t -63.06 101.4 0.28 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.644 0.778 . . . . 0.0 111.394 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.429 ' HB1' HG13 ' A' ' 41' ' ' VAL . . . -59.08 -25.95 64.23 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.722 0.809 . . . . 0.0 112.297 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.5 m -69.33 -39.88 77.92 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.718 0.807 . . . . 0.0 112.029 174.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -74.99 -32.76 61.74 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.172 0.589 . . . . 0.0 111.338 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.545 ' HE1' HD21 ' A' ' 115' ' ' LEU . 3.4 t-105 -65.1 -46.73 79.87 Favored 'General case' 0 CA--C 1.567 1.598 0 C-N-CA 123.456 0.702 . . . . 0.0 109.377 171.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -57.49 -44.45 84.96 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.12 0.968 . . . . 0.0 111.576 174.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -60.25 -34.82 74.24 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.056 0.942 . . . . 0.0 111.42 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.89 -39.12 87.38 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 122.927 0.491 . . . . 0.0 111.739 175.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.429 ' HA ' ' HB3' ' A' ' 94' ' ' ALA . 32.6 t80 -66.76 -39.78 88.0 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 121.074 0.464 . . . . 0.0 110.715 176.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -69.22 -28.44 66.35 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 123.728 0.811 . . . . 0.0 111.425 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.18 -5.68 57.99 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.852 0.861 . . . . 0.0 111.978 173.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 92.76 -20.94 41.91 Favored Glycine 0 C--N 1.353 1.497 0 N-CA-C 114.226 0.45 . . . . 0.0 114.226 177.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' MET . . . . . 0.412 ' SD ' ' HD2' ' A' ' 52' ' ' PHE . 6.3 ptm -71.27 -87.92 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.773 0 C-N-CA 124.03 0.932 . . . . 0.0 112.59 -177.08 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.429 ' HB3' ' HA ' ' A' ' 89' ' ' PHE . . . 61.58 112.67 0.02 OUTLIER Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 178.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -67.69 176.72 4.77 Favored 'Trans proline' 0 N--CA 1.507 2.304 0 C-N-CA 123.498 2.799 . . . . 0.0 113.661 170.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -82.01 134.47 8.23 Favored 'Trans proline' 0 C--N 1.381 2.267 0 C-N-CA 122.402 2.068 . . . . 0.0 111.897 166.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.9 p -122.79 143.74 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.912 0.885 . . . . 0.0 110.179 177.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.3 p -94.65 120.2 43.72 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.652 0 C-N-CA 123.216 0.606 . . . . 0.0 111.852 -178.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.4 mt -61.0 -45.82 93.28 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.161 0.985 . . . . 0.0 113.384 -176.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -75.14 14.75 0.5 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.988 0.915 . . . . 0.0 113.451 -172.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.2 t -137.39 -5.73 1.8 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 123.521 0.728 . . . . 0.0 112.07 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 53.5 m -91.24 124.2 35.26 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.029 0.532 . . . . 0.0 110.888 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.8 mp0 -66.39 154.6 39.71 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.001 0.52 . . . . 0.0 112.194 175.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.434 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 1.4 tmtp? -67.17 -19.32 65.56 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 123.633 0.773 . . . . 0.0 111.545 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 42.9 t -56.43 -26.68 54.35 Favored 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 123.715 0.806 . . . . 0.0 111.918 176.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.37 73.73 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.956 0.902 . . . . 0.0 112.692 174.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 10.6 mp -62.9 -6.82 4.16 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -173.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 59.6 mtp180 -83.67 -34.2 25.04 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 121.084 0.469 . . . . 0.0 111.526 172.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -102.21 -22.73 14.12 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.501 1.121 . . . . 0.0 111.524 -173.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.41 HG22 ' NE1' ' A' ' 85' ' ' TRP . 7.6 p -136.24 170.98 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 124.331 1.052 . . . . 0.0 108.756 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' SER . . . . . 0.495 ' HB3' ' HB2' ' A' ' 114' ' ' ASP . 28.7 t -92.97 151.29 20.0 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 121.747 -0.596 . . . . 0.0 111.277 170.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.9 tt -59.9 -44.63 94.16 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.551 0.34 . . . . 0.0 110.196 167.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.07 -30.65 69.35 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.298 0.639 . . . . 0.0 111.356 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.495 ' HB2' ' HB3' ' A' ' 111' ' ' SER . 5.5 t70 -67.1 -41.01 86.98 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.588 1.155 . . . . 0.0 110.45 175.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.545 HD21 ' HE1' ' A' ' 85' ' ' TRP . 71.3 mt -66.33 -53.48 35.88 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.845 0.858 . . . . 0.0 110.509 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . 0.432 ' HA ' ' HB3' ' A' ' 119' ' ' ALA . 11.3 mt-30 -69.47 -28.03 65.74 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.445 1.098 . . . . 0.0 111.947 -173.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -55.2 -37.03 66.56 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.283 0.633 . . . . 0.0 112.43 171.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -113.22 30.26 7.34 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.757 0.823 . . . . 0.0 111.455 178.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.432 ' HB3' ' HA ' ' A' ' 116' ' ' GLN . . . . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.494 1.729 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.556 HG13 ' HB1' ' A' ' 82' ' ' ALA . 42.3 t -139.5 110.6 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 C-N-CA 123.591 0.756 . . . . 0.0 110.618 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.8 m -108.23 106.92 17.31 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.64 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -142.27 151.31 41.91 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.45 0.7 . . . . 0.0 109.321 -168.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.469 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 29.1 tt0 -112.25 115.81 29.4 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.837 0.351 . . . . 0.0 111.667 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.407 ' HB3' HD13 ' A' ' 50' ' ' LEU . 75.5 mmm -95.19 114.84 26.68 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 170.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.694 ' HB ' ' HB2' ' A' ' 95' ' ' PRO . 92.4 m -83.56 147.73 27.59 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.34 0.656 . . . . 0.0 110.294 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.496 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 35.6 tt0 -47.31 -32.52 4.8 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -164.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -53.1 -41.87 65.39 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -76.08 -32.5 59.27 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.383 0.273 . . . . 0.0 111.595 175.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' A' ' 74' ' ' ALA . 5.3 mp -77.39 -22.54 51.48 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.803 0.441 . . . . 0.0 110.813 -177.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.496 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 70.2 mt -68.79 -46.82 67.72 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.811 1.244 . . . . 0.0 109.626 168.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -55.08 -48.77 73.08 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.427 1.091 . . . . 0.0 110.98 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 N--CA 1.484 1.261 0 C-N-CA 124.117 0.967 . . . . 0.0 111.949 177.802 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.602 ' HA ' HD23 ' A' ' 50' ' ' LEU . . . . . . . . 0 CA--C 1.55 0.942 0 CA-C-O 120.863 0.363 . . . . 0.0 111.543 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 75.65 44.88 19.32 Favored Glycine 0 C--N 1.346 1.12 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.811 -176.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -119.93 149.14 42.6 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.227 0.611 . . . . 0.0 109.96 173.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.469 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -135.54 91.68 2.75 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.206 0.602 . . . . 0.0 110.787 -174.713 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -179.61 123.8 0.08 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.551 1.141 . . . . 0.0 109.454 173.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.2 t 54.57 30.86 13.89 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.392 1.077 . . . . 0.0 112.706 177.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.64 HD13 ' HB3' ' A' ' 43' ' ' ALA . 2.4 tm? -68.6 131.77 45.78 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.697 0.799 . . . . 0.0 110.538 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 60.8 m -60.26 106.93 0.58 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.133 0.973 . . . . 0.0 110.761 176.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.556 ' HB1' HG13 ' A' ' 41' ' ' VAL . . . -64.5 -24.8 67.73 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.6 t -64.0 -34.01 77.02 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 122.756 0.422 . . . . 0.0 111.741 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -63.07 -37.99 89.38 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.82 0.848 . . . . 0.0 110.978 176.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -75.14 -50.62 15.74 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 124.279 1.032 . . . . 0.0 111.155 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.447 ' HB2' HG12 ' A' ' 110' ' ' VAL . 19.6 tp60 -49.1 -44.29 42.01 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.952 0.901 . . . . 0.0 112.07 173.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -69.61 -30.01 67.65 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.48 -43.13 91.21 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 122.822 0.449 . . . . 0.0 111.911 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.548 ' HA ' ' HB1' ' A' ' 94' ' ' ALA . 80.0 t80 -64.68 -41.37 96.1 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.134 0.574 . . . . 0.0 111.127 176.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -67.07 -29.94 69.85 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.612 0.765 . . . . 0.0 112.647 175.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.48 -14.7 56.7 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.598 0.759 . . . . 0.0 111.914 175.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 78.58 7.51 88.04 Favored Glycine 0 C--N 1.352 1.448 0 CA-C-N 116.25 -0.432 . . . . 0.0 113.318 -174.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 94.6 mmm -104.2 17.82 23.33 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.227 1.011 . . . . 0.0 112.075 -177.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.548 ' HB1' ' HA ' ' A' ' 89' ' ' PHE . . . -52.06 108.56 1.1 Allowed Pre-proline 0 CA--C 1.569 1.701 0 C-N-CA 125.39 1.476 . . . . 0.0 114.439 178.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.694 ' HB2' ' HB ' ' A' ' 46' ' ' THR . 32.3 Cg_endo -86.56 168.06 8.6 Favored 'Trans proline' 0 CA--C 1.571 2.327 0 C-N-CA 123.06 2.507 . . . . 0.0 113.172 175.205 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.79 126.58 21.6 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.853 2.369 . . . . 0.0 114.803 176.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.2 p -115.43 175.61 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 125.381 1.472 . . . . 0.0 109.363 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.0 m -95.67 161.1 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.435 0 O-C-N 121.625 -0.672 . . . . 0.0 110.612 165.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.446 HD13 ' HG2' ' A' ' 116' ' ' GLN . 7.7 mt -113.44 -29.73 7.11 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.214 1.006 . . . . 0.0 108.889 161.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -59.43 -46.06 89.79 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.802 1.241 . . . . 0.0 112.082 -173.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.1 t -96.63 -23.83 16.3 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.008 178.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.7 m -63.49 110.1 1.85 Allowed 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 120.855 0.359 . . . . 0.0 111.482 175.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.0 mp0 -65.59 155.65 35.15 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.947 0.899 . . . . 0.0 112.11 178.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -66.86 -16.61 64.42 Favored 'General case' 0 N--CA 1.5 2.03 0 C-N-CA 123.45 0.7 . . . . 0.0 112.057 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.4 t -61.34 -26.34 67.74 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.095 0.958 . . . . 0.0 112.302 173.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.459 ' O ' HG23 ' A' ' 110' ' ' VAL . . . -54.66 -37.64 65.96 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.117 0.567 . . . . 0.0 112.084 174.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 7.0 mp -65.85 4.04 0.69 Allowed 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 124.956 1.303 . . . . 0.0 113.261 -176.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 65.1 mtp85 -98.69 -10.19 23.56 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.485 1.114 . . . . 0.0 110.848 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -121.06 -49.28 2.2 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.997 1.319 . . . . 0.0 108.611 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.804 HG21 HD23 ' A' ' 115' ' ' LEU . 32.6 m -90.1 -174.32 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 CA-C-O 122.101 0.953 . . . . 0.0 111.09 167.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.9 t -110.02 160.68 16.22 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.219 155.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.58 -36.91 62.42 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.252 0.621 . . . . 0.0 112.39 173.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.36 -30.74 71.4 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -177.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -61.47 -46.36 90.39 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.307 0.575 . . . . 0.0 110.12 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.804 HD23 HG21 ' A' ' 110' ' ' VAL . 5.9 mt -66.55 -56.58 10.17 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.431 -175.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . 0.446 ' HG2' HD13 ' A' ' 99' ' ' LEU . 3.2 mt-30 -65.84 -24.65 66.94 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.479 -170.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -51.17 -40.32 58.37 Favored 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 172.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -140.7 21.52 2.33 Favored 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 123.258 0.623 . . . . 0.0 112.639 -176.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -178.56 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 45.0 p . . . . . 0 CA--C 1.552 1.029 0 CA-C-O 120.775 0.322 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.2 t -129.07 123.51 58.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.781 -0.574 . . . . 0.0 110.525 173.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 71.9 m -119.95 108.91 14.9 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 167.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.669 ' HB1' HD12 ' A' ' 80' ' ' LEU . . . -138.96 147.93 42.87 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.851 0.86 . . . . 0.0 108.835 -174.057 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -112.17 118.76 36.22 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 117.796 0.271 . . . . 0.0 111.501 -172.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.505 ' SD ' ' HB2' ' A' ' 85' ' ' TRP . 75.7 mmm -101.88 129.86 48.22 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.501 0.72 . . . . 0.0 110.641 178.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 57.0 m -85.73 150.96 24.22 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.222 1.009 . . . . 0.0 110.412 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -47.92 -30.01 3.84 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.631 1.573 . . . . 0.0 114.432 -172.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -48.19 -55.15 11.13 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.164 0.986 . . . . 0.0 112.179 177.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -74.39 -33.74 63.12 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.277 -176.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.8 mp -73.19 -35.61 66.39 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 117.914 0.324 . . . . 0.0 111.293 -176.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 38.8 mt -74.16 -33.67 63.56 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.972 0.509 . . . . 0.0 110.995 173.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -58.28 -51.92 67.76 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.908 0.483 . . . . 0.0 110.664 171.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.477 0.889 0 C-N-CA 123.662 0.785 . . . . 0.0 111.745 -179.691 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.004 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.85 20.8 25.28 Favored Glycine 0 CA--C 1.537 1.452 0 CA-C-N 115.648 -0.705 . . . . 0.0 113.431 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -95.99 134.02 39.51 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.565 0.746 . . . . 0.0 110.772 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.67 90.56 3.13 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.934 0.873 . . . . 0.0 111.791 172.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -173.96 121.4 0.3 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.485 1.114 . . . . 0.0 108.765 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 36.6 t 58.75 21.51 9.01 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.945 0.898 . . . . 0.0 112.374 177.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.669 HD12 ' HB1' ' A' ' 43' ' ' ALA . 3.2 tm? -68.87 112.92 5.85 Favored 'General case' 0 C--N 1.355 0.82 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 63.0 m -59.46 115.34 3.21 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.997 0.519 . . . . 0.0 109.967 176.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -56.28 -25.12 47.04 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -176.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.5 t -61.45 -33.32 73.54 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.623 0.769 . . . . 0.0 112.52 174.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -71.01 -40.21 71.93 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 123.852 0.861 . . . . 0.0 112.016 177.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.697 ' HE1' HD22 ' A' ' 115' ' ' LEU . 10.7 t-105 -68.84 -51.67 38.04 Favored 'General case' 0 CA--C 1.561 1.385 0 O-C-N 122.249 -0.282 . . . . 0.0 111.009 173.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.509 ' HB2' HG12 ' A' ' 110' ' ' VAL . 6.8 tp60 -48.43 -37.32 16.83 Favored 'General case' 0 CA--C 1.567 1.603 0 C-N-CA 124.167 0.987 . . . . 0.0 111.62 173.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -59.43 -44.04 92.98 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.634 1.174 . . . . 0.0 112.425 174.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.5 -36.6 73.9 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.149 0.58 . . . . 0.0 111.97 -173.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.7 ' HA ' ' HB3' ' A' ' 94' ' ' ALA . 65.5 t80 -66.02 -52.23 51.09 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.057 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -67.78 -22.52 65.19 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.92 -22.14 60.78 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.301 0.641 . . . . 0.0 111.528 171.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 102.26 -4.89 51.98 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 114.136 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 61.5 mtp -81.11 -70.14 0.55 Allowed 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 117.356 0.578 . . . . 0.0 109.909 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.7 ' HB3' ' HA ' ' A' ' 89' ' ' PHE . . . 57.21 92.05 0.07 OUTLIER Pre-proline 0 CA--C 1.557 1.224 0 C-N-CA 125.034 1.333 . . . . 0.0 113.54 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.42 ' HG2' ' HE1' ' A' ' 45' ' ' MET . 93.5 Cg_exo -55.06 159.25 10.02 Favored 'Trans proline' 0 CA--C 1.564 2.004 0 C-N-CA 123.049 2.499 . . . . 0.0 114.496 163.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.65 110.98 2.0 Favored 'Trans proline' 0 CA--C 1.558 1.699 0 C-N-CA 121.776 1.651 . . . . 0.0 110.999 163.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -95.24 157.15 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 123.245 0.618 . . . . 0.0 110.224 178.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.497 HG23 ' HB3' ' A' ' 101' ' ' SER . 28.1 m -73.48 147.28 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.149 0 C-N-CA 123.097 0.559 . . . . 0.0 111.175 171.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.442 HD22 ' HG2' ' A' ' 116' ' ' GLN . 0.6 OUTLIER -105.17 -30.25 9.83 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 167.766 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -80.52 -14.42 58.26 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.629 1.171 . . . . 0.0 113.338 -172.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.497 ' HB3' HG23 ' A' ' 98' ' ' VAL . 33.0 t -119.6 -24.69 6.17 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 122.759 0.424 . . . . 0.0 111.783 -179.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 85.5 m -63.31 106.3 0.87 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.747 0.419 . . . . 0.0 111.113 172.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -76.57 160.31 29.55 Favored 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 124.167 0.987 . . . . 0.0 110.702 -176.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -57.98 -23.36 53.51 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -174.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.6 m -59.23 -32.23 69.78 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 120.765 0.317 . . . . 0.0 111.628 176.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.416 ' O ' HG21 ' A' ' 110' ' ' VAL . . . -59.8 -36.36 76.58 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.556 0.742 . . . . 0.0 112.801 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.7 mp -65.47 5.49 0.41 Allowed 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 124.615 1.166 . . . . 0.0 113.495 -178.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 49.4 mtp180 -98.72 -26.01 14.49 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.044 0.938 . . . . 0.0 110.525 175.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -95.79 -53.15 3.8 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.731 1.212 . . . . 0.0 108.065 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.631 HG22 HD21 ' A' ' 115' ' ' LEU . 33.1 m -91.02 -171.54 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 122.207 1.003 . . . . 0.0 111.569 170.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 47.1 t -114.52 161.1 18.46 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.304 -1.316 . . . . 0.0 108.216 156.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.2 tt -53.88 -40.24 66.42 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.479 0.311 . . . . 0.0 110.97 168.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.89 -30.31 67.68 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.524 0.73 . . . . 0.0 112.43 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.57 -39.09 88.3 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.613 0.765 . . . . 0.0 110.298 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.697 HD22 ' HE1' ' A' ' 85' ' ' TRP . 23.4 mt -71.61 -53.67 12.92 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.738 -177.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . 0.442 ' HG2' HD22 ' A' ' 99' ' ' LEU . 28.6 mt-30 -69.51 -27.16 64.95 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.445 -173.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -50.53 -54.54 21.62 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.878 0.871 . . . . 0.0 113.331 177.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 23.1 t-80 -99.9 -14.36 18.77 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.557 1.232 0 O-C-N 122.195 -0.316 . . . . 0.0 111.051 179.199 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 120.663 0.268 . . . . 0.0 111.325 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 84.26 -136.04 14.32 Favored Glycine 0 C--N 1.349 1.26 0 N-CA-C 111.858 -0.497 . . . . 0.0 111.858 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -92.97 150.27 20.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-N 117.357 0.578 . . . . 0.0 110.781 176.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -146.77 153.56 25.42 Favored Glycine 0 N--CA 1.478 1.481 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.354 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -90.57 137.72 32.13 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 117.248 0.524 . . . . 0.0 111.045 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -100.12 163.72 12.3 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.79 0.836 . . . . 0.0 111.692 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.2 m -68.32 -24.93 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 CA-C-O 121.72 0.772 . . . . 0.0 111.07 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 62.9 mt -81.38 -21.99 38.64 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.622 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.78 -71.05 0.91 Allowed Glycine 0 C--N 1.353 1.495 0 N-CA-C 114.608 0.603 . . . . 0.0 114.608 -175.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -156.43 150.01 24.67 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 117.128 0.464 . . . . 0.0 111.2 -176.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.3 t0 67.25 151.85 0.07 Allowed 'General case' 0 CA--C 1.567 1.615 0 C-N-CA 125.153 1.381 . . . . 0.0 113.939 164.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.0 tp -168.88 24.13 0.02 OUTLIER 'General case' 0 CA--C 1.566 1.579 0 C-N-CA 123.918 0.887 . . . . 0.0 109.948 175.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -87.13 151.03 23.55 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.492 0.717 . . . . 0.0 111.854 -177.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.512 HG23 ' HG3' ' A' ' 100' ' ' GLN . 8.7 p -91.61 146.29 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.437 0 C-N-CA 123.466 0.707 . . . . 0.0 110.26 177.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 36.0 t -163.94 85.55 0.47 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.865 0.466 . . . . 0.0 111.92 -172.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 35.6 t 55.91 6.36 0.21 Allowed 'General case' 0 N--CA 1.509 2.509 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 169.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 35.2 t 60.51 19.27 9.07 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 124.373 1.069 . . . . 0.0 111.815 -167.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -160.5 146.61 11.58 Favored Pre-proline 0 CA--C 1.56 1.328 0 C-N-CA 124.876 1.271 . . . . 0.0 110.395 -173.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_exo -47.49 -36.73 24.69 Favored 'Trans proline' 0 C--N 1.385 2.469 0 C-N-CA 123.812 3.008 . . . . 0.0 116.064 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.8 mtt -87.88 138.4 31.49 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.03 0.532 . . . . 0.0 110.882 173.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 19.2 p -86.02 85.51 7.37 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.466 0.706 . . . . 0.0 111.836 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -85.37 98.17 2.23 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-N 116.054 -0.521 . . . . 0.0 113.168 177.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -74.49 84.54 2.01 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -124.98 19.15 8.44 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.613 1.165 . . . . 0.0 109.343 163.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 38.9 ttp180 55.8 74.99 0.35 Allowed 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 124.818 1.247 . . . . 0.0 110.971 -170.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -119.41 -100.37 0.43 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 122.953 0.501 . . . . 0.0 110.577 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.43 ' O ' HG21 ' A' ' 14' ' ' VAL . . . -93.35 45.11 2.42 Favored Glycine 0 C--N 1.358 1.76 0 CA-C-N 118.09 0.404 . . . . 0.0 112.903 -177.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -106.41 -34.24 7.48 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.06 0.944 . . . . 0.0 108.787 169.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.687 ' SG ' ' HA ' ' A' ' 101' ' ' SER . 55.5 m 60.27 21.66 11.1 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.174 1.39 . . . . 0.0 113.15 174.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -87.2 59.57 5.66 Favored 'General case' 0 CA--C 1.556 1.176 0 CA-C-O 121.921 0.867 . . . . 0.0 110.107 -179.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.442 HG23 ' HG2' ' A' ' 103' ' ' GLU . 9.0 t -91.73 -21.11 20.9 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.357 174.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -68.39 126.44 29.62 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 168.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.48 -25.33 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 C-N-CA 123.59 0.756 . . . . 0.0 112.671 -176.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -169.02 -49.82 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.365 1.066 . . . . 0.0 109.583 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -142.73 -63.0 0.42 Allowed 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.314 -177.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 75.3 mtt85 -85.4 113.48 21.72 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.953 -177.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.4 -100.4 0.31 Allowed Glycine 0 CA--C 1.534 1.227 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 167.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.3 t -170.58 -64.99 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.541 0.736 . . . . 0.0 110.23 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -151.31 38.95 0.65 Allowed 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.454 0.702 . . . . 0.0 110.466 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 68.1 p -95.7 102.76 14.59 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.493 0.663 . . . . 0.0 111.303 -173.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.789 HG21 ' HB1' ' A' ' 82' ' ' ALA . 53.2 t -134.44 111.1 14.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.602 1.161 . . . . 0.0 109.516 175.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 78.2 m -107.44 106.69 17.21 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 169.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.538 ' HB2' HD11 ' A' ' 80' ' ' LEU . . . -143.76 152.39 41.19 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.679 1.191 . . . . 0.0 108.904 -175.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -117.54 109.57 16.87 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 121.638 -0.663 . . . . 0.0 111.71 -176.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.445 ' HB3' HD12 ' A' ' 50' ' ' LEU . 89.7 mmm -93.02 141.98 27.8 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.983 0.913 . . . . 0.0 110.838 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.4 p -93.78 156.84 16.45 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.025 0.53 . . . . 0.0 111.497 -176.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -68.15 -33.64 74.84 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.124 0.569 . . . . 0.0 111.713 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -53.61 -49.17 68.4 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 124.194 0.998 . . . . 0.0 111.307 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -77.48 -33.45 54.52 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.087 0.955 . . . . 0.0 111.864 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.479 ' HG ' HD23 ' A' ' 60' ' ' LEU . 5.2 mp -77.6 -33.71 53.68 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 113.55 0.945 . . . . 0.0 113.55 -176.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 61.0 mt -71.97 -34.67 69.15 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.901 0.481 . . . . 0.0 110.713 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.418 ' CD2' ' SD ' ' A' ' 93' ' ' MET . 81.9 t80 -63.44 -52.55 61.01 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.074 0.549 . . . . 0.0 110.688 175.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.7 t -67.63 -30.42 69.98 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.853 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.562 ' HG3' ' HA ' ' A' ' 59' ' ' ASP . 71.1 ttt-85 -61.08 -58.35 8.75 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.12 0.568 . . . . 0.0 111.416 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -84.09 4.9 28.16 Favored 'General case' 0 CA--C 1.556 1.206 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -176.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -70.36 -43.19 70.67 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 122.899 0.479 . . . . 0.0 110.772 167.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 160.95 38.11 0.02 OUTLIER Glycine 0 N--CA 1.479 1.518 0 N-CA-C 114.668 0.627 . . . . 0.0 114.668 176.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.438 ' O ' ' HA ' ' A' ' 54' ' ' ARG . 44.8 t-20 -174.51 118.21 0.21 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.809 0.843 . . . . 0.0 108.815 176.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.562 ' HA ' ' HG3' ' A' ' 54' ' ' ARG . 17.3 m-20 -69.79 105.83 2.91 Favored 'General case' 0 CA--C 1.555 1.151 0 CA-C-O 120.87 0.367 . . . . 0.0 111.889 178.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.479 HD23 ' HG ' ' A' ' 50' ' ' LEU . 8.2 mp -67.69 -30.59 70.15 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.92 0.888 . . . . 0.0 109.953 170.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.481 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 1.7 mpt? -100.3 -144.99 0.34 Allowed 'General case' 0 CA--C 1.563 1.457 0 C-N-CA 124.401 1.08 . . . . 0.0 108.145 168.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 70.4 p -96.39 165.41 16.25 Favored Pre-proline 0 N--CA 1.492 1.637 0 C-N-CA 123.26 0.624 . . . . 0.0 110.552 169.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -72.49 34.69 0.31 Allowed 'Trans proline' 0 C--N 1.39 2.747 0 C-N-CA 123.154 2.57 . . . . 0.0 114.225 174.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -116.51 145.81 36.08 Favored Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 124.2 1.0 . . . . 0.0 109.938 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -71.31 -6.99 20.39 Favored 'Trans proline' 0 C--N 1.382 2.318 0 C-N-CA 122.612 2.208 . . . . 0.0 113.528 175.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -80.5 168.05 19.4 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.049 0.94 . . . . 0.0 110.983 175.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -87.15 37.0 0.75 Allowed 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.454 0.702 . . . . 0.0 111.749 -174.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -84.69 112.06 20.13 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 124.088 0.955 . . . . 0.0 110.33 -179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -119.19 144.25 35.8 Favored Pre-proline 0 N--CA 1.486 1.364 0 C-N-CA 124.203 1.001 . . . . 0.0 110.606 177.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -69.6 -45.73 1.57 Allowed 'Trans proline' 0 C--N 1.374 1.915 0 C-N-CA 122.157 1.905 . . . . 0.0 112.762 173.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -175.79 145.72 7.81 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 55.37 92.37 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.722 1.209 . . . . 0.0 112.339 -175.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -165.96 1.35 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.112 0.965 . . . . 0.0 110.519 177.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.96 111.09 6.08 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.597 0.759 . . . . 0.0 112.686 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 109.3 -1.17 31.11 Favored Glycine 0 N--CA 1.474 1.208 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 175.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -74.77 93.8 2.65 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 117.55 0.675 . . . . 0.0 110.991 173.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -85.63 85.0 7.43 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 173.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.6 t90 163.11 127.7 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 125.27 1.428 . . . . 0.0 108.552 -171.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 51.4 t 52.28 27.3 4.64 Favored 'General case' 0 N--CA 1.505 2.294 0 C-N-CA 124.184 0.994 . . . . 0.0 112.744 174.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' A' ' 43' ' ' ALA . 2.6 tm? -66.11 130.41 43.14 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.216 -176.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.4 t -57.22 104.44 0.16 Allowed 'General case' 0 N--CA 1.474 0.732 0 O-C-N 123.638 0.586 . . . . 0.0 110.957 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.789 ' HB1' HG21 ' A' ' 41' ' ' VAL . . . -51.72 -35.72 44.13 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.652 1.181 . . . . 0.0 112.897 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.8 m -63.97 -32.81 74.48 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.055 0.942 . . . . 0.0 112.286 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.424 ' HD2' HD23 ' A' ' 60' ' ' LEU . 46.3 ttp180 -71.6 -47.75 52.72 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.246 0.618 . . . . 0.0 112.041 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.433 ' HE1' HD21 ' A' ' 115' ' ' LEU . 8.3 t-105 -59.21 -47.77 84.11 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.284 0.564 . . . . 0.0 109.966 174.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -60.31 -39.15 85.99 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.923 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -65.32 -43.28 91.47 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.137 0.575 . . . . 0.0 111.556 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.86 -24.98 60.94 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.244 0.217 . . . . 0.0 111.446 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.591 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 49.1 t80 -66.87 -48.52 68.55 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-O 120.909 0.385 . . . . 0.0 110.331 171.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -65.5 -27.05 68.2 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.807 0.843 . . . . 0.0 112.109 177.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.73 -2.31 22.83 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.348 0.659 . . . . 0.0 112.465 174.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.39 23.0 63.79 Favored Glycine 0 C--N 1.355 1.631 0 CA-C-N 116.662 -0.245 . . . . 0.0 113.542 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' MET . . . . . 0.418 ' SD ' ' CD2' ' A' ' 52' ' ' PHE . 67.9 mtp -114.6 -86.06 0.6 Allowed 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 123.571 0.749 . . . . 0.0 111.129 -175.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.591 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 63.71 108.47 0.03 OUTLIER Pre-proline 0 CA--C 1.573 1.83 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 175.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -67.59 167.68 20.27 Favored 'Trans proline' 0 C--N 1.386 2.52 0 C-N-CA 123.367 2.711 . . . . 0.0 113.809 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.05 105.54 0.85 Allowed 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.396 2.064 . . . . 0.0 111.97 171.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.5 p -95.16 142.58 13.36 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 C-N-CA 123.631 0.773 . . . . 0.0 110.934 -176.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.419 HG13 HD13 ' A' ' 120' ' ' LEU . 4.9 m -75.14 94.55 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.834 -178.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.442 HD13 ' HG2' ' A' ' 116' ' ' GLN . 3.3 mm? -58.9 -27.49 65.28 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 123.585 0.754 . . . . 0.0 112.352 173.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.512 ' HG3' HG23 ' A' ' 14' ' ' VAL . 10.5 tt0 -69.62 -47.01 64.94 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.742 0.817 . . . . 0.0 112.085 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.687 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 32.6 t -92.97 -30.47 15.33 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -171.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.8 p -56.6 121.03 8.76 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 170.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.442 ' HG2' HG23 ' A' ' 31' ' ' THR . 3.7 mp0 -84.83 172.55 11.34 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.893 0.877 . . . . 0.0 112.106 -177.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -72.55 -28.24 62.71 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 122.972 0.509 . . . . 0.0 111.015 -172.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.2 t -59.64 -25.97 65.13 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.63 0.772 . . . . 0.0 112.367 176.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.52 -37.65 70.73 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.885 0.874 . . . . 0.0 113.299 177.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.0 mp -65.81 2.78 0.93 Allowed 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -173.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 -98.4 -20.24 17.26 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 123.107 0.563 . . . . 0.0 111.618 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -109.07 -32.01 7.4 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.57 HG12 ' H ' ' A' ' 111' ' ' SER . 2.5 t -110.09 -166.06 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 CA-C-N 112.395 -2.184 . . . . 0.0 108.529 -178.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' SER . . . . . 0.57 ' H ' HG12 ' A' ' 110' ' ' VAL . 58.2 p -140.73 156.05 46.29 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 121.591 -0.693 . . . . 0.0 109.594 164.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.2 tt -53.5 -45.47 69.7 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.275 0.63 . . . . 0.0 112.114 173.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.17 -39.47 82.6 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.314 0.645 . . . . 0.0 111.997 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -64.52 -36.22 83.49 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.543 0.737 . . . . 0.0 112.02 175.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.433 HD21 ' HE1' ' A' ' 85' ' ' TRP . 39.2 mt -66.82 -55.58 14.2 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-O 121.214 0.53 . . . . 0.0 109.671 177.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.442 ' HG2' HD13 ' A' ' 99' ' ' LEU . 2.8 mt-30 -64.75 -34.88 79.37 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.27 1.028 . . . . 0.0 112.213 -172.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.8 -40.69 69.77 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.901 0.88 . . . . 0.0 112.656 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -123.76 47.61 2.01 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.288 0.635 . . . . 0.0 110.36 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -61.45 155.07 22.69 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 175.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.419 HD13 HG13 ' A' ' 98' ' ' VAL . 2.5 pt? -63.62 166.4 9.49 Favored Pre-proline 0 CA--C 1.567 1.621 0 C-N-CA 123.923 0.889 . . . . 0.0 111.753 173.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -54.08 108.17 0.27 Allowed 'Trans proline' 0 C--N 1.381 2.243 0 C-N-CA 122.665 2.243 . . . . 0.0 112.009 165.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 60.7 t -73.66 87.42 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 CA-C-O 121.703 0.763 . . . . 0.0 110.388 -177.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 94.6 mt -80.4 120.4 24.37 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.038 175.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -71.47 112.94 8.0 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.307 0.643 . . . . 0.0 110.327 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -99.5 132.75 44.62 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.819 0.848 . . . . 0.0 109.487 173.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -69.11 104.51 2.17 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.97 0.508 . . . . 0.0 111.122 -177.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 50.7 m80 -71.07 103.55 2.76 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.929 0.892 . . . . 0.0 110.818 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -80.98 8.54 8.18 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.536 0.734 . . . . 0.0 111.992 176.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -64.71 -28.18 69.42 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 123.646 0.778 . . . . 0.0 111.268 173.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 . . . . . 0 CA--C 1.57 1.722 0 CA-C-O 118.964 -0.541 . . . . 0.0 110.292 172.732 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.4 ttm . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 110.442 -0.207 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 77.75 -104.06 1.94 Allowed Glycine 0 CA--C 1.535 1.31 0 CA-C-N 116.377 -0.374 . . . . 0.0 113.912 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -118.28 150.09 40.05 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.757 0.823 . . . . 0.0 110.434 -176.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.52 148.37 48.38 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 114.229 0.451 . . . . 0.0 114.229 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -90.78 165.55 13.59 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.077 0.951 . . . . 0.0 111.463 -175.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.675 ' HB3' ' HZ2' ' A' ' 104' ' ' LYS . 0.1 OUTLIER -158.8 -175.02 5.06 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.464 0.706 . . . . 0.0 111.637 -174.375 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.0 m -110.43 -14.27 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 C-N-CA 123.494 0.717 . . . . 0.0 111.456 175.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.9 mp -87.07 -63.62 1.28 Allowed 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.015 0.526 . . . . 0.0 111.125 -162.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -164.22 -62.27 0.02 OUTLIER Glycine 0 CA--C 1.529 0.925 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.111 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.596 ' HG3' ' H ' ' A' ' 11' ' ' ASP . 18.8 pt20 -143.94 -71.79 0.29 Allowed 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.96 0.904 . . . . 0.0 110.175 177.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.596 ' H ' ' HG3' ' A' ' 10' ' ' GLN . 11.0 m-20 55.57 162.97 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 125.711 1.604 . . . . 0.0 114.402 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.1 tp 70.01 157.25 0.16 Allowed 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 124.668 1.187 . . . . 0.0 110.487 -167.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 67.42 -159.97 0.23 Allowed 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 124.351 1.06 . . . . 0.0 111.193 -177.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.577 HG21 ' H ' ' A' ' 28' ' ' PHE . 12.8 p -66.39 152.93 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.434 0 C-N-CA 123.162 0.585 . . . . 0.0 111.441 174.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.403 ' SG ' ' HB3' ' A' ' 28' ' ' PHE . 30.3 p -53.74 -32.5 52.37 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 123.597 0.759 . . . . 0.0 112.151 172.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.489 ' H ' HG22 ' A' ' 14' ' ' VAL . 49.5 t 73.06 -65.68 0.35 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 125.737 1.615 . . . . 0.0 112.618 175.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 43.4 t -75.75 76.96 2.7 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 121.598 0.713 . . . . 0.0 111.351 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -168.46 132.52 1.36 Allowed Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.611 1.164 . . . . 0.0 108.979 -178.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -57.04 143.44 92.8 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 123.05 2.5 . . . . 0.0 114.18 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.9 mtt 65.7 8.04 4.93 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 172.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 72.7 p -80.56 -56.46 4.15 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-N 118.517 0.599 . . . . 0.0 109.726 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 57.62 -104.58 0.45 Allowed Glycine 0 C--N 1.35 1.321 0 C-N-CA 124.297 0.951 . . . . 0.0 114.604 170.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 11.7 m-90 -82.94 57.33 3.83 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.861 0.864 . . . . 0.0 111.0 177.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 74.77 -44.16 0.54 Allowed 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 125.962 1.705 . . . . 0.0 114.608 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 53.6 ttt-85 68.02 -73.09 0.09 Allowed 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.849 1.26 . . . . 0.0 110.501 -169.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -141.38 4.01 1.76 Allowed 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.304 1.042 . . . . 0.0 111.111 175.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 78.27 77.46 0.86 Allowed Glycine 0 CA--C 1.534 1.219 0 N-CA-C 110.951 -0.859 . . . . 0.0 110.951 -166.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.577 ' H ' HG21 ' A' ' 14' ' ' VAL . 28.4 t80 -63.52 148.21 49.33 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.355 0.662 . . . . 0.0 111.911 -175.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 75.4 m 72.56 22.36 3.34 Favored 'General case' 0 N--CA 1.5 2.042 0 C-N-CA 125.683 1.593 . . . . 0.0 112.186 -172.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -80.27 107.53 13.14 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.629 0.772 . . . . 0.0 110.46 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.6 t -117.89 102.28 8.96 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.23 0.612 . . . . 0.0 111.22 -177.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -155.85 160.95 40.63 Favored 'General case' 0 CA--C 1.555 1.173 0 CA-C-O 121.077 0.465 . . . . 0.0 111.439 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -69.96 -34.33 59.43 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.426 0 C-N-CA 124.09 0.956 . . . . 0.0 112.894 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -154.12 -60.44 0.13 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.142 0.577 . . . . 0.0 111.638 -174.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -70.97 95.0 1.13 Allowed 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.714 0.805 . . . . 0.0 111.4 -169.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -59.59 100.21 0.08 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 114.698 -1.137 . . . . 0.0 112.606 -178.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.46 -136.69 7.35 Favored Glycine 0 C--N 1.347 1.176 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.787 178.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.2 t -86.83 84.29 7.38 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.418 0.687 . . . . 0.0 111.383 -177.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -144.17 14.08 1.65 Allowed 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 124.032 0.933 . . . . 0.0 110.285 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 26.4 m -92.41 108.14 19.74 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.268 0.627 . . . . 0.0 110.704 -167.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.515 HG22 ' HB1' ' A' ' 82' ' ' ALA . 26.2 t -131.37 112.98 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 124.267 1.027 . . . . 0.0 110.426 -177.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 81.6 m -107.09 108.04 19.32 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 171.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.402 ' HB2' HD13 ' A' ' 80' ' ' LEU . . . -145.12 153.74 41.72 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.28 1.032 . . . . 0.0 109.138 -176.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.669 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 27.8 tt0 -119.12 107.76 13.86 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 118.708 0.685 . . . . 0.0 111.88 177.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.606 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 81.5 mmm -84.8 114.47 22.1 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.102 0.961 . . . . 0.0 109.035 166.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.6 t -80.94 151.61 28.45 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 122.86 0.464 . . . . 0.0 110.301 -176.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.413 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 28.8 tt0 -56.84 -33.62 66.97 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 123.558 0.536 . . . . 0.0 111.706 -175.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -50.76 -55.69 15.56 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 124.165 0.986 . . . . 0.0 110.99 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -79.67 -29.61 40.93 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 124.661 1.185 . . . . 0.0 113.189 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.1 tp -82.69 -24.49 33.65 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.304 0.641 . . . . 0.0 111.894 -173.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.403 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 63.8 mt -64.92 -34.03 77.42 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 122.885 0.474 . . . . 0.0 110.55 171.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -58.31 -44.46 88.6 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.13 0.572 . . . . 0.0 110.899 169.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.1 m -68.88 -30.06 68.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.201 0.6 . . . . 0.0 111.777 175.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.683 ' HA ' ' HB3' ' A' ' 59' ' ' ASP . 39.3 ttp180 -67.1 -55.88 12.36 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.989 0.916 . . . . 0.0 111.849 -177.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -69.72 -13.38 62.26 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.661 0.784 . . . . 0.0 112.089 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -76.28 -23.1 54.39 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.056 0.943 . . . . 0.0 111.326 170.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.96 -7.12 57.08 Favored Glycine 0 N--CA 1.477 1.396 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.932 -176.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -97.65 39.05 1.23 Allowed 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 124.244 1.017 . . . . 0.0 111.232 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.683 ' HB3' ' HA ' ' A' ' 54' ' ' ARG . 3.9 p-10 -69.94 120.88 16.33 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-O 121.429 0.633 . . . . 0.0 112.252 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.9 tp -97.33 26.27 4.98 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-O 121.989 0.899 . . . . 0.0 109.316 169.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.493 ' SD ' ' HB1' ' A' ' 74' ' ' ALA . 19.5 mmt -72.28 -60.66 2.12 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.461 1.104 . . . . 0.0 110.835 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.488 HG23 ' HG3' ' A' ' 64' ' ' ARG . 26.8 m 56.86 94.86 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.231 0 C-N-CA 124.979 1.312 . . . . 0.0 110.793 -171.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -52.1 -48.25 22.58 Favored 'Trans proline' 0 C--N 1.383 2.38 0 C-N-CA 123.232 2.621 . . . . 0.0 113.887 -174.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.488 ' HG3' HG23 ' A' ' 62' ' ' THR . 64.1 mtm180 56.18 86.5 0.16 Allowed Pre-proline 0 N--CA 1.488 1.439 0 C-N-CA 123.511 0.724 . . . . 0.0 111.21 -177.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -82.71 24.11 0.76 Allowed 'Trans proline' 0 C--N 1.372 1.795 0 C-N-CA 123.189 2.593 . . . . 0.0 113.659 -172.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -88.54 -92.61 0.11 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.066 0.947 . . . . 0.0 110.263 -173.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -142.01 -81.02 0.22 Allowed 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 176.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -158.9 115.44 2.69 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.12 0.968 . . . . 0.0 109.276 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -128.49 153.86 79.33 Favored Pre-proline 0 N--CA 1.489 1.493 0 C-N-CA 124.164 0.986 . . . . 0.0 110.861 -173.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.22 177.11 2.72 Favored 'Trans proline' 0 C--N 1.386 2.543 0 C-N-CA 122.946 2.431 . . . . 0.0 114.6 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 123.11 -132.09 8.46 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.287 -174.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -149.64 175.57 11.43 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.435 0.694 . . . . 0.0 111.204 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.38 -174.78 4.67 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.743 0.817 . . . . 0.0 110.464 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.493 ' HB1' ' SD ' ' A' ' 61' ' ' MET . . . -62.09 106.85 0.77 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.509 0.723 . . . . 0.0 112.844 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 82.43 56.94 2.71 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.952 -174.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -147.03 107.21 4.02 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 123.683 0.793 . . . . 0.0 110.462 176.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.669 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 4.8 ptp180 -79.78 89.83 5.23 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.245 0.618 . . . . 0.0 111.606 -176.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 31.3 t-105 -178.06 122.07 0.1 Allowed 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.789 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 42.3 t 52.36 53.82 11.72 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.155 0.982 . . . . 0.0 112.226 174.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.402 HD13 ' HB2' ' A' ' 43' ' ' ALA . 3.3 tm? -92.99 124.24 36.82 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.626 -175.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 61.5 m -59.39 111.97 1.58 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.023 0.529 . . . . 0.0 109.995 173.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.515 ' HB1' HG22 ' A' ' 41' ' ' VAL . . . -57.47 -27.29 62.36 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -171.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.8 m -69.59 -28.76 66.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.396 0.679 . . . . 0.0 112.266 176.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -61.89 -45.11 95.18 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.803 0.841 . . . . 0.0 111.325 175.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.606 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 1.3 t-105 -70.85 -47.92 56.73 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.63 174.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.435 HE21 ' HG3' ' A' ' 90' ' ' GLU . 21.2 tp60 -56.15 -42.79 77.56 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.098 0.959 . . . . 0.0 111.665 -177.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -55.31 -45.54 76.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.724 0.81 . . . . 0.0 111.574 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.21 -37.76 86.57 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.457 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.555 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 51.6 t80 -71.9 -34.41 69.11 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 122.439 0.296 . . . . 0.0 111.649 178.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.435 ' HG3' HE21 ' A' ' 86' ' ' GLN . 58.3 mt-10 -69.45 -23.11 63.63 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.206 0.602 . . . . 0.0 111.754 178.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.61 -11.37 59.66 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.558 0.743 . . . . 0.0 111.99 170.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.81 8.8 86.31 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-N 116.496 -0.32 . . . . 0.0 112.995 -174.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 25.9 ttt -88.13 -77.95 0.34 Allowed 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 124.313 1.045 . . . . 0.0 110.135 -174.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.555 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 61.94 114.18 0.02 OUTLIER Pre-proline 0 N--CA 1.497 1.905 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 167.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.423 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 92.6 Cg_endo -74.6 171.46 18.12 Favored 'Trans proline' 0 CA--C 1.572 2.39 0 C-N-CA 122.824 2.349 . . . . 0.0 113.152 171.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.38 111.15 2.65 Favored 'Trans proline' 0 C--N 1.383 2.394 0 C-N-CA 122.057 1.838 . . . . 0.0 111.778 171.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -97.35 134.26 35.96 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 123.065 0.546 . . . . 0.0 110.525 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.1 m -67.97 98.78 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 123.954 0.902 . . . . 0.0 113.231 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.478 HD22 ' HB3' ' A' ' 115' ' ' LEU . 3.6 mm? -73.57 -13.4 61.02 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.743 -0.598 . . . . 0.0 112.062 172.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -83.18 -12.45 56.89 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 124.273 1.029 . . . . 0.0 112.418 176.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.2 t -130.73 -26.35 2.23 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -174.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.3 p -55.33 106.0 0.21 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.407 0.622 . . . . 0.0 112.098 170.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -61.77 141.28 58.0 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 125.09 1.356 . . . . 0.0 110.968 168.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.675 ' HZ2' ' HB3' ' A' ' 6' ' ' ASN . 21.5 ptmt -61.33 -17.52 54.19 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -177.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 69.6 m -58.19 -27.33 63.78 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 123.186 0.594 . . . . 0.0 112.594 171.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.05 -28.29 68.96 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.573 0.749 . . . . 0.0 112.712 173.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 104' ' ' LYS . 7.9 mp -70.31 1.99 4.31 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 124.29 1.036 . . . . 0.0 113.65 -175.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 48.3 mtp180 -88.75 -35.29 16.77 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.143 0.577 . . . . 0.0 111.235 167.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -91.34 -49.47 6.33 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.212 1.005 . . . . 0.0 110.361 -174.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.546 HG23 ' HE1' ' A' ' 85' ' ' TRP . 6.9 p -106.08 176.02 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.367 0 C-N-CA 124.407 1.083 . . . . 0.0 108.496 169.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 47.0 m -116.17 153.26 32.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.975 -1.078 . . . . 0.0 109.992 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.8 tt -57.09 -36.5 70.67 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.511 0.724 . . . . 0.0 112.603 179.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.22 -34.16 73.26 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.5 -36.72 79.31 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.499 0.719 . . . . 0.0 110.526 175.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.478 ' HB3' HD22 ' A' ' 99' ' ' LEU . 85.6 mt -68.35 -52.74 29.91 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.376 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -73.77 -27.86 61.37 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 114.73 -1.123 . . . . 0.0 112.672 -172.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -66.97 -17.16 64.79 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 175.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -130.42 20.01 5.24 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 123.383 0.673 . . . . 0.0 111.955 172.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -90.6 -162.84 0.94 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.644 0.778 . . . . 0.0 110.475 168.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.39 150.27 65.39 Favored Pre-proline 0 CA--C 1.562 1.407 0 CA-C-O 119.012 -0.518 . . . . 0.0 110.788 167.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.29 82.23 0.05 OUTLIER 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.48 2.786 . . . . 0.0 114.562 -175.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 42.7 t -106.45 92.58 2.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 124.437 1.095 . . . . 0.0 108.446 176.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.1 pp -80.0 108.03 13.26 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-O 121.465 0.65 . . . . 0.0 111.218 -179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -105.28 137.04 43.71 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.05 0.54 . . . . 0.0 110.746 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 35.6 p80 -111.01 6.92 21.32 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 124.389 1.075 . . . . 0.0 113.061 -173.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 52.2 m170 -60.13 113.85 2.56 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 47.1 p-80 -163.14 165.68 24.29 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.212 1.005 . . . . 0.0 110.703 174.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 11.0 p-80 -163.94 166.06 22.04 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.049 0.94 . . . . 0.0 110.778 175.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -88.46 140.61 29.29 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.515 0.726 . . . . 0.0 110.314 176.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 29.5 p-80 . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 119.523 -0.275 . . . . 0.0 110.647 172.051 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtt . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 120.478 0.18 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -74.87 91.81 0.8 Allowed Glycine 0 CA--C 1.541 1.658 0 CA-C-N 116.477 -0.329 . . . . 0.0 113.833 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -78.28 111.9 14.72 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.497 0.719 . . . . 0.0 110.566 176.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -148.2 174.91 27.74 Favored Glycine 0 C--N 1.349 1.303 0 N-CA-C 113.994 0.358 . . . . 0.0 113.994 -175.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -90.63 130.32 36.66 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.713 0.805 . . . . 0.0 110.213 -176.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -143.84 158.47 43.66 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.842 0.857 . . . . 0.0 110.811 -178.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 21.7 t 72.71 -48.29 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.398 0 C-N-CA 126.149 1.779 . . . . 0.0 112.783 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.402 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 2.6 pp -65.75 -48.67 71.1 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.659 0.784 . . . . 0.0 111.663 -176.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -89.24 39.87 3.1 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 114.353 0.501 . . . . 0.0 114.353 -173.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -160.38 -47.37 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.89 0.876 . . . . 0.0 110.543 -176.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -86.03 -37.89 18.45 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.843 0.857 . . . . 0.0 110.926 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.505 ' HG ' ' H ' ' A' ' 13' ' ' GLU . 14.1 tp -118.49 -151.56 0.48 Allowed 'General case' 0 CA--C 1.569 1.706 0 C-N-CA 123.83 0.852 . . . . 0.0 109.612 -177.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.505 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 26.1 mm-40 66.84 176.64 0.24 Allowed 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.315 1.446 . . . . 0.0 112.716 -175.248 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.7 p -60.74 123.19 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-O 121.289 0.566 . . . . 0.0 111.453 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.592 ' SG ' ' HA ' ' A' ' 21' ' ' THR . 37.0 t -137.48 98.46 3.7 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.507 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 p -121.02 150.33 41.32 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.502 1.121 . . . . 0.0 110.371 173.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 54.0 t 72.95 -59.07 0.58 Allowed 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 125.373 1.469 . . . . 0.0 113.606 176.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.6 150.13 18.86 Favored Pre-proline 0 CA--C 1.564 1.499 0 C-N-CA 124.788 1.235 . . . . 0.0 113.629 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -56.85 129.99 37.49 Favored 'Trans proline' 0 C--N 1.392 2.846 0 C-N-CA 123.247 2.631 . . . . 0.0 112.785 -178.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 10.9 tmm? 65.0 95.26 0.05 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.959 1.303 . . . . 0.0 110.281 -171.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.592 ' HA ' ' SG ' ' A' ' 15' ' ' CYS . 43.2 p -96.2 169.19 10.11 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.288 0.635 . . . . 0.0 111.406 176.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -54.75 -48.95 63.58 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 123.446 0.466 . . . . 0.0 114.115 -178.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 31.5 t90 67.43 163.83 0.2 Allowed 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.745 1.218 . . . . 0.0 112.554 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 44.3 t80 68.37 -87.65 0.03 OUTLIER 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 124.536 1.134 . . . . 0.0 111.751 172.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 65.7 mmt-85 -142.78 22.64 1.95 Allowed 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 124.658 1.183 . . . . 0.0 109.966 178.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -126.92 142.48 51.54 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.042 0.937 . . . . 0.0 110.491 -166.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 88.1 -92.09 1.78 Allowed Glycine 0 CA--C 1.531 1.077 0 CA-C-N 114.766 -1.106 . . . . 0.0 113.922 170.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -90.54 143.13 27.05 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.191 0.596 . . . . 0.0 111.955 -171.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 85.4 m -130.21 -175.55 3.66 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.574 1.15 . . . . 0.0 111.029 -178.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -77.27 70.65 3.69 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.227 0.611 . . . . 0.0 112.493 -178.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.1 t -168.32 157.14 8.94 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.244 0.618 . . . . 0.0 111.322 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -109.19 156.89 19.34 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.295 0.638 . . . . 0.0 109.384 168.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 13.4 p -64.91 -35.92 76.47 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 123.609 0.763 . . . . 0.0 112.832 -174.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -72.78 -21.17 61.03 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.563 0.745 . . . . 0.0 112.573 -171.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -76.92 19.19 0.31 Allowed 'General case' 0 CA--C 1.564 1.483 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -177.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? 61.38 22.4 12.8 Favored 'General case' 0 CA--C 1.567 1.626 0 C-N-CA 124.463 1.105 . . . . 0.0 111.703 175.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.12 6.03 67.53 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 114.947 0.739 . . . . 0.0 114.947 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.2 m -92.96 20.26 6.88 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.754 0.822 . . . . 0.0 112.121 -179.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 105' ' ' SER . 68.3 m80 67.58 174.44 0.26 Allowed 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 125.341 1.456 . . . . 0.0 112.277 -178.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 60.3 p -94.19 100.45 12.52 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.461 0.648 . . . . 0.0 110.35 -175.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.7 HG13 ' HB1' ' A' ' 82' ' ' ALA . 39.3 t -136.26 102.65 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 C-N-CA 123.615 0.766 . . . . 0.0 109.982 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.568 ' SG ' ' HA ' ' A' ' 78' ' ' TRP . 80.2 m -111.18 107.39 16.71 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 174.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.475 ' HB1' HD13 ' A' ' 80' ' ' LEU . . . -138.57 150.4 46.28 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -172.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.501 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 20.7 tt0 -116.96 130.24 56.57 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.775 0.322 . . . . 0.0 111.246 -175.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.433 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 37.6 mtm -116.33 154.24 30.56 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.409 173.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.5 HG21 ' HB3' ' A' ' 95' ' ' PRO . 9.2 t -92.91 156.22 17.08 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.755 0.822 . . . . 0.0 110.517 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.443 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 37.1 tt0 -54.38 -32.69 57.63 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.198 0.599 . . . . 0.0 112.313 -175.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -48.99 -53.17 21.05 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.622 1.169 . . . . 0.0 112.351 -176.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.466 ' HA ' ' HD2' ' A' ' 52' ' ' PHE . 53.8 t80 -71.05 -40.6 71.58 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 177.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.407 HD11 ' HB2' ' A' ' 45' ' ' MET . 8.9 mp -63.78 -24.52 67.79 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.827 0.451 . . . . 0.0 111.36 -178.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.443 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 92.8 mt -71.28 -45.87 62.15 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.924 0.889 . . . . 0.0 110.939 170.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.466 ' HD2' ' HA ' ' A' ' 49' ' ' PHE . 25.9 m-85 -58.35 -31.76 67.9 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 123.121 0.568 . . . . 0.0 111.258 174.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 58.5 m -71.29 -42.03 69.21 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 115.542 -0.753 . . . . 0.0 110.979 173.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.439 ' HB2' ' HE1' ' A' ' 61' ' ' MET . 38.6 ttt180 -61.58 -39.32 90.76 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.554 0.742 . . . . 0.0 112.482 -178.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -64.41 -16.12 61.8 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -70.94 -21.13 62.38 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.131 0.573 . . . . 0.0 112.526 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -167.33 37.48 0.23 Allowed Glycine 0 C--N 1.355 1.584 0 CA-C-O 119.977 -0.346 . . . . 0.0 113.857 -178.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 78.42 -40.62 0.29 Allowed 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 125.846 1.658 . . . . 0.0 114.39 170.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -138.08 -78.78 0.36 Allowed 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 123.044 0.538 . . . . 0.0 112.068 -177.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 36.15 24.32 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 116.417 2.006 . . . . 0.0 116.417 -173.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.439 ' HE1' ' HB2' ' A' ' 54' ' ' ARG . 56.8 mtt -93.36 -41.61 9.74 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.605 0.762 . . . . 0.0 109.607 171.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 91.5 m -146.3 133.31 10.02 Favored Pre-proline 0 CA--C 1.553 1.067 0 C-N-CA 124.585 1.154 . . . . 0.0 108.989 175.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -67.62 133.08 28.72 Favored 'Trans proline' 0 C--N 1.375 1.949 0 C-N-CA 122.138 1.892 . . . . 0.0 111.621 169.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 69.37 153.89 0.14 Allowed Pre-proline 0 N--CA 1.501 2.077 0 C-N-CA 124.894 1.277 . . . . 0.0 112.673 176.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.01 -13.93 23.74 Favored 'Trans proline' 0 C--N 1.386 2.505 0 C-N-CA 122.199 1.932 . . . . 0.0 112.331 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -134.38 118.16 17.14 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.245 -1.021 . . . . 0.0 108.245 174.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -139.28 16.15 2.59 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.594 0.758 . . . . 0.0 111.171 -173.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 24.4 m-80 67.64 -71.29 0.11 Allowed 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 125.46 1.504 . . . . 0.0 111.577 -176.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -113.47 136.72 21.94 Favored Pre-proline 0 CA--C 1.559 1.309 0 C-N-CA 124.312 1.045 . . . . 0.0 110.692 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -80.1 145.9 17.67 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.411 2.074 . . . . 0.0 112.094 169.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -81.77 -162.78 30.54 Favored Glycine 0 CA--C 1.534 1.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 112.925 175.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 78' ' ' TRP . 3.0 mm? -76.53 111.27 11.83 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.137 0.494 . . . . 0.0 111.138 -178.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.0 pttm -104.51 -168.39 1.48 Allowed 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 123.742 0.817 . . . . 0.0 110.226 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.67 125.78 25.43 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.475 0.71 . . . . 0.0 111.592 176.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.75 -2.61 70.03 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 114.41 0.524 . . . . 0.0 114.41 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -97.09 123.06 40.74 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.079 0.551 . . . . 0.0 110.539 173.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.501 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.1 OUTLIER -114.89 91.22 3.55 Favored 'General case' 0 CA--C 1.574 1.88 0 CA-C-O 121.919 0.866 . . . . 0.0 110.437 176.643 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.568 ' HA ' ' SG ' ' A' ' 42' ' ' CYS . 75.0 t90 -172.28 124.49 0.5 Allowed 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.318 0.647 . . . . 0.0 110.098 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 86.9 m 50.59 26.13 2.31 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.475 HD13 ' HB1' ' A' ' 43' ' ' ALA . 3.2 tm? -66.31 118.52 10.1 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 6.4 p -61.98 105.92 0.64 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 122.993 0.517 . . . . 0.0 110.564 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.7 ' HB1' HG13 ' A' ' 41' ' ' VAL . . . -55.16 -23.61 22.37 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.953 1.301 . . . . 0.0 113.775 -176.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.7 m -58.92 -38.77 79.7 Favored 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 123.503 0.721 . . . . 0.0 112.425 173.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.3 mmm-85 -74.97 -36.12 62.05 Favored 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 123.726 0.81 . . . . 0.0 112.433 178.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.519 ' HE1' HD21 ' A' ' 115' ' ' LEU . 7.7 t-105 -64.88 -45.8 84.47 Favored 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 173.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -57.94 -43.89 86.6 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.85 0.86 . . . . 0.0 110.792 173.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -55.28 -38.32 68.44 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.515 1.126 . . . . 0.0 112.024 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.34 94.03 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 174.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -68.26 -40.25 81.95 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 122.586 0.354 . . . . 0.0 111.48 174.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -63.48 -33.34 75.35 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.016 0.926 . . . . 0.0 111.785 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.29 -15.97 25.24 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 123.843 0.857 . . . . 0.0 112.138 175.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.87 -20.93 37.5 Favored Glycine 0 CA--C 1.542 1.779 0 N-CA-C 115.202 0.841 . . . . 0.0 115.202 175.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -89.79 33.08 0.86 Allowed 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 118.054 0.927 . . . . 0.0 113.023 -174.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.22 112.79 4.54 Favored Pre-proline 0 CA--C 1.569 1.679 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.5 ' HB3' HG21 ' A' ' 46' ' ' THR . 57.4 Cg_exo -59.83 171.51 2.8 Favored 'Trans proline' 0 CA--C 1.568 2.182 0 C-N-CA 123.947 3.098 . . . . 0.0 114.825 172.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -80.1 113.15 2.92 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.719 2.279 . . . . 0.0 111.983 168.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 9.7 p -99.25 156.78 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 123.884 0.873 . . . . 0.0 110.642 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.497 HG23 ' HB3' ' A' ' 101' ' ' SER . 33.3 m -81.44 164.32 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.096 0 CA-C-O 121.608 0.718 . . . . 0.0 112.228 173.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 83.5 mt -112.55 -13.78 13.28 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.973 0.909 . . . . 0.0 110.056 163.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -71.6 -70.47 0.32 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.735 0.814 . . . . 0.0 111.208 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.497 ' HB3' HG23 ' A' ' 98' ' ' VAL . 34.6 t -66.26 -31.55 72.43 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.219 0.608 . . . . 0.0 112.061 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 76.2 m -62.67 127.38 31.04 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.61 0.764 . . . . 0.0 111.938 175.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -98.97 164.27 12.25 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.891 0.877 . . . . 0.0 110.842 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.438 ' HD3' HD21 ' A' ' 107' ' ' LEU . 3.0 tppp? -53.5 -32.83 52.01 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 125.422 1.489 . . . . 0.0 113.595 176.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.456 ' HB3' ' HB3' ' A' ' 39' ' ' HIS . 56.7 m -60.5 -26.06 66.54 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 178.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.68 -33.45 72.87 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.393 0.677 . . . . 0.0 112.667 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.438 HD21 ' HD3' ' A' ' 104' ' ' LYS . 8.8 mp -61.65 -24.46 66.75 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.923 0.889 . . . . 0.0 112.264 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -74.34 -11.49 60.27 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.978 0.911 . . . . 0.0 112.81 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -116.3 -48.99 2.69 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.041 0.937 . . . . 0.0 111.708 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.473 HG23 ' CD1' ' A' ' 85' ' ' TRP . 14.8 p -113.25 -24.33 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -169.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 46.2 t 75.2 148.17 0.1 Allowed 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 125.112 1.365 . . . . 0.0 112.607 -173.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.479 ' HA ' HD12 ' A' ' 115' ' ' LEU . 3.8 tt -58.59 -39.05 79.29 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.487 1.115 . . . . 0.0 112.149 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.72 -38.83 70.28 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.278 0.631 . . . . 0.0 112.686 -176.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -67.17 -44.74 78.96 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.589 0.756 . . . . 0.0 110.373 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.519 HD21 ' HE1' ' A' ' 85' ' ' TRP . 63.8 mt -58.99 -46.86 87.09 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.814 0.816 . . . . 0.0 110.114 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -74.98 -29.96 61.05 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 114.131 -1.395 . . . . 0.0 112.828 -176.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.91 -19.31 60.34 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.341 170.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -123.33 6.49 9.05 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.788 0.835 . . . . 0.0 112.489 178.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -127.72 -88.46 0.55 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.374 0.669 . . . . 0.0 111.296 177.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -161.06 159.69 24.64 Favored Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 123.88 0.872 . . . . 0.0 110.808 179.125 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -60.26 150.83 77.75 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 123.037 2.491 . . . . 0.0 114.202 174.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.7 p -71.95 122.75 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 122.991 0.517 . . . . 0.0 110.277 173.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tt -79.57 71.55 6.18 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-O 122.12 0.962 . . . . 0.0 109.025 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -142.13 113.0 7.39 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.906 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -169.8 20.28 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 124.217 1.007 . . . . 0.0 110.1 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 53.4 p-80 -76.28 79.47 3.05 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.427 1.108 . . . . 0.0 111.781 -171.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 56.5 m80 -140.21 104.16 4.75 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.51 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -126.56 85.38 2.38 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.759 0.824 . . . . 0.0 109.147 172.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -155.89 130.62 9.11 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.228 0.611 . . . . 0.0 110.228 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 . . . . . 0 CA--C 1.561 1.381 0 C-N-CA 123.491 0.717 . . . . 0.0 109.433 172.881 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.8 mtp . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 120.425 0.155 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -167.18 95.33 0.12 Allowed Glycine 0 C--N 1.349 1.256 0 CA-C-N 116.673 -0.239 . . . . 0.0 112.811 -178.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -119.66 114.63 22.49 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.515 0.726 . . . . 0.0 110.252 178.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.37 -145.15 8.54 Favored Glycine 0 N--CA 1.476 1.312 0 N-CA-C 111.905 -0.478 . . . . 0.0 111.905 168.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -130.59 118.3 20.82 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.394 0.678 . . . . 0.0 110.123 173.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -146.47 94.22 2.41 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-O 122.327 1.06 . . . . 0.0 110.229 -168.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.475 HG23 ' HG ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -157.31 -53.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.117 1.367 . . . . 0.0 109.501 -176.449 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.475 ' HG ' HG23 ' A' ' 7' ' ' VAL . 82.2 mt -97.6 -28.87 13.74 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 114.745 -1.116 . . . . 0.0 112.629 -168.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 77.55 90.33 0.31 Allowed Glycine 0 C--N 1.349 1.256 0 N-CA-C 112.339 -0.304 . . . . 0.0 112.339 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -137.0 161.14 36.88 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.068 0.947 . . . . 0.0 109.609 -176.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.2 t70 62.14 31.14 17.84 Favored 'General case' 0 CA--C 1.568 1.648 0 C-N-CA 124.385 1.074 . . . . 0.0 110.528 -173.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.9 tt -87.79 131.54 34.48 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.218 1.007 . . . . 0.0 110.052 -174.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -108.93 154.98 21.38 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.632 0.773 . . . . 0.0 110.954 177.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 14.6 p -156.42 139.59 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 123.376 0.67 . . . . 0.0 110.996 173.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.8 m -93.84 -75.43 0.5 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.399 0.68 . . . . 0.0 110.163 175.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.0 t 50.66 101.33 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 125.228 1.411 . . . . 0.0 114.5 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.5 m 70.75 -3.25 2.01 Favored 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 124.854 1.261 . . . . 0.0 113.78 173.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.87 158.06 87.78 Favored Pre-proline 0 CA--C 1.562 1.432 0 C-N-CA 123.939 0.896 . . . . 0.0 111.562 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -60.91 121.43 9.67 Favored 'Trans proline' 0 C--N 1.375 1.958 0 C-N-CA 122.058 1.839 . . . . 0.0 111.882 171.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.405 ' HG2' ' HB2' ' A' ' 23' ' ' TRP . 42.6 ttm 68.29 43.14 1.55 Allowed 'General case' 0 CA--C 1.564 1.519 0 C-N-CA 125.324 1.449 . . . . 0.0 111.412 -177.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.3 m -63.22 106.91 0.95 Allowed 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.161 170.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 138.14 -22.05 3.11 Favored Glycine 0 N--CA 1.474 1.232 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.735 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.405 ' HB2' ' HG2' ' A' ' 20' ' ' MET . 81.6 t90 -58.13 -45.68 86.9 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.3 0.64 . . . . 0.0 111.419 177.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -69.71 -28.27 65.68 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.35 0.66 . . . . 0.0 112.08 175.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.416 ' NH1' ' HA ' ' A' ' 33' ' ' VAL . 28.0 ttp85 70.41 -68.5 0.2 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.419 1.488 . . . . 0.0 112.747 177.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -44.23 -48.48 9.37 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 125.389 1.475 . . . . 0.0 114.029 -175.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.21 22.73 5.86 Favored Glycine 0 CA--C 1.542 1.758 0 N-CA-C 115.976 1.15 . . . . 0.0 115.976 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -162.56 -67.32 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 117.949 0.875 . . . . 0.0 109.885 175.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.9 t -82.64 65.23 7.66 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.201 1.0 . . . . 0.0 110.297 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -87.83 58.53 4.91 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-O 122.708 1.242 . . . . 0.0 110.497 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.1 t -94.13 36.43 1.13 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 125.758 1.623 . . . . 0.0 110.309 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 62.72 -79.34 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 124.971 1.308 . . . . 0.0 110.532 -165.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.416 ' HA ' ' NH1' ' A' ' 25' ' ' ARG . 86.9 t -131.38 -50.2 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 124.117 0.967 . . . . 0.0 108.719 168.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -156.7 -48.96 0.07 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 124.112 0.965 . . . . 0.0 110.937 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.426 ' HB3' ' HB2' ' A' ' 39' ' ' HIS . 34.2 t70 50.27 79.88 0.08 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 125.492 1.517 . . . . 0.0 112.67 -175.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mtm180 69.27 -8.89 0.66 Allowed 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 125.328 1.451 . . . . 0.0 113.622 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 147.68 -48.47 0.64 Allowed Glycine 0 C--N 1.348 1.21 0 N-CA-C 112.034 -0.426 . . . . 0.0 112.034 -175.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 t -160.24 142.28 12.9 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.093 0.557 . . . . 0.0 111.628 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.426 ' HB2' ' HB3' ' A' ' 35' ' ' ASP . 8.9 t-160 -155.14 42.98 0.46 Allowed 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.335 1.054 . . . . 0.0 109.179 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.414 ' HG1' ' HB3' ' A' ' 103' ' ' GLU . 56.4 p -93.86 102.35 14.46 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.229 -172.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.42 HG12 ' N ' ' A' ' 82' ' ' ALA . 28.6 t -123.8 103.47 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.434 0.694 . . . . 0.0 110.126 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 80.8 m -113.78 108.17 16.72 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 173.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -142.28 152.55 43.12 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.084 0.953 . . . . 0.0 109.384 -167.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.466 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 27.0 tt0 -122.74 126.8 48.21 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.558 ' HB2' HD11 ' A' ' 50' ' ' LEU . 18.7 mtm -119.89 136.67 54.41 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.617 0.767 . . . . 0.0 109.509 173.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 6.2 t -98.68 160.73 14.07 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 123.005 0.522 . . . . 0.0 111.764 -172.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -53.13 -35.38 59.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.345 1.058 . . . . 0.0 113.051 -171.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -55.17 -46.68 75.78 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 122.266 1.031 . . . . 0.0 110.529 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -79.6 -35.82 38.99 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.949 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.558 HD11 ' HB2' ' A' ' 45' ' ' MET . 10.5 mp -68.57 -36.89 79.36 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 117.709 0.231 . . . . 0.0 111.589 178.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.9 mt -64.02 -31.7 72.99 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.312 0.645 . . . . 0.0 111.579 177.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.518 ' HE2' ' HB2' ' A' ' 91' ' ' ALA . 87.2 t80 -61.71 -46.77 88.26 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.621 0.368 . . . . 0.0 110.871 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 45.2 m -62.34 -49.14 76.77 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.298 0.639 . . . . 0.0 112.386 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -76.52 -56.76 4.33 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -178.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -77.05 -7.31 55.47 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -171.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.87 17.68 3.85 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 118.202 0.455 . . . . 0.0 111.891 177.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -159.52 -104.23 0.2 Allowed Glycine 0 C--N 1.353 1.475 0 O-C-N 122.055 -0.403 . . . . 0.0 113.607 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -129.27 162.98 26.66 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.259 1.024 . . . . 0.0 111.553 -175.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -63.54 134.65 55.92 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.446 0.698 . . . . 0.0 111.717 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.6 tp -143.04 -44.04 0.3 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.441 0.696 . . . . 0.0 110.791 -176.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 39.9 ttm -95.11 80.26 3.6 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.218 0.607 . . . . 0.0 109.803 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 41.3 p -135.28 140.69 35.25 Favored Pre-proline 0 N--CA 1.491 1.602 0 C-N-CA 123.676 0.79 . . . . 0.0 111.298 -177.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -55.5 -47.38 25.99 Favored 'Trans proline' 0 C--N 1.388 2.633 0 C-N-CA 123.452 2.768 . . . . 0.0 113.908 174.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 65.2 mtt85 64.58 80.91 0.23 Allowed Pre-proline 0 N--CA 1.492 1.626 0 C-N-CA 124.872 1.269 . . . . 0.0 112.115 -177.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.78 -12.92 24.39 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.768 2.312 . . . . 0.0 113.001 -178.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -73.8 -27.96 61.4 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.891 0.876 . . . . 0.0 111.529 177.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -139.73 105.68 5.19 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.206 1.003 . . . . 0.0 109.599 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -79.8 43.64 0.6 Allowed 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.297 1.039 . . . . 0.0 112.802 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.482 ' HB2' ' HD3' ' A' ' 70' ' ' PRO . 59.7 m-85 -132.07 -56.09 0.03 OUTLIER Pre-proline 0 CA--C 1.574 1.886 0 C-N-CA 123.541 0.736 . . . . 0.0 111.582 -177.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.482 ' HD3' ' HB2' ' A' ' 69' ' ' PHE . 94.5 Cg_endo -89.49 114.63 0.62 Allowed 'Trans proline' 0 C--N 1.395 3.019 0 C-N-CA 121.92 1.747 . . . . 0.0 113.243 178.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -128.32 -86.45 0.51 Allowed Glycine 0 C--N 1.346 1.133 0 N-CA-C 111.854 -0.498 . . . . 0.0 111.854 177.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 64.26 147.68 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 125.492 1.517 . . . . 0.0 113.038 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -124.88 177.61 5.93 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.634 0.774 . . . . 0.0 110.174 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -82.89 105.84 14.22 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.113 0.565 . . . . 0.0 112.362 -173.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.59 38.71 4.9 Favored Glycine 0 N--CA 1.475 1.251 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.998 -177.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -122.73 107.59 12.09 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.385 1.074 . . . . 0.0 110.681 -176.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.466 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 16.4 ptt-85 -84.06 89.98 7.37 Favored 'General case' 0 CA--C 1.555 1.172 0 CA-C-O 122.027 0.918 . . . . 0.0 111.559 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -138.16 -163.77 1.51 Allowed 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 125.251 1.421 . . . . 0.0 108.844 175.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 26.0 p -55.9 81.09 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 122.167 0.984 . . . . 0.0 111.246 169.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -85.28 -25.84 26.99 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.919 1.288 . . . . 0.0 110.118 -175.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 52.4 t 68.02 123.36 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.041 1.336 . . . . 0.0 111.148 -173.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.42 ' N ' HG12 ' A' ' 41' ' ' VAL . . . -55.69 -24.47 34.52 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.79 0.836 . . . . 0.0 112.658 -177.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.4 t -54.12 -47.08 72.21 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.985 0.914 . . . . 0.0 112.693 173.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -41.55 85.42 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 123.531 0.732 . . . . 0.0 112.536 -178.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.44 ' NE1' HG23 ' A' ' 110' ' ' VAL . 9.8 t-105 -71.35 -43.69 66.49 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 124.043 0.937 . . . . 0.0 110.535 -177.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -65.77 -37.66 86.92 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.936 0.895 . . . . 0.0 111.633 175.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.72 -44.16 97.46 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.54 0.736 . . . . 0.0 111.06 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.51 -30.1 71.13 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.46 0.704 . . . . 0.0 111.461 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.524 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 86.8 t80 -68.77 -46.4 68.87 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 123.01 0.524 . . . . 0.0 111.299 174.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -71.79 -16.6 62.19 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.459 0.704 . . . . 0.0 112.242 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.518 ' HB2' ' HE2' ' A' ' 52' ' ' PHE . . . -75.21 -2.7 29.14 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 123.7 0.8 . . . . 0.0 111.589 168.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 84.61 15.65 67.83 Favored Glycine 0 C--N 1.355 1.623 0 C-N-CA 123.63 0.634 . . . . 0.0 113.72 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.2 mmm -118.81 -79.04 0.59 Allowed 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.142 0.577 . . . . 0.0 112.057 -171.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.524 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 63.99 102.26 0.04 OUTLIER Pre-proline 0 N--CA 1.493 1.683 0 C-N-CA 125.0 1.32 . . . . 0.0 113.8 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.422 ' HG3' ' HB3' ' A' ' 45' ' ' MET . 59.6 Cg_endo -67.94 168.98 17.32 Favored 'Trans proline' 0 N--CA 1.504 2.131 0 C-N-CA 123.84 3.027 . . . . 0.0 114.954 177.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.99 109.69 1.77 Allowed 'Trans proline' 0 C--N 1.379 2.177 0 C-N-CA 122.658 2.239 . . . . 0.0 112.197 168.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.7 p -95.2 152.31 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.222 0.609 . . . . 0.0 110.592 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.5 p -90.75 105.42 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.422 0 CA-C-O 121.734 0.778 . . . . 0.0 110.937 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.532 HD22 ' HA ' ' A' ' 116' ' ' GLN . 5.8 mp -69.32 -40.54 77.55 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.737 1.215 . . . . 0.0 112.262 -171.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -68.62 -27.54 66.11 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.367 0.667 . . . . 0.0 111.86 -176.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 30.6 t -84.09 -29.64 26.63 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.198 0.599 . . . . 0.0 110.685 174.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 90.6 m -74.63 101.49 4.26 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.17 0.588 . . . . 0.0 110.414 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.414 ' HB3' ' HG1' ' A' ' 40' ' ' THR . 10.5 tp10 -67.97 156.6 36.92 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.56 0.744 . . . . 0.0 111.126 178.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.581 ' HA ' HD11 ' A' ' 107' ' ' LEU . 0.6 OUTLIER -63.12 -14.32 47.18 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.092 0.957 . . . . 0.0 113.129 -174.902 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 40.4 t -57.16 -39.22 74.83 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.226 0.61 . . . . 0.0 111.814 171.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.43 -22.37 61.11 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.916 0.886 . . . . 0.0 112.877 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.581 HD11 ' HA ' ' A' ' 104' ' ' LYS . 7.2 mp -63.97 -22.4 66.91 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 123.93 0.892 . . . . 0.0 112.199 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -78.55 -15.08 58.98 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.251 0.62 . . . . 0.0 111.268 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -110.97 -17.06 13.38 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.621 1.168 . . . . 0.0 113.334 -175.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.44 HG23 ' NE1' ' A' ' 85' ' ' TRP . 7.4 p -144.52 -23.76 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.0 t 80.34 139.74 0.07 Allowed 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 125.461 1.504 . . . . 0.0 112.851 -176.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.82 -38.19 87.26 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.535 1.134 . . . . 0.0 112.298 173.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.87 -32.43 69.46 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.153 0.581 . . . . 0.0 112.303 -175.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.78 -39.34 76.68 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.894 174.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.414 ' HB3' ' HG ' ' A' ' 99' ' ' LEU . 64.5 mt -69.16 -45.39 70.17 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.586 0.754 . . . . 0.0 110.298 -172.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.532 ' HA ' HD22 ' A' ' 99' ' ' LEU . 61.1 mm-40 -62.64 -43.74 98.04 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.621 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -61.46 -29.83 70.21 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 115.264 -0.88 . . . . 0.0 113.216 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -91.67 -17.37 25.59 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.32 -65.87 0.96 Allowed 'General case' 0 N--CA 1.485 1.304 0 CA-C-O 121.253 0.549 . . . . 0.0 111.002 168.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.1 pp -113.59 152.24 45.24 Favored Pre-proline 0 CA--C 1.559 1.296 0 C-N-CA 124.569 1.148 . . . . 0.0 111.04 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -68.38 96.53 0.48 Allowed 'Trans proline' 0 C--N 1.371 1.753 0 C-N-CA 122.593 2.196 . . . . 0.0 113.125 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.3 p -133.86 132.08 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.248 0.619 . . . . 0.0 110.078 170.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.2 tt -109.81 126.49 53.85 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.608 0.763 . . . . 0.0 110.026 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -145.72 12.54 1.3 Allowed 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.738 0.815 . . . . 0.0 110.295 172.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 63.73 105.87 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 125.422 1.489 . . . . 0.0 111.769 -176.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -66.8 131.56 46.18 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.285 0.634 . . . . 0.0 111.614 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -169.2 -31.39 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.378 0.671 . . . . 0.0 110.439 175.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -69.59 107.86 3.59 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.573 0.749 . . . . 0.0 110.932 172.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 38.3 m-70 -136.82 -44.53 0.58 Allowed 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 122.953 0.501 . . . . 0.0 112.195 -177.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 72.8 m80 . . . . . 0 N--CA 1.496 1.871 0 C-N-CA 124.528 1.131 . . . . 0.0 111.081 -164.691 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 mtt . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.448 0.166 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -72.98 -55.19 6.51 Favored Glycine 0 C--N 1.351 1.363 0 CA-C-N 116.103 -0.499 . . . . 0.0 114.009 -176.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -92.76 132.47 36.93 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.005 0.431 . . . . 0.0 110.952 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -163.43 159.88 32.51 Favored Glycine 0 CA--C 1.532 1.111 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.527 173.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -114.62 121.75 44.38 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 117.667 0.733 . . . . 0.0 109.98 173.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.408 ' ND2' ' HB2' ' A' ' 76' ' ' ASP . 14.9 m120 -65.59 157.15 30.58 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.789 0.836 . . . . 0.0 111.96 -175.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 5.1 m -66.53 -23.76 31.97 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-O 121.682 0.753 . . . . 0.0 109.933 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.2 mt -67.56 -34.52 77.23 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 114.167 -1.379 . . . . 0.0 110.494 177.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -88.98 -103.77 1.03 Allowed Glycine 0 C--N 1.35 1.325 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.329 169.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -167.24 137.36 2.93 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.755 0.822 . . . . 0.0 111.411 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -158.51 156.78 30.87 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.161 0.584 . . . . 0.0 110.894 175.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.39 -32.17 72.05 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.447 0.699 . . . . 0.0 110.375 177.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 62.11 26.88 16.19 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.002 1.321 . . . . 0.0 112.64 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.445 HG21 ' HA3' ' A' ' 27' ' ' GLY . 14.4 p -96.87 138.41 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.454 0.702 . . . . 0.0 111.515 -174.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 40.9 t -78.85 -36.05 42.95 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.303 0.641 . . . . 0.0 110.503 172.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.2 t -75.26 88.05 2.51 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.991 176.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.1 p -117.88 -55.29 2.28 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.544 0.738 . . . . 0.0 110.146 177.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.48 -45.87 0.2 Allowed Pre-proline 0 CA--C 1.568 1.668 0 C-N-CA 124.031 0.932 . . . . 0.0 112.053 172.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -81.85 162.15 18.59 Favored 'Trans proline' 0 C--N 1.396 3.066 0 C-N-CA 121.768 1.645 . . . . 0.0 113.401 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.0 mmt -67.07 -37.54 84.2 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.241 0.617 . . . . 0.0 111.324 176.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.3 m 61.18 81.32 0.19 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.756 1.222 . . . . 0.0 111.269 176.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.77 -130.19 14.3 Favored Glycine 0 CA--C 1.536 1.35 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.856 -169.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 93.4 m95 -130.93 -64.31 0.83 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.639 0.775 . . . . 0.0 109.842 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -153.82 111.86 3.56 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 122.928 0.491 . . . . 0.0 110.594 -177.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -136.89 -60.1 0.7 Allowed 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.537 1.135 . . . . 0.0 109.09 173.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -168.58 -49.35 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.762 1.225 . . . . 0.0 108.636 -178.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.445 ' HA3' HG21 ' A' ' 14' ' ' VAL . . . 161.69 23.58 0.02 OUTLIER Glycine 0 CA--C 1.531 1.058 0 CA-C-N 115.108 -0.951 . . . . 0.0 112.958 176.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.6 p90 -152.34 156.41 39.55 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 121.416 0.627 . . . . 0.0 111.641 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 28.4 p -143.22 160.28 40.75 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.811 171.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -76.26 -75.22 0.2 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.972 0.509 . . . . 0.0 111.078 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 t -164.01 -177.48 5.07 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.946 0.498 . . . . 0.0 111.477 -179.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -77.83 150.09 34.27 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.579 0.752 . . . . 0.0 110.236 172.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 14.9 p -61.8 -29.28 45.95 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 C-N-CA 123.13 0.572 . . . . 0.0 111.96 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -74.77 -28.3 60.7 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.863 0.865 . . . . 0.0 112.03 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.69 94.02 5.64 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.525 0.679 . . . . 0.0 111.238 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.0 mmm180 -88.59 83.89 6.76 Favored 'General case' 0 CA--C 1.554 1.11 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.313 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.99 87.38 0.77 Allowed Glycine 0 CA--C 1.539 1.593 0 CA-C-N 115.845 -0.616 . . . . 0.0 113.293 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.6 t -89.44 -157.41 0.45 Allowed 'General case' 0 CA--C 1.568 1.638 0 C-N-CA 123.708 0.803 . . . . 0.0 110.601 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -111.59 24.82 12.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.307 -0.871 . . . . 0.0 111.039 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.0 p -95.05 110.19 22.14 Favored 'General case' 0 CA--C 1.563 1.447 0 O-C-N 121.578 -0.702 . . . . 0.0 112.16 -170.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.1 t -131.53 137.08 56.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.282 0.633 . . . . 0.0 110.261 174.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 74.7 m -131.03 111.24 11.84 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.775 0.83 . . . . 0.0 110.051 174.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.554 ' HB3' HD11 ' A' ' 80' ' ' LEU . . . -141.28 151.92 44.06 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.826 0.851 . . . . 0.0 109.54 -172.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.618 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 23.8 tt0 -119.86 108.35 14.26 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 122.245 -0.284 . . . . 0.0 111.642 -176.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.543 ' SD ' ' HG3' ' A' ' 84' ' ' ARG . 56.2 mtp -93.38 130.02 39.32 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.053 0.541 . . . . 0.0 110.228 170.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.8 p -83.3 167.71 17.35 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.568 0.747 . . . . 0.0 109.578 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -62.75 -37.01 84.9 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 118.403 0.547 . . . . 0.0 110.842 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -54.31 -55.53 27.49 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 124.018 0.927 . . . . 0.0 111.544 176.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -78.13 -29.98 49.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.796 -176.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.11 -38.87 60.98 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.471 0.708 . . . . 0.0 110.237 -177.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 28.1 mt -62.91 -47.68 82.21 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.634 0.774 . . . . 0.0 110.778 169.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -65.01 -42.05 94.79 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -174.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.6 t -56.43 -39.41 73.03 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 123.263 0.625 . . . . 0.0 110.773 177.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 49.7 mtp85 -78.56 -34.49 47.0 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.4 173.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -61.72 -20.15 63.19 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 123.96 0.904 . . . . 0.0 111.96 -166.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -82.86 90.9 7.0 Favored 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 167.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.96 -62.12 2.23 Favored Glycine 0 CA--C 1.543 1.799 0 N-CA-C 114.367 0.507 . . . . 0.0 114.367 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -95.89 35.89 1.35 Allowed 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 123.997 0.919 . . . . 0.0 111.873 -170.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -48.21 -39.09 20.0 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -168.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -59.71 95.49 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.507 0 CA-C-O 121.76 0.791 . . . . 0.0 110.913 174.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 24.4 ttt -59.79 -60.16 4.28 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 124.756 1.222 . . . . 0.0 111.709 -175.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.1 m -112.28 95.16 29.6 Favored Pre-proline 0 CA--C 1.555 1.155 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 174.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -62.88 -40.75 33.44 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 122.879 2.386 . . . . 0.0 113.158 -173.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 85.9 mtt180 -90.57 158.01 43.48 Favored Pre-proline 0 CA--C 1.556 1.207 0 C-N-CA 124.156 0.982 . . . . 0.0 111.153 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -66.88 -13.55 40.37 Favored 'Trans proline' 0 C--N 1.383 2.352 0 C-N-CA 122.29 1.994 . . . . 0.0 112.831 170.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.431 ' HB3' HD21 ' A' ' 68' ' ' ASN . 11.6 mp0 -77.06 157.52 31.06 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.776 0.83 . . . . 0.0 111.323 174.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -81.56 2.12 30.62 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.831 0.852 . . . . 0.0 112.85 -177.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.431 HD21 ' HB3' ' A' ' 66' ' ' GLU . 35.6 m-80 -81.85 95.17 7.23 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.305 0.642 . . . . 0.0 111.454 -175.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -134.95 146.65 59.53 Favored Pre-proline 0 N--CA 1.489 1.496 0 C-N-CA 123.617 0.767 . . . . 0.0 110.08 173.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.2 96.63 1.04 Allowed 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 122.095 1.863 . . . . 0.0 112.546 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 158.43 -175.49 35.54 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-N 116.156 -0.474 . . . . 0.0 112.842 178.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.525 HD23 HD21 ' A' ' 80' ' ' LEU . 4.2 mm? -97.0 178.12 5.38 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-O 121.665 0.745 . . . . 0.0 112.023 178.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.43 ' HD3' ' N ' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -99.52 22.92 10.09 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.139 -165.642 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 65.88 117.25 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 125.366 1.466 . . . . 0.0 113.022 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 67.57 40.9 90.68 Favored Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.627 -0.589 . . . . 0.0 111.627 -168.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.408 ' HB2' ' ND2' ' A' ' 6' ' ' ASN . 10.8 t70 -138.27 97.42 3.38 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 124.152 0.981 . . . . 0.0 109.013 -174.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.618 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 39.0 ptt85 -89.14 85.33 6.63 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.709 0.766 . . . . 0.0 112.716 -174.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 -159.26 120.42 3.27 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.474 0.71 . . . . 0.0 110.122 -173.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.0 t 62.47 9.83 3.63 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 170.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.554 HD11 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -67.6 110.63 3.78 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 44.1 t -61.44 132.41 53.34 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.372 0.669 . . . . 0.0 111.199 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.42 -22.81 62.0 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.6 m -58.27 -41.58 84.64 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 118.362 0.528 . . . . 0.0 112.04 172.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.543 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 6.9 tpm_? -69.2 -41.49 77.04 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.334 1.054 . . . . 0.0 111.841 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.46 ' NE1' HG11 ' A' ' 110' ' ' VAL . 0.5 OUTLIER -74.25 -54.6 7.38 Favored 'General case' 0 CA--C 1.563 1.457 0 C-N-CA 123.6 0.76 . . . . 0.0 110.841 179.571 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.497 ' HB2' HG13 ' A' ' 110' ' ' VAL . 32.4 tp60 -49.95 -40.68 44.54 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 177.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -61.79 -41.1 97.3 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 120.68 0.276 . . . . 0.0 111.049 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.5 70.6 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.927 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.655 ' HA ' ' HB1' ' A' ' 94' ' ' ALA . 54.0 t80 -67.03 -43.45 82.74 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.75 0.82 . . . . 0.0 110.782 171.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -69.4 -31.59 70.06 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.167 0.587 . . . . 0.0 112.466 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -78.96 -11.51 60.01 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.654 0.782 . . . . 0.0 111.577 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 107.1 -16.79 38.62 Favored Glycine 0 C--N 1.352 1.439 0 N-CA-C 114.934 0.734 . . . . 0.0 114.934 170.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -73.97 -70.43 0.39 Allowed 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 117.918 0.859 . . . . 0.0 111.021 -177.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.655 ' HB1' ' HA ' ' A' ' 89' ' ' PHE . . . 60.52 97.98 0.04 OUTLIER Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 124.745 1.218 . . . . 0.0 113.291 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.438 ' HB2' ' O ' ' A' ' 44' ' ' GLU . 94.5 Cg_endo -71.28 168.97 21.89 Favored 'Trans proline' 0 CA--C 1.568 2.182 0 C-N-CA 123.391 2.727 . . . . 0.0 113.563 175.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -66.46 118.64 5.69 Favored 'Trans proline' 0 C--N 1.381 2.276 0 C-N-CA 122.421 2.081 . . . . 0.0 112.784 176.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.539 HG12 ' HB3' ' A' ' 119' ' ' ALA . 7.7 p -105.97 158.27 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 123.497 0.719 . . . . 0.0 109.323 173.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.549 HG11 ' HD2' ' A' ' 77' ' ' ARG . 3.4 p -115.65 108.24 24.76 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 O-C-N 121.675 -0.641 . . . . 0.0 112.508 -170.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 97.0 mt -69.07 -28.91 66.95 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -83.67 40.0 0.71 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.607 0.763 . . . . 0.0 111.748 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.475 ' HB3' HG12 ' A' ' 98' ' ' VAL . 22.4 t -170.12 -24.67 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 124.521 1.129 . . . . 0.0 110.852 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 33.6 p -74.77 -176.84 3.0 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.729 0.776 . . . . 0.0 112.186 172.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -148.76 171.85 15.56 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.03 -177.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.521 ' HA ' HD12 ' A' ' 107' ' ' LEU . 0.5 OUTLIER -62.74 -17.72 61.38 Favored 'General case' 0 CA--C 1.564 1.512 0 C-N-CA 124.256 1.022 . . . . 0.0 110.98 167.888 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.2 m -57.56 -36.18 71.33 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.495 1.118 . . . . 0.0 112.255 169.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.439 ' O ' HG23 ' A' ' 110' ' ' VAL . . . -63.49 -36.36 83.51 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.948 0.499 . . . . 0.0 111.236 176.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 104' ' ' LYS . 9.5 mp -68.05 5.75 0.86 Allowed 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 124.906 1.282 . . . . 0.0 113.584 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -86.86 -23.72 25.16 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.526 0.73 . . . . 0.0 110.182 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -107.71 -50.92 2.98 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.717 1.207 . . . . 0.0 108.758 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.497 HG13 ' HB2' ' A' ' 86' ' ' GLN . 33.8 m -97.06 -172.67 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 CA-C-O 122.289 1.042 . . . . 0.0 111.919 176.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.1 t -113.97 158.52 21.04 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.347 158.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.5 ' HA ' HD13 ' A' ' 115' ' ' LEU . 2.5 tt -55.95 -34.98 66.16 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 122.518 0.327 . . . . 0.0 110.761 170.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.35 73.72 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.185 0.594 . . . . 0.0 112.308 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -73.09 -33.91 65.88 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 120.841 0.353 . . . . 0.0 110.183 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.5 HD13 ' HA ' ' A' ' 112' ' ' LEU . 87.7 mt -68.35 -56.88 6.99 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 123.73 0.812 . . . . 0.0 110.634 178.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -64.62 -30.94 71.96 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.418 1.087 . . . . 0.0 112.315 -170.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -52.3 -30.42 28.1 Favored 'General case' 0 CA--C 1.563 1.443 0 C-N-CA 123.89 0.876 . . . . 0.0 112.87 171.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -135.72 27.7 3.31 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 123.886 0.874 . . . . 0.0 112.488 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.539 ' HB3' HG12 ' A' ' 97' ' ' VAL . . . -127.57 168.6 14.75 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -177.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -109.96 121.02 43.09 Favored Pre-proline 0 CA--C 1.561 1.394 0 CA-C-N 114.801 -1.09 . . . . 0.0 108.659 174.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -57.19 162.98 8.65 Favored 'Trans proline' 0 N--CA 1.506 2.242 0 C-N-CA 124.14 3.227 . . . . 0.0 116.243 -177.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.6 p -103.65 140.84 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.897 0.879 . . . . 0.0 111.167 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.71 72.6 8.76 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 121.992 0.901 . . . . 0.0 110.08 173.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -150.84 13.38 0.71 Allowed 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.791 1.236 . . . . 0.0 109.683 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -78.34 90.55 4.39 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.958 0.903 . . . . 0.0 111.431 -171.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -155.31 136.65 14.03 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.891 0.876 . . . . 0.0 110.572 174.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -89.25 157.2 18.32 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.147 0.579 . . . . 0.0 109.569 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -63.19 -39.03 93.47 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -172.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 66.65 179.63 0.21 Allowed 'General case' 0 N--CA 1.498 1.959 0 C-N-CA 124.289 1.035 . . . . 0.0 112.449 -173.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 40.0 t-80 . . . . . 0 N--CA 1.485 1.305 0 C-N-CA 123.223 0.609 . . . . 0.0 110.122 176.722 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.449 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 120.584 0.23 . . . . 0.0 110.944 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.67 154.5 10.34 Favored Glycine 0 C--N 1.348 1.217 0 CA-C-N 116.649 -0.25 . . . . 0.0 112.964 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -170.74 149.59 3.14 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.504 0.722 . . . . 0.0 110.54 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.06 -139.79 9.53 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.095 0.378 . . . . 0.0 113.739 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -88.31 137.27 32.47 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.53 0.732 . . . . 0.0 110.344 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -124.68 177.26 6.06 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.705 0.802 . . . . 0.0 111.649 -174.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -82.99 -16.66 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.968 169.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 52.6 mt -72.35 -13.29 61.44 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.982 1.713 . . . . 0.0 113.857 -167.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.37 65.46 2.02 Favored Glycine 0 CA--C 1.539 1.559 0 C-N-CA 123.464 0.554 . . . . 0.0 112.77 176.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -164.91 -40.4 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.597 1.559 . . . . 0.0 109.374 -173.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 65.9 -77.79 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 126.124 1.77 . . . . 0.0 111.102 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.8 mt 55.38 -76.24 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 125.906 1.683 . . . . 0.0 113.776 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -81.78 60.01 4.49 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 124.579 1.152 . . . . 0.0 111.86 -175.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.409 HG21 ' HA2' ' A' ' 22' ' ' GLY . 7.6 p -79.45 149.05 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.256 0 C-N-CA 123.738 0.815 . . . . 0.0 110.202 175.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.496 ' SG ' ' HB2' ' A' ' 28' ' ' PHE . 75.0 m -58.5 -37.28 75.25 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 123.072 0.549 . . . . 0.0 111.956 177.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.56 ' SG ' HD11 ' A' ' 112' ' ' LEU . 81.6 m -150.04 149.29 30.11 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.302 0.641 . . . . 0.0 111.641 -178.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 71.3 m -93.31 33.04 1.25 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 123.841 0.857 . . . . 0.0 111.113 175.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -134.67 140.56 35.76 Favored Pre-proline 0 CA--C 1.561 1.367 0 C-N-CA 123.574 0.75 . . . . 0.0 111.15 -172.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.05 7.55 0.07 OUTLIER 'Trans proline' 0 N--CA 1.513 2.652 0 C-N-CA 124.602 3.535 . . . . 0.0 118.231 -175.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -88.08 -33.54 18.25 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 119.284 0.947 . . . . 0.0 111.064 168.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 84.9 m -147.17 93.19 2.21 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.517 1.127 . . . . 0.0 109.123 175.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.409 ' HA2' HG21 ' A' ' 14' ' ' VAL . . . -166.73 117.94 0.77 Allowed Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 -178.456 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 25.5 m-90 65.92 12.59 8.5 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.279 1.031 . . . . 0.0 113.613 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -52.01 -39.48 59.54 Favored 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -173.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.425 ' HG3' ' OD1' ' A' ' 26' ' ' ASN . 17.9 tpt180 -130.13 -74.01 0.55 Allowed 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 124.303 1.041 . . . . 0.0 109.586 176.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.425 ' OD1' ' HG3' ' A' ' 25' ' ' ARG . 1.6 p-10 -148.36 93.35 2.14 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.602 0.715 . . . . 0.0 109.319 173.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 67.11 -104.23 1.07 Allowed Glycine 0 C--N 1.347 1.147 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.957 -170.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.496 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 54.8 p90 -81.47 167.6 19.19 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.435 0.694 . . . . 0.0 112.0 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.417 ' HB2' ' HG3' ' A' ' 104' ' ' LYS . 56.5 m -95.83 95.76 8.49 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.984 0.514 . . . . 0.0 110.252 177.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -73.4 95.65 2.24 Favored 'General case' 0 CA--C 1.555 1.165 0 CA-C-O 121.141 0.496 . . . . 0.0 110.446 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -73.83 -39.31 64.14 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.825 0.85 . . . . 0.0 112.288 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -116.01 119.03 34.57 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.519 0.728 . . . . 0.0 109.712 173.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 29.7 m -66.31 -22.05 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 176.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -91.71 -36.78 13.4 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.072 0.949 . . . . 0.0 111.132 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.0 t70 53.21 85.33 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.717 1.207 . . . . 0.0 111.847 -169.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -176.29 -39.57 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.717 0.807 . . . . 0.0 111.905 175.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.52 79.9 0.01 OUTLIER Glycine 0 C--N 1.361 1.945 0 N-CA-C 115.809 1.084 . . . . 0.0 115.809 -165.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.2 m 60.51 -2.49 0.17 Allowed 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 125.664 1.585 . . . . 0.0 114.163 -175.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 62.34 139.11 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 125.381 1.472 . . . . 0.0 112.389 -169.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 40.7 p -94.22 102.74 14.77 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-O 121.325 0.583 . . . . 0.0 111.231 -176.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.49 HG21 ' HB2' ' A' ' 82' ' ' ALA . 21.4 t -135.16 102.22 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 C-N-CA 123.974 0.91 . . . . 0.0 109.334 171.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 61.6 m -108.03 104.3 13.72 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 170.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.402 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.73 144.01 32.5 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.325 1.05 . . . . 0.0 109.778 -173.449 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.507 ' HG3' ' HB3' ' A' ' 77' ' ' ARG . 1.7 mp0 -102.63 107.5 18.43 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 122.165 -0.335 . . . . 0.0 110.611 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.574 ' SD ' HD21 ' A' ' 80' ' ' LEU . 63.8 mtp -91.06 137.75 32.13 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 169.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.7 p -82.77 159.51 22.49 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 121.339 0.59 . . . . 0.0 111.713 -174.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -60.85 -28.6 68.95 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.54 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -50.98 -54.4 24.78 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.975 0.91 . . . . 0.0 112.096 174.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -74.86 -36.43 62.33 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.46 -26.8 65.67 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -78.59 -34.39 46.83 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.69 0.796 . . . . 0.0 110.877 168.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -62.31 -31.49 72.11 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 122.552 0.341 . . . . 0.0 110.631 170.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.3 m -75.7 -42.34 51.17 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.412 0.685 . . . . 0.0 110.757 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.432 ' HG3' ' HA ' ' A' ' 59' ' ' ASP . 43.5 ttt-85 -71.32 -61.11 1.89 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.207 1.003 . . . . 0.0 112.537 -175.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -79.97 -15.98 56.16 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -170.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -82.46 -37.29 25.61 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.999 -0.438 . . . . 0.0 110.912 173.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -81.63 -72.61 1.24 Allowed Glycine 0 CA--C 1.537 1.452 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.414 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -172.06 -60.23 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.856 1.262 . . . . 0.0 108.69 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.432 ' HA ' ' HG3' ' A' ' 54' ' ' ARG . 7.1 p-10 -146.31 178.7 8.05 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.338 172.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.4 tp -158.64 -55.48 0.07 Allowed 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 173.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 55.3 mtt -81.24 86.97 6.14 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-N 114.393 -1.276 . . . . 0.0 108.121 167.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 92.0 m -60.6 123.91 76.37 Favored Pre-proline 0 N--CA 1.485 1.3 0 C-N-CA 123.78 0.832 . . . . 0.0 111.92 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -66.96 87.43 0.3 Allowed 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 122.941 2.427 . . . . 0.0 112.449 177.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -88.55 138.89 29.78 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 123.952 0.901 . . . . 0.0 110.992 177.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -77.36 8.04 3.47 Favored 'Trans proline' 0 C--N 1.38 2.215 0 C-N-CA 122.741 2.294 . . . . 0.0 113.816 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -156.04 144.1 19.78 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.877 0.871 . . . . 0.0 108.688 175.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -103.6 87.18 2.77 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.765 0.826 . . . . 0.0 110.593 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -85.01 -56.64 3.46 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.426 0.69 . . . . 0.0 112.543 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -94.2 114.31 62.95 Favored Pre-proline 0 N--CA 1.486 1.353 0 C-N-CA 123.309 0.643 . . . . 0.0 111.329 -175.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -75.7 -71.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.379 2.151 0 C-N-CA 122.566 2.177 . . . . 0.0 111.859 170.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 53.24 -104.84 0.22 Allowed Glycine 0 C--N 1.36 1.899 0 C-N-CA 123.704 0.668 . . . . 0.0 114.342 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.456 ' HB2' ' HB3' ' A' ' 76' ' ' ASP . 2.7 pt? -150.63 139.72 21.1 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.073 0.549 . . . . 0.0 110.717 175.297 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.16 85.84 1.47 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.723 0.809 . . . . 0.0 109.406 169.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 70.53 129.38 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.253 1.421 . . . . 0.0 113.68 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 83.53 -7.82 67.44 Favored Glycine 0 CA--C 1.543 1.809 0 N-CA-C 114.973 0.749 . . . . 0.0 114.973 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.456 ' HB3' ' HB2' ' A' ' 72' ' ' LEU . 23.5 t70 -113.02 148.18 35.66 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.33 0.652 . . . . 0.0 111.073 -178.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.507 ' HB3' ' HG3' ' A' ' 44' ' ' GLU . 27.1 ptt180 -111.12 101.76 10.26 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.544 0.738 . . . . 0.0 111.282 -177.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -163.41 118.83 1.68 Allowed 'General case' 0 N--CA 1.483 1.203 0 O-C-N 121.712 -0.617 . . . . 0.0 111.599 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.6 t 51.61 27.96 4.36 Favored 'General case' 0 N--CA 1.5 2.033 0 C-N-CA 123.93 0.892 . . . . 0.0 112.391 174.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.574 HD21 ' SD ' ' A' ' 45' ' ' MET . 3.1 tm? -66.3 126.69 29.55 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.939 0.895 . . . . 0.0 110.56 -171.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.421 ' SG ' ' HB2' ' A' ' 83' ' ' SER . 43.4 t -64.16 101.3 0.4 Allowed 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 122.924 0.49 . . . . 0.0 110.863 177.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.49 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -56.86 -24.74 53.79 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.86 0.864 . . . . 0.0 113.018 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.421 ' HB2' ' SG ' ' A' ' 81' ' ' CYS . 54.4 m -61.61 -48.88 78.9 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.851 0.46 . . . . 0.0 111.296 171.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -59.35 -39.01 81.83 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 122.707 0.403 . . . . 0.0 112.061 179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.687 ' HE1' HD21 ' A' ' 115' ' ' LEU . 13.1 t-105 -66.63 -52.71 42.13 Favored 'General case' 0 CA--C 1.569 1.689 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.132 174.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.465 ' HB2' HG13 ' A' ' 110' ' ' VAL . 34.2 tp60 -49.54 -47.28 49.17 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 176.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -35.44 77.52 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.576 0.75 . . . . 0.0 111.903 177.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.9 -39.12 90.9 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.097 0.559 . . . . 0.0 111.89 176.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.597 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 68.8 t80 -60.42 -51.73 68.24 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.164 0.507 . . . . 0.0 110.771 175.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -71.6 -19.49 62.12 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.476 -177.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.28 -11.45 46.44 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.692 0.797 . . . . 0.0 112.36 175.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.96 10.4 85.12 Favored Glycine 0 CA--C 1.542 1.757 0 N-CA-C 114.091 0.396 . . . . 0.0 114.091 -176.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 94.2 mmm -112.83 27.98 9.17 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.346 1.058 . . . . 0.0 110.725 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.597 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -67.76 117.45 48.15 Favored Pre-proline 0 CA--C 1.558 1.276 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 -178.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -67.05 174.81 6.35 Favored 'Trans proline' 0 CA--C 1.566 2.093 0 C-N-CA 123.074 2.516 . . . . 0.0 113.079 168.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.1 145.62 55.7 Favored 'Trans proline' 0 C--N 1.376 1.981 0 C-N-CA 121.522 1.481 . . . . 0.0 112.169 166.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.8 p -131.62 153.37 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.735 0.814 . . . . 0.0 108.99 174.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.519 HG23 ' HB3' ' A' ' 101' ' ' SER . 30.8 m -85.63 165.84 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-O 121.144 0.497 . . . . 0.0 111.302 173.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 86.4 mt -107.13 -26.06 11.28 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.609 0.764 . . . . 0.0 110.676 169.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -74.39 -60.33 2.32 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.503 0.721 . . . . 0.0 111.479 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.519 ' HB3' HG23 ' A' ' 98' ' ' VAL . 40.8 t -77.35 -25.33 50.94 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 179.297 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.459 ' H ' HG21 ' A' ' 98' ' ' VAL . 88.6 m -73.83 105.39 5.09 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 172.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -78.26 160.61 27.81 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.454 -175.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.521 ' HA ' HD11 ' A' ' 107' ' ' LEU . 27.9 mmtp -71.66 -12.85 61.54 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -169.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 16.6 t -61.94 -25.54 67.65 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 122.983 0.513 . . . . 0.0 111.369 170.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.419 ' O ' HG23 ' A' ' 110' ' ' VAL . . . -57.02 -33.99 67.73 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.626 0.77 . . . . 0.0 112.888 172.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.521 HD11 ' HA ' ' A' ' 104' ' ' LYS . 9.4 mp -65.73 5.64 0.43 Allowed 'General case' 0 N--CA 1.503 2.224 0 C-N-CA 124.813 1.245 . . . . 0.0 113.588 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 46.2 mtp180 -94.57 -19.15 20.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.714 0.805 . . . . 0.0 110.28 175.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 34.7 m-85 -106.94 -51.4 2.93 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.099 1.359 . . . . 0.0 108.673 178.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.465 HG13 ' HB2' ' A' ' 86' ' ' GLN . 33.0 m -92.55 -170.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.017 170.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.3 t -120.27 163.46 17.76 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 114.638 -1.164 . . . . 0.0 108.103 155.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.56 HD11 ' SG ' ' A' ' 16' ' ' CYS . 2.7 tt -56.79 -31.87 65.1 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.571 0.349 . . . . 0.0 111.238 173.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.2 -41.44 79.36 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.702 0.801 . . . . 0.0 112.756 178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -70.09 -33.54 72.01 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.192 0.597 . . . . 0.0 110.519 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.687 HD21 ' HE1' ' A' ' 85' ' ' TRP . 80.4 mt -67.69 -54.88 15.89 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.639 178.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -63.45 -37.07 85.89 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.341 1.056 . . . . 0.0 112.056 -175.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.78 -21.94 12.71 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -130.12 21.5 5.31 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.6 0.76 . . . . 0.0 111.681 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -128.3 170.95 12.46 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.837 0.855 . . . . 0.0 111.926 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.46 149.89 50.18 Favored Pre-proline 0 N--CA 1.487 1.388 0 C-N-CA 123.101 0.56 . . . . 0.0 110.627 172.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.58 97.98 0.74 Allowed 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 122.29 1.993 . . . . 0.0 111.593 174.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 8.7 p -75.57 134.6 28.86 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.261 0.624 . . . . 0.0 111.316 179.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 16.3 tp -90.5 115.06 27.36 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.127 0.571 . . . . 0.0 109.706 174.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -84.99 178.04 7.72 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 120.987 0.423 . . . . 0.0 110.94 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -95.68 38.3 1.17 Allowed 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -172.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 61.1 t60 60.94 -78.9 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 125.0 1.32 . . . . 0.0 112.306 174.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -150.08 64.87 0.97 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.228 1.011 . . . . 0.0 108.762 176.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 79.9 t60 51.99 46.08 27.2 Favored 'General case' 0 CA--C 1.569 1.695 0 C-N-CA 124.157 0.983 . . . . 0.0 111.089 -177.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 41.8 t60 65.14 97.98 0.04 OUTLIER 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 125.279 1.432 . . . . 0.0 111.789 -174.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 . . . . . 0 CA--C 1.56 1.362 0 C-N-CA 123.716 0.807 . . . . 0.0 110.003 173.046 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.1 mtp . . . . . 0 N--CA 1.494 1.741 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 122.55 133.95 4.34 Favored Glycine 0 N--CA 1.475 1.283 0 CA-C-O 119.836 -0.425 . . . . 0.0 113.188 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 60.88 89.92 0.07 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 125.064 1.345 . . . . 0.0 112.391 176.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.22 106.8 3.27 Favored Glycine 0 CA--C 1.535 1.315 0 N-CA-C 111.97 -0.452 . . . . 0.0 111.97 173.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -90.92 153.72 19.98 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.425 0.69 . . . . 0.0 109.947 177.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -130.4 132.87 45.97 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.935 0.494 . . . . 0.0 110.834 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.4 m -75.13 -17.09 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 124.203 1.001 . . . . 0.0 109.743 175.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 39.1 mt -78.08 -39.89 40.2 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.976 -176.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -88.08 62.44 3.87 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-N 115.402 -0.817 . . . . 0.0 113.777 -177.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -157.98 -48.72 0.06 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.759 0.824 . . . . 0.0 110.29 176.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -86.72 158.77 19.35 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.618 0.767 . . . . 0.0 110.736 175.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -74.15 136.3 42.89 Favored 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 172.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -96.94 -26.15 15.15 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.439 0.696 . . . . 0.0 110.971 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.608 HG21 HG22 ' A' ' 21' ' ' THR . 9.8 p -102.76 173.29 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.566 1.587 0 C-N-CA 124.375 1.07 . . . . 0.0 111.062 -172.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.492 ' H ' HG22 ' A' ' 14' ' ' VAL . 10.4 t -147.07 -73.62 0.21 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.914 -0.491 . . . . 0.0 112.084 -167.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.6 t 69.85 6.01 5.52 Favored 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 125.307 1.443 . . . . 0.0 113.797 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.7 m -62.68 -58.43 7.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.017 0.527 . . . . 0.0 111.857 -178.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -173.86 -55.51 0.0 OUTLIER Pre-proline 0 CA--C 1.568 1.648 0 C-N-CA 124.114 0.966 . . . . 0.0 111.819 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -84.59 -17.18 5.29 Favored 'Trans proline' 0 C--N 1.392 2.855 0 C-N-CA 122.126 1.884 . . . . 0.0 114.453 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 66.3 mtt -125.43 146.53 49.58 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.688 0.795 . . . . 0.0 111.377 -176.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.608 HG22 HG21 ' A' ' 14' ' ' VAL . 66.3 p 51.86 -89.88 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 126.232 1.813 . . . . 0.0 112.865 -173.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 58.12 -83.68 0.01 OUTLIER Glycine 0 CA--C 1.548 2.153 0 N-CA-C 116.052 1.181 . . . . 0.0 116.052 171.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 27.9 m-90 -51.89 -53.17 43.77 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 125.508 1.523 . . . . 0.0 113.03 -177.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -68.39 105.52 2.2 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -79.8 73.06 6.55 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-O 121.979 0.895 . . . . 0.0 110.343 -178.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.44 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 25.4 t-20 -169.59 151.75 4.47 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.528 -1.214 . . . . 0.0 108.715 -173.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.05 -53.29 3.93 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-N 116.54 -0.3 . . . . 0.0 112.925 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.485 ' N ' HG23 ' A' ' 14' ' ' VAL . 52.5 p90 -74.91 -5.69 45.1 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 122.915 0.486 . . . . 0.0 111.969 175.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.44 ' SG ' ' HA ' ' A' ' 26' ' ' ASN . 78.2 m -54.81 92.1 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.846 1.259 . . . . 0.0 112.477 -178.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -69.82 88.47 0.55 Allowed 'General case' 0 CA--C 1.551 1.012 0 CA-C-O 121.771 0.796 . . . . 0.0 111.155 179.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.2 t -117.57 -18.24 9.78 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.54 1.136 . . . . 0.0 110.033 172.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -64.93 -39.54 93.66 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.347 1.059 . . . . 0.0 111.252 174.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.2 t 62.63 -80.63 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 C-N-CA 125.497 1.519 . . . . 0.0 112.3 176.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.24 -0.98 32.12 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.446 0.698 . . . . 0.0 111.671 -176.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.0 t70 61.84 -164.25 0.25 Allowed 'General case' 0 CA--C 1.572 1.79 0 C-N-CA 124.409 1.084 . . . . 0.0 110.748 178.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 71.34 -67.18 0.27 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 125.496 1.519 . . . . 0.0 112.253 174.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.38 14.28 29.7 Favored Glycine 0 CA--C 1.541 1.71 0 CA-C-O 119.582 -0.565 . . . . 0.0 114.182 173.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.4 m 66.13 -80.26 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 125.23 1.412 . . . . 0.0 112.223 176.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.6 m80 56.78 31.29 19.23 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 124.424 1.089 . . . . 0.0 112.611 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.52 ' HB ' ' HB3' ' A' ' 105' ' ' SER . 1.7 m -92.0 98.5 11.6 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -168.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.545 HG23 ' HA ' ' A' ' 106' ' ' ALA . 34.5 t -138.41 100.4 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.978 0 C-N-CA 124.662 1.185 . . . . 0.0 110.206 -174.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 62.8 m -101.14 103.63 14.7 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 166.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.404 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -134.55 147.48 50.29 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 -176.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 26.1 tt0 -120.29 109.55 15.52 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.213 0.53 . . . . 0.0 111.258 -169.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.598 ' HB2' HD12 ' A' ' 50' ' ' LEU . 73.6 mmm -93.94 150.93 19.93 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.22 1.008 . . . . 0.0 110.656 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 70.2 p -82.94 155.88 23.79 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 171.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.565 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 24.5 tt0 -58.98 -27.37 65.33 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.837 0.455 . . . . 0.0 112.015 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -49.06 -38.4 24.06 Favored 'General case' 0 CA--C 1.566 1.591 0 C-N-CA 123.923 0.889 . . . . 0.0 111.816 170.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.573 ' HA ' ' HE1' ' A' ' 93' ' ' MET . 72.3 t80 -73.56 -53.03 11.5 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 172.176 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.598 HD12 ' HB2' ' A' ' 45' ' ' MET . 6.0 mp -66.76 -25.51 66.53 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -170.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.565 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 92.1 mt -73.57 -40.5 63.87 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.891 0.876 . . . . 0.0 110.76 171.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -60.71 -46.73 89.26 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.312 0.645 . . . . 0.0 110.958 174.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.1 t -63.75 -39.17 93.63 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.627 0.771 . . . . 0.0 111.805 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.519 ' HA ' ' HA ' ' A' ' 59' ' ' ASP . 6.0 ptm180 -78.89 -43.15 25.51 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 -177.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -82.56 -32.51 28.49 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.516 0.727 . . . . 0.0 111.517 -170.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.71 -34.92 10.73 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.835 0.454 . . . . 0.0 110.309 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -89.8 -105.53 1.17 Allowed Glycine 0 C--N 1.35 1.335 0 CA-C-N 116.262 -0.426 . . . . 0.0 113.65 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -161.6 23.69 0.12 Allowed 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 117.236 0.518 . . . . 0.0 111.847 -174.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.519 ' HA ' ' HA ' ' A' ' 54' ' ' ARG . 0.5 OUTLIER 75.36 -178.33 0.16 Allowed 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.616 1.567 . . . . 0.0 112.636 -178.261 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 tm? 176.14 -45.45 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 126.241 1.816 . . . . 0.0 107.761 -175.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 50.7 ttp -69.79 -40.11 76.21 Favored 'General case' 0 CA--C 1.557 1.226 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.53 -172.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.8 p -95.96 153.22 39.27 Favored Pre-proline 0 N--CA 1.491 1.618 0 C-N-CA 122.878 0.471 . . . . 0.0 111.394 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -77.39 39.32 0.73 Allowed 'Trans proline' 0 C--N 1.388 2.649 0 C-N-CA 123.362 2.708 . . . . 0.0 115.236 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 68.9 mtp180 -56.18 150.51 30.95 Favored Pre-proline 0 N--CA 1.487 1.382 0 C-N-CA 123.979 0.912 . . . . 0.0 112.27 174.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -59.99 -13.79 24.84 Favored 'Trans proline' 0 N--CA 1.512 2.582 0 C-N-CA 123.567 2.845 . . . . 0.0 114.337 -172.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -63.25 -45.43 91.6 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 123.877 0.871 . . . . 0.0 111.545 174.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -107.06 -29.42 9.41 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 123.786 0.834 . . . . 0.0 112.133 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 67.48 -67.72 0.17 Allowed 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 125.654 1.582 . . . . 0.0 112.646 -176.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -104.88 110.95 65.14 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.853 0.861 . . . . 0.0 110.609 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -83.41 172.1 10.67 Favored 'Trans proline' 0 CA--C 1.56 1.814 0 C-N-CA 122.881 2.388 . . . . 0.0 113.521 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -99.28 -121.53 4.58 Favored Glycine 0 C--N 1.351 1.407 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.961 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.412 ' HB3' ' O ' ' A' ' 78' ' ' TRP . 2.6 pt? -65.91 159.23 26.03 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.942 0.897 . . . . 0.0 113.17 178.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -87.24 177.98 7.0 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.563 164.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.19 87.69 1.95 Allowed 'General case' 0 CA--C 1.549 0.94 0 CA-C-O 121.18 0.514 . . . . 0.0 110.859 176.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 116.16 31.29 1.9 Allowed Glycine 0 CA--C 1.539 1.556 0 CA-C-N 115.67 -0.695 . . . . 0.0 113.776 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -122.15 113.78 19.97 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-N 117.28 0.54 . . . . 0.0 110.592 169.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.437 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 13.0 ptp180 -69.8 89.82 0.58 Allowed 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 121.935 0.874 . . . . 0.0 111.178 177.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.412 ' O ' ' HB3' ' A' ' 72' ' ' LEU . 26.4 t90 -177.61 140.81 0.27 Allowed 'General case' 0 N--CA 1.491 1.612 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.976 -171.063 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 44.9 t 50.79 31.85 6.47 Favored 'General case' 0 N--CA 1.508 2.459 0 C-N-CA 124.773 1.229 . . . . 0.0 113.702 167.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.477 HD21 ' HD2' ' A' ' 84' ' ' ARG . 3.0 tm? -81.62 -33.29 31.54 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 118.847 -0.597 . . . . 0.0 111.889 -171.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 37.6 t 65.12 121.8 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 123.463 0.705 . . . . 0.0 111.58 -175.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.468 ' H ' HG21 ' A' ' 41' ' ' VAL . . . -61.23 -29.88 70.1 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -170.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.5 m -57.76 -33.5 68.58 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.668 0.787 . . . . 0.0 112.551 176.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.477 ' HD2' HD21 ' A' ' 80' ' ' LEU . 30.2 ttm180 -73.43 -45.43 54.51 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.791 0.836 . . . . 0.0 111.324 -174.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.532 ' HE1' HD22 ' A' ' 115' ' ' LEU . 1.6 t-105 -74.23 -52.08 13.44 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.55 0.74 . . . . 0.0 111.277 176.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.418 ' OE1' HG13 ' A' ' 110' ' ' VAL . 34.2 tp60 -51.67 -37.73 51.86 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.044 0.938 . . . . 0.0 112.948 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -62.72 -42.74 99.81 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.768 0.427 . . . . 0.0 111.395 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.71 -33.8 76.45 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.338 0.655 . . . . 0.0 111.913 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -61.17 -51.4 69.22 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.51 0.724 . . . . 0.0 111.041 174.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.72 -25.56 63.91 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.411 0.685 . . . . 0.0 112.266 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.38 -14.39 58.99 Favored 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 123.54 0.736 . . . . 0.0 111.699 171.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.73 -20.18 29.31 Favored Glycine 0 C--N 1.353 1.48 0 N-CA-C 114.448 0.539 . . . . 0.0 114.448 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' MET . . . . . 0.573 ' HE1' ' HA ' ' A' ' 49' ' ' PHE . 4.5 ppp? -84.56 5.18 28.76 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -171.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.465 ' HB3' ' CZ3' ' A' ' 85' ' ' TRP . . . -54.14 131.99 60.02 Favored Pre-proline 0 CA--C 1.564 1.518 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.9 174.89 10.49 Favored 'Trans proline' 0 CA--C 1.565 2.055 0 C-N-CA 123.484 2.789 . . . . 0.0 113.585 172.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.95 124.46 13.58 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.151 1.901 . . . . 0.0 112.446 166.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.09 137.86 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.581 0.752 . . . . 0.0 110.597 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.503 HG13 ' HB3' ' A' ' 101' ' ' SER . 4.5 p -68.44 103.4 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.572 1.812 0 CA-C-O 121.902 0.858 . . . . 0.0 112.066 179.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 86.7 mt -58.41 -40.89 83.67 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 124.845 1.258 . . . . 0.0 112.694 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -78.52 7.04 7.31 Favored 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -175.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.503 ' HB3' HG13 ' A' ' 98' ' ' VAL . 40.9 t -118.42 -25.31 6.55 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 122.952 0.501 . . . . 0.0 111.973 173.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.2 p -69.16 115.21 8.19 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.583 0.353 . . . . 0.0 111.14 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.6 mp0 -64.44 160.8 18.4 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.007 0.523 . . . . 0.0 111.978 175.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.408 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 3.3 tmtp? -66.06 -27.63 68.23 Favored 'General case' 0 CA--C 1.561 1.402 0 CA-C-O 121.191 0.52 . . . . 0.0 109.754 174.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.52 ' HB3' ' HB ' ' A' ' 40' ' ' THR . 45.3 t -60.12 -28.76 68.13 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.248 0.619 . . . . 0.0 111.794 173.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.545 ' HA ' HG23 ' A' ' 41' ' ' VAL . . . -65.2 -44.21 89.08 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 122.813 0.445 . . . . 0.0 111.282 171.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.421 ' HA ' HG22 ' A' ' 110' ' ' VAL . 9.5 mp -64.45 6.19 0.22 Allowed 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 125.463 1.505 . . . . 0.0 113.741 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -95.99 -14.71 22.8 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.475 0.71 . . . . 0.0 110.459 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.403 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 19.7 m-85 -114.39 -41.21 3.49 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.664 1.186 . . . . 0.0 108.469 178.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.521 HG21 HD21 ' A' ' 115' ' ' LEU . 1.7 m -92.99 -168.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.861 0.839 . . . . 0.0 110.739 164.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.3 t -131.01 156.01 45.85 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.949 1.3 . . . . 0.0 107.886 160.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 tt -49.28 -39.21 29.9 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.995 0.518 . . . . 0.0 111.625 170.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.1 77.05 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.206 0.602 . . . . 0.0 112.495 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -68.43 -32.86 73.18 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.792 0.437 . . . . 0.0 111.025 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.532 HD22 ' HE1' ' A' ' 85' ' ' TRP . 29.5 mt -73.26 -55.64 6.16 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.902 -178.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -66.0 -24.31 66.75 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.78 1.232 . . . . 0.0 112.993 -176.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -53.21 -34.27 56.35 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 174.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 69.3 m-70 -115.19 -23.02 9.16 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.365 0.666 . . . . 0.0 112.415 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -83.29 -25.27 31.73 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.321 0.648 . . . . 0.0 112.157 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.2 mm? 68.48 139.6 0.06 OUTLIER Pre-proline 0 CA--C 1.561 1.372 0 C-N-CA 125.494 1.518 . . . . 0.0 112.557 -174.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -74.24 16.55 0.56 Allowed 'Trans proline' 0 C--N 1.382 2.296 0 C-N-CA 123.568 2.846 . . . . 0.0 115.252 -173.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 59.1 t 62.4 107.68 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.509 0 C-N-CA 125.328 1.451 . . . . 0.0 113.05 173.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.9 tt -65.8 -20.36 66.22 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.998 0.919 . . . . 0.0 112.715 -178.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -61.19 91.98 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.522 0.729 . . . . 0.0 112.654 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 77.3 t60 44.55 106.04 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 126.348 1.859 . . . . 0.0 115.571 170.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -95.25 -58.37 2.16 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.536 0.334 . . . . 0.0 110.616 169.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -143.1 -166.61 2.35 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 124.297 1.039 . . . . 0.0 110.393 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -102.37 -54.76 2.61 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 165.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 20.8 p80 -158.56 138.46 12.1 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.576 1.15 . . . . 0.0 108.862 169.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 . . . . . 0 CA--C 1.571 1.755 0 C-N-CA 124.65 1.18 . . . . 0.0 111.17 -169.371 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.2 -68.31 3.31 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 116.404 -0.362 . . . . 0.0 113.167 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -81.44 115.94 21.01 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.182 0.993 . . . . 0.0 111.292 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -163.46 106.06 0.27 Allowed Glycine 0 C--N 1.351 1.38 0 N-CA-C 112.388 -0.285 . . . . 0.0 112.388 175.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -106.46 157.96 17.26 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.772 0.829 . . . . 0.0 111.41 -176.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -95.96 177.65 5.68 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.383 0.673 . . . . 0.0 111.285 175.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 11.2 m -66.76 -18.45 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -174.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -68.99 -30.34 68.73 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.876 0.871 . . . . 0.0 111.175 175.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 96.62 -78.1 0.72 Allowed Glycine 0 C--N 1.344 0.976 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.78 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -172.8 167.14 5.26 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.211 1.005 . . . . 0.0 111.588 178.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -158.93 104.82 1.74 Allowed 'General case' 0 CA--C 1.565 1.534 0 C-N-CA 124.125 0.97 . . . . 0.0 110.519 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 89.3 mt -114.39 70.01 0.72 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.153 -0.967 . . . . 0.0 110.898 -178.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -140.24 153.12 46.44 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 124.863 1.265 . . . . 0.0 109.721 175.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.5 p -169.52 148.07 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 78.2 m -145.84 0.41 0.85 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.811 0.844 . . . . 0.0 111.979 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.4 t 59.54 129.24 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 124.929 1.291 . . . . 0.0 113.661 -168.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 77.0 m 75.97 -39.27 0.37 Allowed 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 125.62 1.568 . . . . 0.0 114.069 176.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.61 154.49 91.21 Favored Pre-proline 0 CA--C 1.561 1.39 0 C-N-CA 123.918 0.887 . . . . 0.0 112.292 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -68.02 -175.37 0.78 Allowed 'Trans proline' 0 C--N 1.385 2.466 0 C-N-CA 122.71 2.273 . . . . 0.0 112.997 172.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 51.7 mtm 72.92 -7.73 1.41 Allowed 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 124.99 1.316 . . . . 0.0 112.889 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.0 t -131.59 116.46 17.42 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.216 1.006 . . . . 0.0 109.844 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -175.59 -23.69 0.03 OUTLIER Glycine 0 C--N 1.346 1.133 0 CA-C-N 116.374 -0.376 . . . . 0.0 113.721 -175.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -76.51 -70.21 0.46 Allowed 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 122.699 0.4 . . . . 0.0 110.208 176.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -83.12 -57.86 3.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 122.062 -0.399 . . . . 0.0 111.131 172.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 50.3 ttm-85 72.5 -57.61 0.62 Allowed 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 125.64 1.576 . . . . 0.0 112.726 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 72.98 10.79 5.3 Favored 'General case' 0 N--CA 1.505 2.293 0 C-N-CA 125.097 1.359 . . . . 0.0 113.029 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.91 36.47 92.15 Favored Glycine 0 N--CA 1.482 1.762 0 N-CA-C 115.186 0.834 . . . . 0.0 115.186 176.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 47.5 t80 62.93 -79.63 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.972 1.309 . . . . 0.0 111.909 -178.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 74.2 m -98.88 -90.13 0.3 Allowed 'General case' 0 CA--C 1.556 1.199 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 172.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.498 ' HG2' ' HB2' ' A' ' 105' ' ' SER . 1.8 mp0 -137.29 -61.34 0.65 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 124.461 1.104 . . . . 0.0 108.338 176.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 t -158.61 -39.39 0.06 Allowed 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 113.945 -1.48 . . . . 0.0 108.696 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 69.41 130.21 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 125.793 1.637 . . . . 0.0 113.366 166.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 21.4 t -96.01 -10.12 9.04 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.673 0 C-N-CA 123.597 0.759 . . . . 0.0 112.088 -174.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 72.37 -36.84 0.37 Allowed 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 126.429 1.892 . . . . 0.0 113.401 -177.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -98.38 40.51 1.18 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.89 0.876 . . . . 0.0 110.609 171.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 69.38 149.61 0.08 Allowed 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 125.678 1.591 . . . . 0.0 113.166 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 152.26 -112.13 0.52 Allowed Glycine 0 CA--C 1.535 1.295 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.151 -178.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.476 ' HB3' ' NE2' ' A' ' 30' ' ' GLN . 67.9 m 63.38 8.57 3.56 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 174.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -86.11 84.97 7.37 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.374 0.67 . . . . 0.0 110.066 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' A' ' 103' ' ' GLU . 4.9 t -130.76 103.41 6.58 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.364 0.666 . . . . 0.0 110.695 -175.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.6 t -138.34 111.89 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 C-N-CA 123.255 0.622 . . . . 0.0 110.353 -178.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 72.2 m -101.42 106.41 17.55 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 171.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.545 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -139.53 147.92 41.9 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.36 0.664 . . . . 0.0 109.689 -175.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -106.61 112.79 25.94 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.461 0.304 . . . . 0.0 111.375 -172.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.576 ' HE2' ' HG2' ' A' ' 84' ' ' ARG . 29.7 mtm -110.0 137.68 47.43 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.044 170.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.1 p -83.7 167.98 16.69 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.602 0.761 . . . . 0.0 111.689 -171.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.416 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 28.4 tt0 -61.12 -30.37 70.33 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.506 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -49.56 -55.33 13.85 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.962 0.905 . . . . 0.0 111.509 174.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -76.22 -37.6 57.53 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.451 HD11 ' HB2' ' A' ' 45' ' ' MET . 10.9 mp -67.41 -33.74 75.8 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 118.351 0.523 . . . . 0.0 111.706 -177.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.416 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 68.6 mt -72.61 -27.88 62.43 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.239 0.616 . . . . 0.0 111.245 170.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -73.83 -34.07 64.41 Favored 'General case' 0 CA--C 1.563 1.47 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 172.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 73.3 m -66.76 -31.09 71.51 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.312 0.645 . . . . 0.0 112.599 -175.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.545 ' HB2' ' HA ' ' A' ' 59' ' ' ASP . 36.4 ptt180 -70.44 -27.53 64.32 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.063 0.545 . . . . 0.0 111.472 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -76.15 -34.44 59.39 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 122.618 0.367 . . . . 0.0 110.174 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -81.21 82.71 7.02 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.712 0.805 . . . . 0.0 110.055 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 116.35 -82.14 0.32 Allowed Glycine 0 N--CA 1.478 1.496 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.505 178.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -156.31 149.15 23.97 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 123.358 0.663 . . . . 0.0 111.256 -176.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.545 ' HA ' ' HB2' ' A' ' 54' ' ' ARG . 9.8 p-10 -90.25 41.36 1.05 Allowed 'General case' 0 CA--C 1.565 1.531 0 C-N-CA 123.874 0.869 . . . . 0.0 113.223 -174.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -66.05 -40.27 90.82 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 172.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 13.9 tpt 75.13 -58.62 0.57 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 125.757 1.623 . . . . 0.0 112.578 175.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.407 HG23 ' HA ' ' A' ' 70' ' ' PRO . 84.9 m -59.73 123.81 73.21 Favored Pre-proline 0 CA--C 1.556 1.201 0 C-N-CA 124.205 1.002 . . . . 0.0 111.302 175.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.47 176.93 9.45 Favored 'Trans proline' 0 C--N 1.375 1.938 0 C-N-CA 122.22 1.946 . . . . 0.0 112.503 176.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 70.15 157.8 0.16 Allowed Pre-proline 0 N--CA 1.498 1.96 0 C-N-CA 124.592 1.157 . . . . 0.0 112.891 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -77.21 33.02 0.43 Allowed 'Trans proline' 0 C--N 1.381 2.274 0 C-N-CA 122.528 2.152 . . . . 0.0 113.477 170.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -123.02 131.11 53.57 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.316 1.447 . . . . 0.0 108.692 178.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -100.42 -6.45 25.65 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -170.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -76.54 84.28 3.23 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 -177.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 65.41 142.4 0.07 OUTLIER Pre-proline 0 N--CA 1.494 1.766 0 C-N-CA 125.554 1.542 . . . . 0.0 114.26 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.407 ' HA ' HG23 ' A' ' 62' ' ' THR . 51.6 Cg_endo -68.16 93.53 0.4 Allowed 'Trans proline' 0 C--N 1.383 2.369 0 C-N-CA 122.381 2.054 . . . . 0.0 111.53 172.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -65.14 -41.33 97.07 Favored Glycine 0 C--N 1.35 1.317 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.7 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -94.88 102.73 14.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.191 0.596 . . . . 0.0 110.118 174.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -97.93 -167.67 1.55 Allowed 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.87 112.27 5.45 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.79 -1.38 58.09 Favored Glycine 0 N--CA 1.475 1.272 0 CA-C-N 115.704 -0.68 . . . . 0.0 113.883 177.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.03 104.42 6.55 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.184 0.516 . . . . 0.0 111.675 178.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.541 ' HD3' HG11 ' A' ' 98' ' ' VAL . 13.7 ptt180 -81.19 91.65 6.2 Favored 'General case' 0 CA--C 1.557 1.221 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.03 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -168.51 120.88 0.82 Allowed 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.232 0.613 . . . . 0.0 110.271 176.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 48.5 t 51.62 25.23 2.69 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 124.166 0.986 . . . . 0.0 112.648 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.545 HD13 ' HB3' ' A' ' 43' ' ' ALA . 3.4 tm? -66.86 123.4 20.05 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.081 0.952 . . . . 0.0 109.536 -177.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.435 ' SG ' ' HB3' ' A' ' 83' ' ' SER . 42.6 t -59.01 102.35 0.12 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.224 0.609 . . . . 0.0 110.924 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.96 -26.89 62.89 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.922 0.889 . . . . 0.0 112.223 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.435 ' HB3' ' SG ' ' A' ' 81' ' ' CYS . 45.7 t -67.25 -41.46 85.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.566 0.746 . . . . 0.0 111.483 172.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.576 ' HG2' ' HE2' ' A' ' 45' ' ' MET . 56.4 ttm-85 -73.89 -31.62 63.2 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.004 0.522 . . . . 0.0 111.843 179.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.593 ' HE1' HD22 ' A' ' 115' ' ' LEU . 6.0 t-105 -64.45 -42.1 96.16 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 169.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -58.18 -38.08 76.0 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.708 0.403 . . . . 0.0 110.85 174.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 83' ' ' SER . 41.6 mm-40 -62.18 -39.13 91.66 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.893 0.477 . . . . 0.0 111.774 176.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.53 -41.23 96.51 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.152 0.501 . . . . 0.0 111.393 174.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.721 ' HA ' ' HB1' ' A' ' 94' ' ' ALA . 40.2 t80 -67.41 -42.59 82.99 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.41 -176.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -77.03 -32.24 56.9 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.324 0.649 . . . . 0.0 111.988 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.88 -22.93 62.22 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.028 0.531 . . . . 0.0 111.74 176.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 106.33 -11.01 43.44 Favored Glycine 0 N--CA 1.476 1.328 0 CA-C-O 119.717 -0.491 . . . . 0.0 114.275 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' MET . . . . . 0.414 ' N ' ' SD ' ' A' ' 93' ' ' MET . 1.1 mpt? -66.79 -66.91 0.49 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 117.41 0.605 . . . . 0.0 109.947 176.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.721 ' HB1' ' HA ' ' A' ' 89' ' ' PHE . . . 48.14 87.34 0.13 Allowed Pre-proline 0 CA--C 1.558 1.269 0 C-N-CA 125.135 1.374 . . . . 0.0 114.018 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -64.85 158.22 52.23 Favored 'Trans proline' 0 CA--C 1.566 2.076 0 C-N-CA 123.18 2.586 . . . . 0.0 113.409 172.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -68.29 109.44 2.0 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.362 2.042 . . . . 0.0 112.35 173.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.7 p -95.99 137.01 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 123.672 0.789 . . . . 0.0 110.916 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.541 HG11 ' HD3' ' A' ' 77' ' ' ARG . 5.5 p -77.34 107.77 9.4 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.741 0 C-N-CA 123.953 0.901 . . . . 0.0 113.076 -174.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 98.6 mt -67.79 -36.81 81.1 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.823 0.849 . . . . 0.0 112.52 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -78.43 20.51 0.41 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.624 0.77 . . . . 0.0 112.769 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.0 t -142.79 -44.23 0.31 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.688 0.795 . . . . 0.0 111.324 175.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.7 m -56.88 121.49 10.02 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 123.862 0.865 . . . . 0.0 112.737 -173.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' THR . 1.9 mp0 -74.14 166.8 22.79 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.034 0.933 . . . . 0.0 113.071 -173.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -68.59 -13.42 62.33 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.101 0.96 . . . . 0.0 113.034 -177.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.498 ' HB2' ' HG2' ' A' ' 30' ' ' GLN . 33.5 t -57.35 -48.68 78.38 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 122.971 0.509 . . . . 0.0 110.613 172.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.58 -32.49 63.09 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.536 0.734 . . . . 0.0 112.82 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.469 ' HG ' ' HB2' ' A' ' 112' ' ' LEU . 8.6 mp -66.16 -22.81 66.38 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.007 0.523 . . . . 0.0 112.371 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.2 mtt85 -89.32 -7.49 55.23 Favored 'General case' 0 CA--C 1.561 1.393 0 C-N-CA 123.686 0.794 . . . . 0.0 112.78 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -117.9 -57.97 2.05 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 123.331 0.652 . . . . 0.0 112.057 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.437 HG23 ' CD1' ' A' ' 85' ' ' TRP . 13.3 p -98.66 -25.75 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 C-N-CA 123.589 0.756 . . . . 0.0 111.767 -176.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 46.8 t 77.58 149.46 0.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 125.689 1.596 . . . . 0.0 112.394 -173.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.546 ' HA ' HD13 ' A' ' 115' ' ' LEU . 4.6 tt -61.31 -37.12 82.08 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.713 1.205 . . . . 0.0 113.021 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.47 -34.8 76.08 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -173.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.35 -34.0 72.12 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.103 0.961 . . . . 0.0 111.481 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.593 HD22 ' HE1' ' A' ' 85' ' ' TRP . 57.4 mt -69.15 -48.01 63.45 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 121.943 0.877 . . . . 0.0 110.434 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -70.26 -37.87 74.99 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.848 -175.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -57.69 -16.74 11.79 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -132.35 39.12 3.42 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.392 0.677 . . . . 0.0 111.56 173.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -153.25 -63.09 0.15 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.175 0.59 . . . . 0.0 111.294 170.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 59.1 tp -142.55 111.13 5.82 Favored Pre-proline 0 N--CA 1.486 1.366 0 C-N-CA 123.81 0.844 . . . . 0.0 109.355 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -77.22 81.56 2.59 Favored 'Trans proline' 0 CA--C 1.56 1.781 0 C-N-CA 122.707 2.271 . . . . 0.0 112.934 -171.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 124' ' ' GLU . 14.2 p -64.74 138.53 22.96 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.321 0 C-N-CA 123.909 0.884 . . . . 0.0 111.424 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.0 pp -101.18 -6.13 24.67 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.744 0.418 . . . . 0.0 111.677 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.409 ' H ' HG22 ' A' ' 122' ' ' VAL . 30.7 mp0 -84.2 31.15 0.51 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.654 1.181 . . . . 0.0 111.782 175.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -66.64 114.16 5.36 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.88 0.472 . . . . 0.0 109.767 172.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 69.8 m80 -121.25 145.75 47.52 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.493 0.717 . . . . 0.0 111.29 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 67.8 t60 -78.29 111.12 13.94 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.234 1.014 . . . . 0.0 110.367 -177.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 12.8 m170 62.22 -81.71 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 124.432 1.093 . . . . 0.0 111.725 -173.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 -174.87 -41.61 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.73 1.212 . . . . 0.0 109.901 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 80.1 t60 . . . . . 0 CA--C 1.558 1.282 0 C-N-CA 124.73 1.212 . . . . 0.0 109.664 -177.096 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.3 mtt . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 120.852 0.358 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -150.44 -154.07 6.34 Favored Glycine 0 N--CA 1.473 1.135 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.293 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -150.8 -177.3 5.92 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 117.346 0.573 . . . . 0.0 111.911 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.07 149.71 19.38 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.783 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -89.36 115.17 26.63 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -168.38 113.74 0.64 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.899 0.88 . . . . 0.0 110.236 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.689 ' H ' ' HB2' ' A' ' 11' ' ' ASP . 21.6 t 75.28 -48.21 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.394 0 C-N-CA 126.689 1.995 . . . . 0.0 112.736 175.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 pp -53.46 -25.24 15.41 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.591 1.556 . . . . 0.0 112.825 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -150.3 59.83 0.43 Allowed Glycine 0 C--N 1.343 0.94 0 N-CA-C 110.415 -1.074 . . . . 0.0 110.415 174.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 76.06 160.31 0.22 Allowed 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 125.56 1.544 . . . . 0.0 111.684 -177.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.689 ' HB2' ' H ' ' A' ' 7' ' ' VAL . 27.5 t70 -171.06 94.32 0.18 Allowed 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.02 -177.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 72.0 mt 53.5 39.47 30.05 Favored 'General case' 0 CA--C 1.558 1.273 0 C-N-CA 124.711 1.204 . . . . 0.0 113.695 169.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -72.38 152.03 42.28 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.153 0.581 . . . . 0.0 111.211 175.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.583 HG13 ' H ' ' A' ' 29' ' ' CYS . 7.5 p -68.41 98.72 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.389 0 CA-C-O 122.503 1.144 . . . . 0.0 111.133 -176.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 54.0 t -111.42 -3.91 15.06 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.099 0.96 . . . . 0.0 112.128 -172.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.8 t 75.94 -22.84 0.26 Allowed 'General case' 0 N--CA 1.503 2.193 0 C-N-CA 125.58 1.552 . . . . 0.0 113.856 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 83.7 m -59.84 -33.86 72.34 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 124.206 1.002 . . . . 0.0 112.755 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -123.48 129.02 25.03 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 123.322 0.649 . . . . 0.0 110.824 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -65.13 115.49 3.33 Favored 'Trans proline' 0 C--N 1.379 2.143 0 C-N-CA 123.156 2.571 . . . . 0.0 112.224 174.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 59.9 ttp 61.93 89.1 0.08 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.852 1.261 . . . . 0.0 111.655 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.5 p -90.84 136.47 33.05 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.751 0.82 . . . . 0.0 110.898 178.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 71.05 -86.32 0.39 Allowed Glycine 0 C--N 1.354 1.538 0 O-C-N 123.108 0.255 . . . . 0.0 112.595 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -137.66 -44.68 0.54 Allowed 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.632 0.773 . . . . 0.0 109.519 172.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -149.34 -69.18 0.21 Allowed 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.793 0.837 . . . . 0.0 110.876 173.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? 59.68 -79.55 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 124.449 1.1 . . . . 0.0 110.33 -163.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 64.4 t30 67.18 138.42 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 125.763 1.625 . . . . 0.0 113.036 173.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.89 -19.05 10.39 Favored Glycine 0 N--CA 1.48 1.588 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.917 -176.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 64.94 83.3 0.17 Allowed 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 125.369 1.468 . . . . 0.0 111.99 177.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.583 ' H ' HG13 ' A' ' 14' ' ' VAL . 53.2 t -80.65 103.11 10.27 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.793 0.837 . . . . 0.0 110.291 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -118.69 35.62 4.72 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-O 122.142 0.972 . . . . 0.0 109.376 -177.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 13.9 t -128.63 165.55 20.61 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.38 -177.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -68.8 123.24 20.4 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.047 0.539 . . . . 0.0 112.431 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.57 -11.44 14.0 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.316 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.076 166.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -66.31 -14.06 61.46 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 124.787 1.235 . . . . 0.0 111.972 173.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 72.69 11.12 5.52 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.21 1.404 . . . . 0.0 112.504 174.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.432 ' HA ' ' HE ' ' A' ' 36' ' ' ARG . 10.1 mmp_? -85.53 -23.51 27.66 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.458 -0.777 . . . . 0.0 112.472 -178.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.55 -71.15 1.87 Allowed Glycine 0 CA--C 1.537 1.447 0 N-CA-C 114.127 0.411 . . . . 0.0 114.127 172.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.7 m -72.27 80.8 1.0 Allowed 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.545 0.738 . . . . 0.0 111.414 178.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 -171.48 1.13 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 124.562 1.145 . . . . 0.0 110.72 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.8 p -92.26 115.59 28.22 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 121.462 0.649 . . . . 0.0 111.093 -169.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.564 HG12 ' HB1' ' A' ' 82' ' ' ALA . 18.6 t -127.23 127.81 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.686 0.794 . . . . 0.0 109.954 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 78' ' ' TRP . 93.6 m -136.39 108.86 7.38 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 168.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.591 ' HB1' HD12 ' A' ' 80' ' ' LEU . . . -140.43 150.77 44.25 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.123 0.969 . . . . 0.0 109.22 -170.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.468 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 20.2 tt0 -114.76 124.5 51.94 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.984 0.421 . . . . 0.0 111.812 -177.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.466 ' HE3' ' HG2' ' A' ' 95' ' ' PRO . 67.1 mmm -108.21 138.46 44.45 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.079 0.951 . . . . 0.0 109.775 175.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 7.0 t -85.5 156.44 20.78 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.865 0.466 . . . . 0.0 110.398 174.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.538 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 37.6 tt0 -61.25 -29.29 69.75 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.065 0.546 . . . . 0.0 111.624 -175.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -48.3 -45.92 35.54 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 124.327 1.051 . . . . 0.0 111.845 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -76.93 -39.96 48.85 Favored 'General case' 0 CA--C 1.558 1.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.274 174.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.28 -26.1 68.34 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.538 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 95.9 mt -74.27 -47.47 34.72 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.691 0.796 . . . . 0.0 109.763 172.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -58.4 -31.77 68.01 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.642 0.777 . . . . 0.0 111.9 174.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.9 t -60.52 -36.2 77.81 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.535 0.734 . . . . 0.0 110.857 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.55 ' HB2' ' HB3' ' A' ' 59' ' ' ASP . 20.9 ttt180 -75.33 -50.64 15.38 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.946 0.898 . . . . 0.0 111.012 174.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -65.02 -18.07 64.98 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.518 0.727 . . . . 0.0 112.925 -176.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 -94.23 -56.42 2.84 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.298 0.639 . . . . 0.0 110.18 172.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -124.84 -88.62 0.78 Allowed Glycine 0 C--N 1.349 1.28 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.417 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -154.75 152.12 29.51 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.537 0.735 . . . . 0.0 111.162 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.55 ' HB3' ' HB2' ' A' ' 54' ' ' ARG . 4.4 p-10 -105.01 168.41 9.07 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.173 0.589 . . . . 0.0 109.757 171.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 95.6 mt -121.22 7.3 10.22 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.214 0.605 . . . . 0.0 111.138 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.46 14.8 24.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -170.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 81.4 m -71.19 118.97 70.69 Favored Pre-proline 0 N--CA 1.492 1.67 0 C-N-CA 122.736 0.415 . . . . 0.0 110.88 170.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.6 108.75 0.56 Allowed 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 123.187 2.592 . . . . 0.0 113.557 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 37.0 mtp180 -92.64 129.6 39.85 Favored Pre-proline 0 N--CA 1.485 1.284 0 C-N-CA 123.301 0.64 . . . . 0.0 110.754 176.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -65.79 -23.19 55.83 Favored 'Trans proline' 0 C--N 1.382 2.29 0 C-N-CA 122.951 2.434 . . . . 0.0 113.351 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -64.64 -33.02 74.96 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.595 1.158 . . . . 0.0 112.133 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -117.08 -17.48 10.3 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.673 0.789 . . . . 0.0 112.16 -176.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 66.62 -67.1 0.16 Allowed 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 125.432 1.493 . . . . 0.0 111.119 -167.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -74.38 122.5 87.66 Favored Pre-proline 0 CA--C 1.563 1.452 0 C-N-CA 124.114 0.966 . . . . 0.0 111.098 178.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -86.53 -152.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.375 1.973 0 C-N-CA 123.197 2.598 . . . . 0.0 112.877 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -80.4 -162.76 27.4 Favored Glycine 0 CA--C 1.537 1.459 0 CA-C-N 116.768 -0.196 . . . . 0.0 113.435 174.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -67.45 138.91 56.98 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.639 0.776 . . . . 0.0 112.299 -174.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -106.01 -179.92 4.08 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.371 1.068 . . . . 0.0 111.865 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -83.14 123.64 29.72 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.236 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 109.86 -10.46 32.14 Favored Glycine 0 N--CA 1.477 1.429 0 CA-C-N 116.743 -0.208 . . . . 0.0 113.521 -174.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -85.61 83.98 7.73 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.306 0.642 . . . . 0.0 111.211 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.468 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -85.04 86.28 7.4 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-O 121.236 0.541 . . . . 0.0 111.57 179.592 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.41 ' HA ' ' SG ' ' A' ' 42' ' ' CYS . 42.3 t90 179.32 122.62 0.05 Allowed 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.916 0.886 . . . . 0.0 109.449 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 84.9 m 57.9 25.81 12.56 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 124.138 0.975 . . . . 0.0 113.209 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.591 HD12 ' HB1' ' A' ' 43' ' ' ALA . 2.8 tm? -66.38 124.16 21.97 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.389 0.676 . . . . 0.0 109.423 175.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 59.0 m -61.39 105.68 0.54 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.309 0.644 . . . . 0.0 109.506 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.564 ' HB1' HG12 ' A' ' 41' ' ' VAL . . . -59.22 -23.63 62.47 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -169.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.9 m -63.77 -30.19 71.31 Favored 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 123.325 0.65 . . . . 0.0 112.347 175.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -57.3 -47.43 81.5 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 124.304 1.041 . . . . 0.0 110.291 171.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.668 ' HE1' HD22 ' A' ' 115' ' ' LEU . 13.5 t-105 -71.74 -41.26 68.68 Favored 'General case' 0 CA--C 1.565 1.532 0 CA-C-N 114.325 -1.307 . . . . 0.0 111.964 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -63.4 -48.08 79.32 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.959 0.904 . . . . 0.0 111.114 -177.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.73 -28.59 67.77 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.348 0.659 . . . . 0.0 111.57 178.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.55 -41.06 96.57 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.208 0.603 . . . . 0.0 111.67 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.74 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 84.9 t80 -67.09 -48.36 68.41 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.977 176.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.28 -25.19 67.94 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.67 0.788 . . . . 0.0 112.354 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.55 -22.62 50.76 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.639 0.775 . . . . 0.0 111.78 175.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.92 -4.74 42.12 Favored Glycine 0 C--N 1.351 1.402 0 N-CA-C 114.259 0.464 . . . . 0.0 114.259 176.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' MET . . . . . 0.443 ' N ' ' SD ' ' A' ' 93' ' ' MET . 1.5 mpt? -84.57 -73.62 0.42 Allowed 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 117.314 0.557 . . . . 0.0 109.963 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.74 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 58.07 95.17 0.05 OUTLIER Pre-proline 0 CA--C 1.565 1.541 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 178.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.466 ' HG2' ' HE3' ' A' ' 45' ' ' MET . 86.6 Cg_exo -55.62 161.58 7.6 Favored 'Trans proline' 0 CA--C 1.564 1.981 0 C-N-CA 123.748 2.965 . . . . 0.0 114.972 169.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.01 117.42 5.09 Favored 'Trans proline' 0 C--N 1.372 1.795 0 C-N-CA 122.332 2.021 . . . . 0.0 111.759 169.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.473 HG11 ' HA ' ' A' ' 115' ' ' LEU . 14.2 p -99.68 159.71 3.54 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 123.691 0.796 . . . . 0.0 110.609 -177.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 m -92.67 99.98 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 124.215 1.006 . . . . 0.0 112.346 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.588 HD13 ' HG2' ' A' ' 116' ' ' GLN . 4.7 mt -74.23 -16.81 60.95 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.305 -0.872 . . . . 0.0 111.717 170.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -74.42 -12.31 60.47 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 123.817 0.847 . . . . 0.0 112.205 174.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.9 t -128.37 -40.53 1.61 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.016 0.526 . . . . 0.0 112.079 -175.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 55.0 p -55.34 99.3 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 CA-C-O 121.172 0.51 . . . . 0.0 111.838 171.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.51 ' HG3' ' H ' ' A' ' 105' ' ' SER . 12.7 tp10 -66.17 154.6 39.3 Favored 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 123.937 0.895 . . . . 0.0 110.781 172.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -56.54 -23.27 38.82 Favored 'General case' 0 CA--C 1.565 1.525 0 C-N-CA 124.237 1.015 . . . . 0.0 112.055 177.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.51 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 25.1 m -58.2 -27.66 64.1 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.99 0.916 . . . . 0.0 112.649 176.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.522 ' HA ' HG22 ' A' ' 41' ' ' VAL . . . -61.78 -23.43 66.18 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.229 1.012 . . . . 0.0 113.045 178.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.416 HD21 ' HB2' ' A' ' 112' ' ' LEU . 9.6 mp -67.37 -3.7 8.97 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -178.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -70.88 -33.38 70.54 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 122.059 -0.401 . . . . 0.0 111.533 167.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.529 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 49.5 m-85 -112.43 -23.43 10.32 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.054 0.942 . . . . 0.0 111.582 -171.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.461 HG21 ' H ' ' A' ' 111' ' ' SER . 4.9 p -129.69 -178.43 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.456 0 C-N-CA 123.832 0.853 . . . . 0.0 109.613 177.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' SER . . . . . 0.461 ' H ' HG21 ' A' ' 110' ' ' VAL . 27.2 p -109.89 164.2 12.81 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.494 -0.754 . . . . 0.0 110.739 170.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.416 ' HB2' HD21 ' A' ' 107' ' ' LEU . 4.6 tt -66.02 -39.45 90.23 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.433 0.693 . . . . 0.0 111.075 171.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.5 -33.83 74.46 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.437 0.695 . . . . 0.0 112.282 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.93 -50.22 73.27 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.269 0.628 . . . . 0.0 111.074 169.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.668 HD22 ' HE1' ' A' ' 85' ' ' TRP . 20.2 mt -65.8 -48.77 70.62 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.077 -172.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.588 ' HG2' HD13 ' A' ' 99' ' ' LEU . 7.0 mt-30 -71.49 -26.81 62.84 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.1 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -61.35 -35.76 78.32 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 173.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -126.47 27.71 6.1 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.338 0.655 . . . . 0.0 112.215 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -166.09 172.19 11.61 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.157 0.983 . . . . 0.0 110.643 172.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.1 pp -117.48 142.82 31.0 Favored Pre-proline 0 N--CA 1.484 1.272 0 C-N-CA 123.081 0.553 . . . . 0.0 110.515 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.501 ' HB2' HD13 ' A' ' 123' ' ' LEU . 51.6 Cg_endo -66.4 129.93 22.6 Favored 'Trans proline' 0 C--N 1.376 1.997 0 C-N-CA 122.293 1.995 . . . . 0.0 111.803 177.116 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.5 p -85.93 53.58 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.642 0 CA-C-O 123.478 1.609 . . . . 0.0 111.807 -173.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.501 HD13 ' HB2' ' A' ' 121' ' ' PRO . 10.3 mp -90.1 82.63 6.06 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.05 173.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.21 34.68 4.73 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.839 0.856 . . . . 0.0 112.007 -174.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -132.08 90.34 2.8 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 121.719 0.771 . . . . 0.0 111.346 -177.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -91.85 -175.96 4.29 Favored 'General case' 0 CA--C 1.576 1.944 0 C-N-CA 124.141 0.976 . . . . 0.0 110.327 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 27.7 m80 66.53 41.82 3.02 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 124.712 1.205 . . . . 0.0 112.188 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 -132.25 96.46 3.88 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.728 0.811 . . . . 0.0 110.345 173.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 21.1 p-80 -77.28 90.81 3.75 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 170.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 66.4 m80 . . . . . 0 CA--C 1.569 1.678 0 C-N-CA 124.322 1.049 . . . . 0.0 110.872 -171.237 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 110.858 -0.053 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.87 118.44 7.55 Favored Glycine 0 CA--C 1.534 1.253 0 N-CA-C 112.146 -0.382 . . . . 0.0 112.146 174.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -96.13 130.9 43.05 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.57 0.748 . . . . 0.0 111.868 -175.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -118.76 -165.25 13.17 Favored Glycine 0 N--CA 1.477 1.391 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.285 173.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -160.17 138.64 10.3 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.861 0.464 . . . . 0.0 111.777 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -81.25 148.97 29.21 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.972 0.509 . . . . 0.0 110.658 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 m -65.89 -18.82 24.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 C-N-CA 123.726 0.81 . . . . 0.0 112.147 -177.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 78.7 mt -73.1 -49.45 28.39 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.759 1.224 . . . . 0.0 112.429 -166.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 175.4 -96.97 0.11 Allowed Glycine 0 N--CA 1.475 1.253 0 CA-C-N 116.836 -0.165 . . . . 0.0 113.039 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -130.79 143.75 50.96 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.585 0.754 . . . . 0.0 111.735 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -165.29 49.4 0.1 Allowed 'General case' 0 CA--C 1.558 1.278 0 CA-C-O 122.38 1.086 . . . . 0.0 108.515 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.565 HD21 ' H ' ' A' ' 12' ' ' LEU . 2.1 pt? -90.34 32.16 0.96 Allowed 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.59 -171.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -79.72 69.37 6.02 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-O 121.708 0.766 . . . . 0.0 110.396 174.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.477 HG23 ' HD2' ' A' ' 28' ' ' PHE . 6.7 p -158.09 120.76 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 124.181 0.992 . . . . 0.0 110.247 -177.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.617 ' H ' ' HB2' ' A' ' 28' ' ' PHE . 61.9 m -67.83 -59.63 3.15 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.388 0.675 . . . . 0.0 110.933 175.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.5 t 61.46 -173.18 0.14 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.39 1.076 . . . . 0.0 112.344 176.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.8 t 71.66 -67.62 0.25 Allowed 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 125.391 1.476 . . . . 0.0 113.973 170.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.61 138.82 76.42 Favored Pre-proline 0 CA--C 1.564 1.507 0 C-N-CA 123.964 0.906 . . . . 0.0 112.764 -178.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.12 -35.24 76.6 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 122.974 2.449 . . . . 0.0 113.875 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 23.6 ttt -73.35 -12.02 60.68 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 122.98 0.512 . . . . 0.0 111.861 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.0 m -63.25 -22.36 66.82 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.035 0.534 . . . . 0.0 111.241 174.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.69 -84.22 1.23 Allowed Glycine 0 C--N 1.352 1.422 0 CA-C-O 119.986 -0.341 . . . . 0.0 112.672 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 36.9 t90 -172.49 -71.73 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.682 0.793 . . . . 0.0 110.664 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -160.82 99.28 1.24 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.976 0.91 . . . . 0.0 108.884 -176.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -91.66 -70.02 0.71 Allowed 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.349 0.66 . . . . 0.0 110.36 -176.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -162.7 44.24 0.13 Allowed 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.479 0.712 . . . . 0.0 109.182 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 70.35 102.11 0.04 OUTLIER Glycine 0 C--N 1.354 1.557 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.81 -173.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.617 ' HB2' ' H ' ' A' ' 15' ' ' CYS . 46.3 m-85 -75.9 81.8 2.8 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.155 0.582 . . . . 0.0 111.226 -172.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 60.2 m -63.92 -71.93 0.16 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 122.614 0.365 . . . . 0.0 110.217 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 72.09 -39.8 0.46 Allowed 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 125.426 1.49 . . . . 0.0 114.438 171.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.655 ' HA ' HG21 ' A' ' 40' ' ' THR . 5.7 t -61.6 104.57 0.44 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.334 1.054 . . . . 0.0 112.658 -176.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' A' ' 35' ' ' ASP . 13.9 m-20 -63.65 -31.44 72.61 Favored 'General case' 0 N--CA 1.478 0.925 0 CA-C-N 115.203 -0.908 . . . . 0.0 112.52 177.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 57.3 t 65.75 -70.13 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.386 0 C-N-CA 125.364 1.466 . . . . 0.0 110.88 -173.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -146.76 -2.64 0.63 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 32' ' ' ASP . 27.8 m-20 -109.63 160.93 15.86 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -174.108 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 53.81 -87.76 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 125.306 1.442 . . . . 0.0 113.42 178.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.63 ' HA3' ' HD3' ' A' ' 108' ' ' ARG . . . 112.33 92.22 2.03 Favored Glycine 0 C--N 1.351 1.38 0 N-CA-C 110.686 -0.965 . . . . 0.0 110.686 -165.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.8 t -118.72 -60.72 1.74 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.878 0.871 . . . . 0.0 111.929 -170.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.1 t60 -170.46 60.25 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 120.832 0.348 . . . . 0.0 111.684 -176.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.655 HG21 ' HA ' ' A' ' 31' ' ' THR . 26.1 p -140.48 103.07 4.47 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.261 -0.899 . . . . 0.0 111.778 177.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.6 t -136.8 107.45 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 C-N-CA 124.659 1.184 . . . . 0.0 109.102 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 93.5 m -113.28 110.72 20.84 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.702 -0.624 . . . . 0.0 111.271 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.523 ' HB1' HD12 ' A' ' 80' ' ' LEU . . . -139.12 149.9 45.04 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.934 1.294 . . . . 0.0 108.392 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.607 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 22.1 tt0 -121.53 114.88 21.84 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.139 0.495 . . . . 0.0 111.447 -178.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.449 ' HB2' HD11 ' A' ' 50' ' ' LEU . 72.2 mmm -89.0 142.82 27.31 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.216 1.006 . . . . 0.0 111.205 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 51.9 p -86.58 151.3 23.57 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.059 0.544 . . . . 0.0 109.641 178.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -54.87 -33.49 61.93 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 123.218 0.607 . . . . 0.0 112.465 -174.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -49.12 -46.95 45.71 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 125.231 1.412 . . . . 0.0 111.911 174.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -77.89 -33.99 51.7 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.449 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.2 mp -71.25 -31.79 67.95 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 120.869 0.366 . . . . 0.0 110.448 174.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 48.7 mt -75.54 -29.9 59.56 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.028 0.931 . . . . 0.0 111.52 174.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -65.03 -49.28 70.77 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.3 t -57.6 -42.9 84.14 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.563 0.745 . . . . 0.0 110.805 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -60.75 -46.67 89.54 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.063 0.945 . . . . 0.0 111.349 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -68.94 -32.67 72.45 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.553 0.741 . . . . 0.0 111.71 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -64.06 -34.01 77.05 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.726 0.81 . . . . 0.0 111.295 -177.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 150.61 51.81 0.02 OUTLIER Glycine 0 N--CA 1.478 1.493 0 CA-C-N 116.343 -0.39 . . . . 0.0 112.676 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -154.37 169.28 24.08 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.403 0.681 . . . . 0.0 110.402 -173.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -162.42 142.95 9.99 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.878 0.471 . . . . 0.0 110.629 171.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.2 tp -175.98 -54.99 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.506 1.122 . . . . 0.0 109.812 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 8.1 tmm? -76.7 91.71 3.48 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.913 -177.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.7 p -135.69 137.4 25.6 Favored Pre-proline 0 N--CA 1.487 1.394 0 C-N-CA 124.32 1.048 . . . . 0.0 110.488 178.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -71.02 92.08 0.64 Allowed 'Trans proline' 0 C--N 1.381 2.261 0 C-N-CA 122.809 2.339 . . . . 0.0 112.56 175.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -117.07 87.91 24.74 Favored Pre-proline 0 N--CA 1.482 1.164 0 C-N-CA 124.105 0.962 . . . . 0.0 109.78 176.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -68.06 -27.42 35.97 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.725 2.283 . . . . 0.0 114.073 -172.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -70.31 -34.76 73.09 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.181 0.592 . . . . 0.0 111.69 -177.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -107.01 -56.41 2.2 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.395 0.678 . . . . 0.0 111.006 -177.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 60.1 84.53 0.12 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.909 1.284 . . . . 0.0 111.998 174.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -92.25 114.25 61.66 Favored Pre-proline 0 N--CA 1.482 1.16 0 C-N-CA 122.931 0.492 . . . . 0.0 111.201 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.54 81.96 2.61 Favored 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 122.795 2.33 . . . . 0.0 112.939 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -106.8 30.38 9.51 Favored Glycine 0 N--CA 1.481 1.661 0 CA-C-N 116.085 -0.507 . . . . 0.0 113.16 176.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.8 tt 60.67 104.56 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 125.176 1.39 . . . . 0.0 110.91 -174.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.0 ptpp? -112.83 -171.84 1.94 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 122.972 0.509 . . . . 0.0 110.835 -177.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.39 116.34 3.87 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.345 0.658 . . . . 0.0 111.558 176.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.49 22.31 14.73 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 114.164 0.425 . . . . 0.0 114.164 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -114.45 96.22 5.65 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.199 0.599 . . . . 0.0 110.129 169.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.607 ' HB2' ' HB2' ' A' ' 44' ' ' GLU . 56.2 ttp180 -92.26 85.8 5.54 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 174.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 6.7 m-90 -167.4 119.48 0.91 Allowed 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 124.195 0.998 . . . . 0.0 109.071 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 31.1 p 44.93 33.76 1.08 Allowed 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.651 1.18 . . . . 0.0 113.143 175.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.523 HD12 ' HB1' ' A' ' 43' ' ' ALA . 3.0 tm? -63.28 118.08 7.51 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.161 0.984 . . . . 0.0 110.117 -176.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 41.4 t -53.1 119.22 4.45 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.593 0.757 . . . . 0.0 110.552 175.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.66 -31.59 26.17 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.834 0.853 . . . . 0.0 112.848 -174.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 73.1 m -57.27 -36.89 71.57 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 176.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.423 ' HG2' HD21 ' A' ' 80' ' ' LEU . 11.3 tpp180 -59.83 -53.35 58.94 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.194 0.597 . . . . 0.0 111.83 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.527 ' CD1' HG23 ' A' ' 110' ' ' VAL . 2.8 t-105 -75.26 -51.51 13.11 Favored 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 123.597 0.759 . . . . 0.0 111.007 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.568 ' HB2' HG21 ' A' ' 110' ' ' VAL . 47.0 tp60 -61.65 -42.25 98.64 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.603 0.761 . . . . 0.0 112.928 -172.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -69.86 -30.37 67.82 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 117.706 0.23 . . . . 0.0 111.594 -178.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.99 -34.85 78.41 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 122.92 0.488 . . . . 0.0 110.755 170.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.638 ' HA ' ' HB1' ' A' ' 94' ' ' ALA . 80.6 t80 -72.55 -43.49 63.39 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.998 0.919 . . . . 0.0 111.462 176.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 86' ' ' GLN . 49.8 mt-10 -66.52 -38.27 86.84 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.858 0.863 . . . . 0.0 111.404 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.13 -20.41 62.32 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.751 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 122.94 -20.87 7.57 Favored Glycine 0 C--N 1.357 1.738 0 N-CA-C 115.179 0.831 . . . . 0.0 115.179 170.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -81.76 -79.97 0.16 Allowed 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 117.721 0.761 . . . . 0.0 111.751 -171.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.638 ' HB1' ' HA ' ' A' ' 89' ' ' PHE . . . 65.91 124.51 0.03 OUTLIER Pre-proline 0 N--CA 1.499 1.999 0 C-N-CA 125.022 1.329 . . . . 0.0 114.409 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -77.39 172.08 16.55 Favored 'Trans proline' 0 CA--C 1.567 2.14 0 C-N-CA 122.959 2.439 . . . . 0.0 113.011 172.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.35 108.27 2.16 Favored 'Trans proline' 0 CA--C 1.565 2.058 0 C-N-CA 122.106 1.87 . . . . 0.0 112.324 169.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.6 p -96.65 151.14 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 123.576 0.75 . . . . 0.0 110.633 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.586 HG23 ' HB3' ' A' ' 101' ' ' SER . 19.2 m -75.84 162.75 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 CA-C-O 121.559 0.695 . . . . 0.0 111.637 173.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 96.3 mt -118.9 -9.42 10.1 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.782 0.833 . . . . 0.0 110.631 168.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -87.15 -47.57 8.77 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.95 0.9 . . . . 0.0 110.341 -171.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.586 ' HB3' HG23 ' A' ' 98' ' ' VAL . 42.3 t -85.71 -32.48 21.9 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.969 179.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 19.4 m -59.61 114.6 2.81 Favored 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 122.657 0.383 . . . . 0.0 111.64 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -79.34 168.24 19.78 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.552 0.741 . . . . 0.0 112.864 -173.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -67.96 -25.23 65.34 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.998 0.919 . . . . 0.0 112.146 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 43.7 t -62.4 -32.98 73.89 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 122.664 0.386 . . . . 0.0 111.633 177.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.16 -34.89 70.79 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.707 0.803 . . . . 0.0 112.057 174.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.631 ' HG ' ' HB2' ' A' ' 112' ' ' LEU . 6.9 mp -64.57 -10.26 24.9 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.937 0.895 . . . . 0.0 113.388 -175.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.63 ' HD3' ' HA3' ' A' ' 37' ' ' GLY . 65.0 mtp85 -94.78 -28.5 15.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.494 0.717 . . . . 0.0 111.927 173.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -96.47 -53.81 3.47 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.145 0.578 . . . . 0.0 111.148 -173.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.568 HG21 ' HB2' ' A' ' 86' ' ' GLN . 14.0 p -100.13 -24.06 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 C-N-CA 123.91 0.884 . . . . 0.0 111.567 -178.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 43.4 t 69.53 147.32 0.06 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.102 1.361 . . . . 0.0 112.636 -173.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.631 ' HB2' ' HG ' ' A' ' 107' ' ' LEU . 5.8 tt -61.23 -40.78 95.28 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.168 178.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.17 -38.81 84.33 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.138 0.575 . . . . 0.0 112.127 -172.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -69.12 -33.19 73.07 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.524 0.729 . . . . 0.0 111.036 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.493 HD21 ' HE1' ' A' ' 85' ' ' TRP . 39.9 mt -66.03 -55.82 14.72 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 121.95 0.881 . . . . 0.0 109.916 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.651 ' HB3' ' HA ' ' A' ' 122' ' ' VAL . 13.0 mt-30 -68.55 -24.77 64.67 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 113.896 -1.502 . . . . 0.0 113.146 -173.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.53 -23.36 64.52 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 113.151 0.796 . . . . 0.0 113.151 175.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 11.1 m80 -116.53 -16.56 10.77 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 123.303 0.641 . . . . 0.0 112.57 174.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.03 167.82 18.45 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.659 0.384 . . . . 0.0 110.419 170.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.538 ' HB3' ' HD3' ' A' ' 121' ' ' PRO . 0.2 OUTLIER -67.83 -60.81 4.92 Favored Pre-proline 0 CA--C 1.584 2.286 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -174.223 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.538 ' HD3' ' HB3' ' A' ' 120' ' ' LEU . 40.9 Cg_endo -86.34 86.36 0.9 Allowed 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 122.952 2.435 . . . . 0.0 113.796 -173.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . 0.651 ' HA ' ' HB3' ' A' ' 116' ' ' GLN . 6.5 p -79.92 136.3 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.223 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.792 174.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tt -140.29 136.85 33.69 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.891 0.876 . . . . 0.0 109.551 -173.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -76.97 138.89 39.92 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.056 0.942 . . . . 0.0 112.724 -175.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 22.4 m-70 -129.29 179.41 5.8 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.596 1.158 . . . . 0.0 110.681 175.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -105.47 -166.28 1.2 Allowed 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.955 0.902 . . . . 0.0 111.641 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -67.53 135.72 53.44 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.661 0.784 . . . . 0.0 111.959 -175.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 28.0 p80 -128.82 141.89 51.15 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.836 0.854 . . . . 0.0 110.235 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -169.15 166.11 10.89 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.715 0.806 . . . . 0.0 110.263 -176.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 51.0 t-80 . . . . . 0 N--CA 1.489 1.486 0 C-N-CA 125.089 1.356 . . . . 0.0 111.401 173.144 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.1 mtm . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 120.444 0.164 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.96 -161.92 44.2 Favored Glycine 0 C--N 1.351 1.385 0 CA-C-N 116.432 -0.349 . . . . 0.0 113.557 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -168.69 -179.47 3.81 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.587 0.755 . . . . 0.0 110.95 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -125.56 -155.32 8.98 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.295 172.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -89.11 129.14 35.77 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.507 0.723 . . . . 0.0 109.872 177.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -120.77 -173.07 2.51 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.273 0.629 . . . . 0.0 111.309 -175.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 16.9 t -92.13 35.82 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.802 0 C-N-CA 124.461 1.105 . . . . 0.0 111.36 -170.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -80.2 -14.1 58.71 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 121.393 -0.817 . . . . 0.0 112.819 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.14 70.13 0.46 Allowed Glycine 0 N--CA 1.482 1.71 0 N-CA-C 114.375 0.51 . . . . 0.0 114.375 -171.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -144.88 -168.3 2.89 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.744 0.817 . . . . 0.0 110.713 179.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 t70 70.15 -176.67 0.2 Allowed 'General case' 0 CA--C 1.564 1.504 0 C-N-CA 124.886 1.275 . . . . 0.0 112.073 170.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 89.0 mt -64.1 126.04 26.44 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.748 0.819 . . . . 0.0 112.219 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.9 -153.96 0.41 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 124.198 0.999 . . . . 0.0 110.053 176.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.498 HG11 ' HB ' ' A' ' 21' ' ' THR . 6.4 p -87.74 129.01 39.76 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.416 0 O-C-N 121.88 -0.513 . . . . 0.0 110.566 167.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 48.2 t -123.22 10.06 9.28 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.379 0.672 . . . . 0.0 110.953 170.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 28' ' ' PHE . 42.0 t -69.71 140.07 53.47 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.13 0.572 . . . . 0.0 111.358 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.4 m 62.2 53.54 2.87 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.307 1.043 . . . . 0.0 110.759 -175.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 72.32 159.73 0.16 Allowed Pre-proline 0 N--CA 1.49 1.534 0 C-N-CA 125.41 1.484 . . . . 0.0 113.101 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -49.69 -7.11 0.08 OUTLIER 'Trans proline' 0 C--N 1.382 2.317 0 C-N-CA 123.8 3.0 . . . . 0.0 116.369 167.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 33.6 ttm -74.33 65.41 1.21 Allowed 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 123.886 0.874 . . . . 0.0 110.635 174.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.498 ' HB ' HG11 ' A' ' 14' ' ' VAL . 45.3 p -135.1 155.65 50.36 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.228 1.011 . . . . 0.0 111.224 -173.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -94.02 -104.71 1.8 Allowed Glycine 0 CA--C 1.526 0.739 0 N-CA-C 111.454 -0.658 . . . . 0.0 111.454 172.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 74.4 t90 -153.17 110.1 3.45 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.135 0.574 . . . . 0.0 109.561 177.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -132.78 146.66 52.03 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.924 0.889 . . . . 0.0 110.638 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 -74.83 120.96 21.09 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.504 0.722 . . . . 0.0 110.642 177.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 65.58 -2.52 0.83 Allowed 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 124.329 1.052 . . . . 0.0 113.738 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.83 -22.92 28.34 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 115.522 0.969 . . . . 0.0 115.522 -170.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.565 ' HA ' ' HB2' ' A' ' 16' ' ' CYS . 85.0 t80 -71.86 -51.99 19.62 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.47 0.708 . . . . 0.0 111.445 173.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 69.9 m -95.31 -174.0 3.08 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 123.783 0.833 . . . . 0.0 112.088 -179.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -130.11 126.22 37.03 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.02 0.928 . . . . 0.0 109.575 170.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 50.2 m -86.09 98.0 10.62 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 121.45 0.643 . . . . 0.0 110.004 176.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -94.59 29.4 2.3 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.591 0.756 . . . . 0.0 111.927 -179.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t 63.12 -76.63 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 C-N-CA 124.574 1.15 . . . . 0.0 111.116 -173.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -150.42 -3.34 0.36 Allowed 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 124.226 1.01 . . . . 0.0 111.206 177.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -70.96 -30.93 67.36 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.545 1.138 . . . . 0.0 112.733 -173.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 61.99 98.86 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 124.658 1.183 . . . . 0.0 111.777 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.57 68.23 1.49 Allowed Glycine 0 N--CA 1.473 1.103 0 CA-C-N 116.526 -0.306 . . . . 0.0 112.663 -175.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.8 t -135.09 -167.35 1.98 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.972 0.909 . . . . 0.0 109.833 -176.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 28.9 p-80 -142.78 125.69 16.16 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 121.932 -0.48 . . . . 0.0 110.894 177.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.488 HG22 ' HG2' ' A' ' 103' ' ' GLU . 3.5 t -140.2 135.21 32.16 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.396 1.078 . . . . 0.0 109.452 174.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.725 HG21 ' HB1' ' A' ' 82' ' ' ALA . 40.1 t -120.89 111.27 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 123.189 0.596 . . . . 0.0 110.329 -175.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 82.5 m -105.97 107.54 18.6 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.564 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -142.6 151.31 41.38 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.911 0.884 . . . . 0.0 109.272 -176.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -126.95 115.3 19.05 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 122.458 0.303 . . . . 0.0 110.244 -173.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.459 ' HE1' ' HE3' ' A' ' 85' ' ' TRP . 63.9 mmm -98.91 152.77 19.4 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.217 0.607 . . . . 0.0 111.671 -174.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.659 HG21 ' HB3' ' A' ' 95' ' ' PRO . 6.8 t -89.11 157.48 18.29 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.468 0.707 . . . . 0.0 110.635 175.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 61.2 tt0 -53.57 -32.18 49.8 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.897 0.879 . . . . 0.0 112.419 -177.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -51.4 -44.88 62.32 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.143 0.977 . . . . 0.0 111.456 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -74.31 -47.42 34.77 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 177.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.411 ' HG ' ' HA ' ' A' ' 73' ' ' LYS . 2.4 mm? -65.28 -32.88 74.76 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.294 0.497 . . . . 0.0 111.543 -174.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.6 mt -76.63 -31.85 57.65 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.118 0.567 . . . . 0.0 112.139 173.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -57.62 -48.77 78.53 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 123.053 0.541 . . . . 0.0 110.666 171.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 37.4 t -69.73 -43.64 71.92 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.601 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -74.38 -33.54 63.08 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -173.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -63.86 -33.32 75.42 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.994 0.518 . . . . 0.0 111.488 -178.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -157.69 90.4 1.08 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.58 0.752 . . . . 0.0 109.411 177.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 148.15 -101.49 0.23 Allowed Glycine 0 N--CA 1.479 1.539 0 CA-C-N 116.579 -0.282 . . . . 0.0 113.711 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -113.67 125.9 54.65 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.88 0.872 . . . . 0.0 110.765 -174.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -59.81 -66.21 0.55 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 122.935 0.494 . . . . 0.0 111.7 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.547 HD11 ' HD3' ' A' ' 84' ' ' ARG . 69.0 mt 72.47 -48.36 0.68 Allowed 'General case' 0 N--CA 1.5 2.062 0 C-N-CA 125.783 1.633 . . . . 0.0 114.474 175.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 82.6 mtp -56.24 -66.59 0.41 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.742 1.217 . . . . 0.0 113.448 -161.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.1 m -146.92 90.13 5.5 Favored Pre-proline 0 N--CA 1.482 1.171 0 C-N-CA 122.668 0.387 . . . . 0.0 110.96 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -85.71 -174.52 1.62 Allowed 'Trans proline' 0 CA--C 1.556 1.587 0 C-N-CA 123.208 2.605 . . . . 0.0 111.466 163.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.487 ' HD2' ' HA ' ' A' ' 67' ' ' PHE . 12.7 ttp180 -158.14 107.26 1.72 Allowed Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 122.226 0.21 . . . . 0.0 111.185 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -78.09 -37.32 0.83 Allowed 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 122.706 2.271 . . . . 0.0 113.064 175.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -129.46 -77.55 0.55 Allowed 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.837 0.855 . . . . 0.0 109.505 -176.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.487 ' HA ' ' HD2' ' A' ' 64' ' ' ARG . 79.2 t80 -156.66 -70.46 0.1 Allowed 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.521 0.728 . . . . 0.0 110.016 175.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -86.19 76.96 9.66 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.111 0.565 . . . . 0.0 110.898 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -171.88 106.29 0.37 Allowed Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 123.747 0.819 . . . . 0.0 110.096 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -91.36 -160.22 0.09 OUTLIER 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 123.098 2.532 . . . . 0.0 112.447 171.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -117.4 -103.09 2.23 Favored Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.244 -0.342 . . . . 0.0 112.244 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -159.35 118.49 2.93 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.833 0.853 . . . . 0.0 110.245 -176.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.411 ' HA ' ' HG ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -130.0 -161.35 1.11 Allowed 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.078 0.551 . . . . 0.0 111.06 -176.165 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.56 118.24 6.78 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.643 0.777 . . . . 0.0 113.036 -174.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 79.23 35.99 28.6 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-N 115.085 -0.961 . . . . 0.0 113.347 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -118.31 98.9 6.52 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.506 0.723 . . . . 0.0 111.216 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -76.74 87.39 3.36 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 166.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -175.39 127.17 0.26 Allowed 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.944 -173.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 39.4 t 59.12 16.09 4.56 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.859 1.264 . . . . 0.0 113.776 171.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.564 HD13 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -75.05 108.83 8.04 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -175.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 62.2 m -65.1 135.31 55.37 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.449 0.7 . . . . 0.0 111.14 178.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.725 ' HB1' HG21 ' A' ' 41' ' ' VAL . . . -51.32 -49.37 61.48 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.187 0.995 . . . . 0.0 113.31 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.6 m -57.3 -29.52 63.98 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.931 0.892 . . . . 0.0 112.943 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.547 ' HD3' HD11 ' A' ' 60' ' ' LEU . 0.8 OUTLIER -70.06 -51.55 31.03 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.431 0.692 . . . . 0.0 110.767 -177.174 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.459 ' HE3' ' HE1' ' A' ' 45' ' ' MET . 3.8 t-105 -62.93 -41.32 99.45 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 123.665 0.786 . . . . 0.0 110.802 172.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -41.77 86.18 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.374 1.069 . . . . 0.0 111.997 -176.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -62.43 -37.33 85.43 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.722 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.7 -39.01 89.94 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.285 0.634 . . . . 0.0 111.65 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.588 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 75.4 t80 -68.23 -51.82 41.05 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.1 0.56 . . . . 0.0 111.23 175.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.86 -19.15 65.68 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.438 0.695 . . . . 0.0 112.42 -174.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.85 -26.97 21.35 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 123.153 0.581 . . . . 0.0 111.529 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 129.18 -21.76 5.15 Favored Glycine 0 N--CA 1.482 1.751 0 N-CA-C 115.697 1.039 . . . . 0.0 115.697 171.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -72.42 -67.89 0.51 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 118.17 0.985 . . . . 0.0 111.456 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.588 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 54.87 81.07 0.27 Allowed Pre-proline 0 CA--C 1.564 1.496 0 C-N-CA 124.641 1.176 . . . . 0.0 113.139 -177.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.659 ' HB3' HG21 ' A' ' 46' ' ' THR . 93.9 Cg_exo -53.4 163.95 2.26 Favored 'Trans proline' 0 N--CA 1.504 2.105 0 C-N-CA 124.352 3.368 . . . . 0.0 115.804 173.418 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -63.86 103.53 0.42 Allowed 'Trans proline' 0 C--N 1.384 2.429 0 C-N-CA 122.927 2.418 . . . . 0.0 112.667 174.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.6 p -94.26 138.01 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 123.299 0.64 . . . . 0.0 109.949 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 7.5 p -79.13 89.11 1.3 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-O 121.852 0.834 . . . . 0.0 112.862 -171.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -60.65 -34.37 74.2 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 124.628 1.171 . . . . 0.0 113.544 -177.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -71.33 -12.24 61.33 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 179.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 50.4 m -128.54 -7.11 5.18 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.248 0.619 . . . . 0.0 112.576 -176.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 99.5 m -72.62 120.96 18.97 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 122.552 0.341 . . . . 0.0 110.156 175.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.544 ' HG3' ' H ' ' A' ' 105' ' ' SER . 13.8 tp10 -64.55 149.71 48.21 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 123.131 0.572 . . . . 0.0 111.587 178.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -68.0 -34.18 76.02 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.369 0.667 . . . . 0.0 110.865 177.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.544 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 84.9 p -61.96 -23.86 66.64 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 122.902 0.481 . . . . 0.0 111.987 175.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.02 -36.06 74.33 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.044 0.538 . . . . 0.0 112.356 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.1 mp -55.73 -13.7 1.85 Allowed 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 124.978 1.311 . . . . 0.0 113.431 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -61.95 -34.48 76.2 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.422 1.089 . . . . 0.0 112.376 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -109.76 -21.82 12.21 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.578 1.151 . . . . 0.0 110.247 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.447 HG11 HD23 ' A' ' 115' ' ' LEU . 48.7 t -109.67 -51.67 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 CA-C-N 114.048 -1.433 . . . . 0.0 112.715 -159.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 26.6 m 71.26 140.86 0.05 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 125.746 1.618 . . . . 0.0 112.79 -168.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.42 -39.8 92.1 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.274 1.03 . . . . 0.0 113.372 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.6 -32.5 70.45 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.86 0.464 . . . . 0.0 111.73 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.89 -36.95 85.01 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 124.382 1.073 . . . . 0.0 111.185 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.447 HD23 HG11 ' A' ' 110' ' ' VAL . 71.5 mt -75.0 -51.58 13.24 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.637 1.175 . . . . 0.0 110.874 -177.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -70.78 -23.06 62.33 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 114.4 -1.273 . . . . 0.0 112.321 -175.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -50.07 -28.68 7.5 Favored 'General case' 0 CA--C 1.562 1.412 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 171.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -128.73 22.63 5.85 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.507 0.723 . . . . 0.0 112.261 175.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -144.23 -164.37 1.88 Allowed 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.239 0.615 . . . . 0.0 110.577 174.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.45 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 4.3 mm? -72.07 134.18 83.28 Favored Pre-proline 0 CA--C 1.56 1.331 0 O-C-N 122.136 -0.352 . . . . 0.0 111.64 177.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 120' ' ' LEU . 36.8 Cg_endo -88.6 164.69 6.42 Favored 'Trans proline' 0 C--N 1.375 1.922 0 C-N-CA 123.348 2.698 . . . . 0.0 113.81 -175.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 4.1 p -79.84 109.84 14.83 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 CA-C-O 121.896 0.855 . . . . 0.0 112.167 -175.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.0 tt -67.03 152.73 45.25 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.894 0.878 . . . . 0.0 108.817 168.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.89 142.14 51.11 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.441 -0.787 . . . . 0.0 111.357 178.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -101.42 -41.42 6.66 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.485 0.714 . . . . 0.0 111.269 175.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 66.1 m-70 -114.4 90.94 3.46 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 122.779 0.431 . . . . 0.0 111.186 177.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -80.48 -15.8 55.85 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 120.899 0.38 . . . . 0.0 110.54 172.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -110.83 167.71 10.03 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.148 0.979 . . . . 0.0 111.316 176.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -151.26 168.2 25.46 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.531 0.733 . . . . 0.0 111.836 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 . . . . . 0 N--CA 1.492 1.634 0 C-N-CA 123.622 0.769 . . . . 0.0 112.498 173.988 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.1 mtp . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 120.681 0.277 . . . . 0.0 111.563 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 66.13 46.66 78.58 Favored Glycine 0 C--N 1.353 1.504 0 CA-C-N 116.044 -0.525 . . . . 0.0 114.208 175.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.9 tp60 -123.26 98.97 6.11 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.597 0.759 . . . . 0.0 110.511 179.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.21 -174.69 42.14 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 115.97 -0.559 . . . . 0.0 113.028 174.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -90.38 140.48 29.67 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.101 0.56 . . . . 0.0 111.117 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -110.33 154.84 22.93 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.011 0.924 . . . . 0.0 110.16 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 m -66.45 -26.25 37.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-O 121.769 0.795 . . . . 0.0 110.804 177.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 80.3 mt -73.72 -19.35 60.83 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-N 114.28 -1.327 . . . . 0.0 112.02 -177.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.97 -14.14 80.43 Favored Glycine 0 CA--C 1.541 1.703 0 CA-C-N 115.553 -0.749 . . . . 0.0 114.47 177.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -153.04 127.44 9.26 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 117.661 0.73 . . . . 0.0 111.378 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -165.79 177.58 7.12 Favored 'General case' 0 CA--C 1.565 1.555 0 C-N-CA 123.649 0.779 . . . . 0.0 110.381 -177.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.7 mp -56.42 130.06 43.25 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 124.066 0.946 . . . . 0.0 111.945 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.99 -177.89 6.15 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.161 0.984 . . . . 0.0 111.753 -178.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.5 p -68.17 134.73 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.337 0 CA-C-O 121.327 0.584 . . . . 0.0 111.975 -179.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.531 ' SG ' ' HA3' ' A' ' 27' ' ' GLY . 78.0 m -84.75 -55.99 3.82 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.554 0.742 . . . . 0.0 110.333 176.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.466 ' H ' ' HB2' ' A' ' 28' ' ' PHE . 53.7 t 75.83 -43.34 0.48 Allowed 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 170.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 52.3 t -61.5 -42.92 99.53 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.556 0.742 . . . . 0.0 112.867 -173.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -108.88 138.69 20.4 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 123.106 0.562 . . . . 0.0 110.48 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.39 -53.19 2.54 Favored 'Trans proline' 0 C--N 1.381 2.238 0 C-N-CA 122.752 2.301 . . . . 0.0 112.661 174.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 57.0 mtt -83.22 88.43 6.92 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.44 0.696 . . . . 0.0 110.519 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 37.6 p -129.98 77.8 1.81 Allowed 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.758 0.823 . . . . 0.0 109.88 178.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.45 -42.4 3.15 Favored Glycine 0 CA--C 1.535 1.294 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.693 -176.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 15.0 t90 79.76 -42.85 0.26 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 125.894 1.678 . . . . 0.0 112.245 174.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -84.52 52.59 2.41 Favored 'General case' 0 CA--C 1.572 1.811 0 C-N-CA 124.436 1.094 . . . . 0.0 110.248 174.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.55 ' HG3' ' SG ' ' A' ' 29' ' ' CYS . 9.3 ttp180 52.97 49.73 19.54 Favored 'General case' 0 CA--C 1.569 1.682 0 C-N-CA 125.502 1.521 . . . . 0.0 113.191 177.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -77.32 -47.94 18.69 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.205 0.526 . . . . 0.0 110.384 172.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.531 ' HA3' ' SG ' ' A' ' 15' ' ' CYS . . . -137.74 -71.52 0.05 OUTLIER Glycine 0 C--N 1.342 0.915 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.595 175.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.466 ' HB2' ' H ' ' A' ' 16' ' ' CYS . 87.9 t80 -101.71 137.16 40.39 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.599 0.76 . . . . 0.0 110.074 177.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.55 ' SG ' ' HG3' ' A' ' 25' ' ' ARG . 26.2 p -159.03 155.11 26.86 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.63 0.772 . . . . 0.0 110.713 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -84.93 71.16 10.94 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.949 0.5 . . . . 0.0 110.455 177.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.415 HG22 ' H ' ' A' ' 32' ' ' ASP . 4.8 t -174.85 -65.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.545 1.138 . . . . 0.0 110.014 174.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.415 ' H ' HG22 ' A' ' 31' ' ' THR . 1.9 m-20 -106.54 120.31 41.6 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.867 0.867 . . . . 0.0 110.007 -177.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 34.0 m -75.25 -37.7 39.74 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.148 0 C-N-CA 123.26 0.624 . . . . 0.0 111.237 177.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -179.07 -57.19 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.716 1.206 . . . . 0.0 109.702 -178.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -67.59 155.51 38.97 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.894 0.878 . . . . 0.0 111.725 177.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -59.22 121.91 12.54 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 124.089 0.956 . . . . 0.0 112.3 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -132.3 -93.41 0.56 Allowed Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 175.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 59.6 m 62.04 169.45 0.12 Allowed 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 125.124 1.37 . . . . 0.0 114.035 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.9 m80 58.82 32.22 22.01 Favored 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 124.064 0.945 . . . . 0.0 112.784 -179.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.401 ' O ' ' HB3' ' A' ' 105' ' ' SER . 65.8 p -98.99 116.13 30.51 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.883 1.273 . . . . 0.0 111.938 -176.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.497 HG13 ' HB1' ' A' ' 82' ' ' ALA . 46.5 t -137.89 117.96 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.746 -0.596 . . . . 0.0 111.126 176.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 57.8 m -116.74 108.22 15.62 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 168.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.654 ' HB2' HD13 ' A' ' 80' ' ' LEU . . . -137.69 148.23 45.52 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -176.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.51 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 28.0 tt0 -115.49 116.56 28.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.843 0.354 . . . . 0.0 111.77 -171.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 52.5 mmm -103.5 123.41 46.85 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.272 175.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 79.3 p -81.39 167.04 19.87 Favored 'General case' 0 C--O 1.246 0.895 0 C-N-CA 123.13 0.572 . . . . 0.0 110.549 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -58.03 -29.57 65.45 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.382 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -49.64 -56.13 11.17 Favored 'General case' 0 CA--C 1.567 1.622 0 C-N-CA 124.826 1.25 . . . . 0.0 112.377 177.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -70.55 -38.81 74.21 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 176.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.9 mp -66.34 -25.09 66.66 Favored 'General case' 0 CA--C 1.566 1.569 0 O-C-N 122.129 -0.357 . . . . 0.0 111.481 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 39.3 mt -75.13 -35.44 61.68 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.227 1.011 . . . . 0.0 110.555 172.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.442 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 89.6 t80 -60.64 -51.34 69.81 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.95 0.5 . . . . 0.0 110.286 171.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.9 m -58.99 -33.04 70.24 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 124.193 0.997 . . . . 0.0 111.646 177.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.7 ttt180 -61.82 -52.22 65.05 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.758 175.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -74.84 -13.04 60.52 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.442 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 5.2 mmp_? -77.46 -13.4 59.93 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 172.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 139.63 7.69 1.01 Allowed Glycine 0 N--CA 1.482 1.739 0 N-CA-C 115.068 0.787 . . . . 0.0 115.068 174.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -117.86 -171.65 2.1 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-N 117.795 0.798 . . . . 0.0 111.614 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -157.57 86.41 0.93 Allowed 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.983 0.913 . . . . 0.0 109.759 171.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.34 -26.94 60.45 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.635 0.774 . . . . 0.0 111.524 -174.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.51 ' SD ' ' N ' ' A' ' 61' ' ' MET . 0.2 OUTLIER -75.49 -31.27 60.13 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.534 0.734 . . . . 0.0 110.158 173.722 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.2 m 62.86 84.39 0.19 Allowed Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 124.743 1.217 . . . . 0.0 111.647 177.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -85.55 45.96 1.65 Allowed 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 123.577 2.851 . . . . 0.0 110.381 172.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.0 ttm180 -138.7 133.0 16.5 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 114.278 -1.328 . . . . 0.0 109.98 -161.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.83 -23.11 30.85 Favored 'Trans proline' 0 C--N 1.372 1.797 0 C-N-CA 122.662 2.241 . . . . 0.0 113.123 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -75.09 156.38 36.12 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.255 0.622 . . . . 0.0 111.573 179.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -89.57 51.72 2.17 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.766 0.826 . . . . 0.0 112.139 -168.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -92.72 -0.59 57.25 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.523 0.729 . . . . 0.0 112.355 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -70.84 132.29 87.0 Favored Pre-proline 0 CA--C 1.564 1.509 0 C-N-CA 123.495 0.718 . . . . 0.0 112.31 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -79.92 154.54 22.93 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.483 2.122 . . . . 0.0 112.751 172.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.72 -36.65 93.6 Favored Glycine 0 CA--C 1.54 1.599 0 N-CA-C 114.386 0.514 . . . . 0.0 114.386 -178.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -74.56 123.34 24.61 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.303 0.641 . . . . 0.0 110.662 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -99.0 173.69 6.71 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.8 0.84 . . . . 0.0 110.602 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.7 105.56 4.34 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.211 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 108.27 27.66 4.95 Favored Glycine 0 CA--C 1.535 1.333 0 CA-C-N 115.814 -0.63 . . . . 0.0 113.581 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -105.47 111.18 23.79 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.186 0.594 . . . . 0.0 111.237 171.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.51 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 11.9 ptt85 -83.1 88.05 6.9 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 165.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.4 t-105 -172.46 121.1 0.42 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.289 -173.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 43.4 t 54.56 19.24 2.32 Favored 'General case' 0 N--CA 1.499 1.978 0 C-N-CA 124.702 1.201 . . . . 0.0 113.708 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.654 HD13 ' HB2' ' A' ' 43' ' ' ALA . 3.1 tm? -71.4 124.11 23.85 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.36 0.664 . . . . 0.0 109.772 -175.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 52.0 t -62.14 110.5 1.62 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.177 0.591 . . . . 0.0 110.162 174.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.497 ' HB1' HG13 ' A' ' 41' ' ' VAL . . . -57.22 -26.7 61.13 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 113.885 1.069 . . . . 0.0 113.885 -171.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 78.6 p -68.64 -30.47 69.19 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.132 0.573 . . . . 0.0 112.228 176.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -72.85 -31.36 64.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.576 0.75 . . . . 0.0 111.027 175.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.532 ' HD1' HG11 ' A' ' 110' ' ' VAL . 8.8 t-105 -67.29 -53.97 24.99 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.259 0.624 . . . . 0.0 110.114 171.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.413 HE21 ' HG3' ' A' ' 90' ' ' GLU . 18.2 tp60 -56.88 -34.97 68.39 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.865 0.866 . . . . 0.0 112.263 177.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -52.41 -39.02 60.44 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.674 0.79 . . . . 0.0 111.826 175.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.06 -36.31 81.75 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.443 0.697 . . . . 0.0 112.727 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -67.42 -46.46 73.1 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 120.913 0.387 . . . . 0.0 110.391 173.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.413 ' HG3' HE21 ' A' ' 86' ' ' GLN . 42.1 mt-10 -66.2 -19.62 65.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.834 0.854 . . . . 0.0 111.827 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.08 -25.77 31.73 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.208 1.003 . . . . 0.0 111.708 171.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 111.17 -12.88 28.8 Favored Glycine 0 CA--C 1.537 1.465 0 CA-C-N 116.235 -0.439 . . . . 0.0 114.052 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 58.8 mtp -89.17 -81.61 0.27 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.725 0.81 . . . . 0.0 111.659 -174.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 59.86 99.5 0.04 OUTLIER Pre-proline 0 CA--C 1.564 1.505 0 C-N-CA 125.184 1.394 . . . . 0.0 114.226 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -57.18 166.47 4.26 Favored 'Trans proline' 0 CA--C 1.567 2.172 0 C-N-CA 124.098 3.199 . . . . 0.0 114.655 171.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.58 129.27 20.81 Favored 'Trans proline' 0 CA--C 1.567 2.144 0 C-N-CA 122.168 1.912 . . . . 0.0 112.996 171.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.8 p -116.61 151.39 18.42 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.158 0 C-N-CA 123.945 0.898 . . . . 0.0 111.096 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.6 m -88.33 97.61 6.94 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 124.262 1.025 . . . . 0.0 113.5 -171.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 22.8 mt -59.97 -24.33 64.33 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.134 -0.979 . . . . 0.0 112.305 172.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -67.81 -32.38 72.89 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 124.144 0.977 . . . . 0.0 112.738 178.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.8 t -115.4 -45.69 2.91 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -174.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.1 m -48.12 112.75 0.62 Allowed 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 123.571 0.748 . . . . 0.0 112.398 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -83.5 175.42 9.81 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -169.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.622 ' HA ' HD11 ' A' ' 107' ' ' LEU . 14.7 mmmm -67.76 -21.09 65.28 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 124.043 0.937 . . . . 0.0 113.197 -175.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.401 ' HB3' ' O ' ' A' ' 40' ' ' THR . 31.3 t -68.54 -29.72 68.36 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 176.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.2 -31.19 70.95 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.05 0.54 . . . . 0.0 112.453 176.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.622 HD11 ' HA ' ' A' ' 104' ' ' LYS . 8.1 mp -61.38 -28.03 68.95 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 124.019 0.928 . . . . 0.0 111.935 176.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -74.5 -5.78 44.66 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.889 0.876 . . . . 0.0 112.624 -177.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -120.92 -45.67 2.37 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.031 0.932 . . . . 0.0 110.721 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.532 HG11 ' HD1' ' A' ' 85' ' ' TRP . 0.6 OUTLIER -103.6 -35.38 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 C-N-CA 122.917 0.487 . . . . 0.0 111.9 -172.777 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.3 t 77.05 134.68 0.06 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.616 1.567 . . . . 0.0 110.849 -166.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 tt -44.93 -28.16 0.63 Allowed 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 124.734 1.214 . . . . 0.0 113.827 -177.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.73 -37.26 70.74 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.613 0.765 . . . . 0.0 113.0 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -72.85 -40.98 65.25 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 120.891 0.377 . . . . 0.0 110.813 177.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.506 HD21 ' HE1' ' A' ' 85' ' ' TRP . 67.7 mt -57.6 -46.46 84.03 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.601 0.76 . . . . 0.0 111.74 177.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -76.06 -34.35 59.59 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.699 0.8 . . . . 0.0 112.409 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -57.72 -28.05 63.52 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.174 0.589 . . . . 0.0 112.435 173.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -126.48 26.62 6.31 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.789 0.836 . . . . 0.0 111.938 -177.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.53 157.2 34.26 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.055 172.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.37 146.64 86.75 Favored Pre-proline 0 CA--C 1.559 1.3 0 C-N-CA 122.691 0.396 . . . . 0.0 111.198 173.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -60.6 117.07 3.8 Favored 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 123.353 2.702 . . . . 0.0 112.593 -176.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 93.8 t 65.85 107.53 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 C-N-CA 124.613 1.165 . . . . 0.0 111.695 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 46.3 tp -72.07 -55.65 6.98 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.058 0.543 . . . . 0.0 110.748 177.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.3 144.25 51.16 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.128 0.971 . . . . 0.0 110.337 -178.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 11.1 p80 -72.69 91.19 1.44 Allowed 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 121.504 0.668 . . . . 0.0 110.618 178.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -68.35 138.16 55.17 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.432 -179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 7.5 p80 -151.96 134.84 15.62 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.702 1.201 . . . . 0.0 109.294 -170.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 17.7 t60 58.76 38.92 24.73 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.653 0.781 . . . . 0.0 110.559 -177.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 69.76 5.42 5.21 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 125.478 1.511 . . . . 0.0 113.458 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 6.0 p-80 . . . . . 0 CA--C 1.574 1.881 0 C-N-CA 124.099 0.959 . . . . 0.0 111.01 176.348 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.1 mmt . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.598 0.237 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.79 -95.2 2.25 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 116.257 -0.429 . . . . 0.0 112.785 178.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.605 ' HB3' ' HG3' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -70.35 153.91 42.49 Favored 'General case' 0 CA--C 1.565 1.541 0 C-N-CA 124.1 0.96 . . . . 0.0 110.95 -179.283 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.04 -145.81 0.53 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 115.457 0.943 . . . . 0.0 115.457 -173.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -147.9 152.28 37.3 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 122.033 -0.687 . . . . 0.0 111.91 -176.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -109.9 -172.7 2.09 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.669 0.788 . . . . 0.0 111.523 -176.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.6 m -74.55 -6.48 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 C-N-CA 123.716 0.806 . . . . 0.0 112.529 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.5 mt -67.84 -22.14 65.15 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.195 1.398 . . . . 0.0 113.411 -167.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 88.9 -60.98 3.8 Favored Glycine 0 C--N 1.345 1.047 0 N-CA-C 111.652 -0.579 . . . . 0.0 111.652 -176.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -151.76 140.12 20.46 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.995 0.918 . . . . 0.0 109.954 175.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -144.1 163.63 32.99 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.219 0.608 . . . . 0.0 110.397 -172.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.1 tt -153.95 86.93 1.19 Allowed 'General case' 0 CA--C 1.562 1.411 0 CA-C-O 120.849 0.357 . . . . 0.0 110.396 -173.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -97.39 86.63 3.92 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 123.9 0.88 . . . . 0.0 111.089 176.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.557 HG21 ' HB3' ' A' ' 38' ' ' SER . 14.2 p -106.4 157.93 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 C-N-CA 123.668 0.787 . . . . 0.0 112.406 -173.264 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.2 m -132.89 -51.44 0.9 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.112 0.565 . . . . 0.0 109.509 167.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.9 t 56.07 -172.4 0.07 Allowed 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 124.137 0.975 . . . . 0.0 113.238 175.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 49.9 t 73.99 -63.41 0.43 Allowed 'General case' 0 N--CA 1.499 2.015 0 C-N-CA 125.203 1.401 . . . . 0.0 112.647 175.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.81 145.08 86.39 Favored Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.368 0.667 . . . . 0.0 111.191 173.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -53.17 109.12 0.32 Allowed 'Trans proline' 0 C--N 1.383 2.357 0 C-N-CA 123.179 2.586 . . . . 0.0 114.16 178.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 52.0 ttm 58.79 85.31 0.1 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 125.473 1.509 . . . . 0.0 112.418 178.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.0 t -155.1 150.65 27.41 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.495 0.718 . . . . 0.0 110.917 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.89 148.46 15.26 Favored Glycine 0 C--N 1.349 1.282 0 N-CA-C 111.899 -0.48 . . . . 0.0 111.899 -169.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -63.69 112.62 2.92 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.613 0.72 . . . . 0.0 112.038 -178.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -70.0 -12.48 61.64 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 125.185 1.394 . . . . 0.0 112.296 -176.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.605 ' HG3' ' HB3' ' A' ' 3' ' ' GLN . 0.1 OUTLIER -77.34 -60.69 2.26 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 124.164 0.986 . . . . 0.0 110.782 178.472 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -112.79 -32.07 6.53 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.701 0.8 . . . . 0.0 112.624 -170.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.58 -85.09 1.09 Allowed Glycine 0 CA--C 1.528 0.89 0 N-CA-C 114.498 0.559 . . . . 0.0 114.498 -174.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -62.65 -54.95 31.83 Favored 'General case' 0 CA--C 1.56 1.345 0 C-N-CA 123.406 0.683 . . . . 0.0 111.279 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 66.5 m 61.25 -173.85 0.13 Allowed 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 172.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -91.91 65.36 4.88 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.68 165.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 37.8 m -85.16 79.72 9.47 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.557 176.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -94.35 -101.14 0.15 Allowed 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.675 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 14.0 p -101.79 5.91 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.351 0 C-N-CA 123.416 0.686 . . . . 0.0 110.757 -174.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -109.84 -69.15 0.88 Allowed 'General case' 0 CA--C 1.555 1.165 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -174.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -78.18 178.48 7.56 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -163.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -109.07 17.17 21.95 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 124.505 1.122 . . . . 0.0 112.241 176.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -77.45 -149.67 3.71 Favored Glycine 0 N--CA 1.48 1.571 0 N-CA-C 112.621 -0.191 . . . . 0.0 112.621 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.557 ' HB3' HG21 ' A' ' 14' ' ' VAL . 59.0 p -72.64 101.37 3.02 Favored 'General case' 0 N--CA 1.486 1.327 0 O-C-N 122.242 -0.564 . . . . 0.0 111.649 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.508 ' HB3' ' HB3' ' A' ' 105' ' ' SER . 94.2 m-70 -75.73 151.39 37.63 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.057 174.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.9 t -123.9 131.63 53.61 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.403 0.681 . . . . 0.0 111.076 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.5 t -129.85 101.4 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 123.65 0.78 . . . . 0.0 109.311 176.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 75.5 m -96.96 105.68 17.87 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.641 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -138.58 137.31 36.87 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.82 0.848 . . . . 0.0 108.954 -177.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.482 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 14.4 tt0 -117.78 108.83 15.84 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.124 0.487 . . . . 0.0 110.977 -168.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.497 ' HB2' HD11 ' A' ' 50' ' ' LEU . 59.3 mmm -91.55 132.6 36.18 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.817 0.847 . . . . 0.0 109.359 -179.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.653 HG21 ' HB3' ' A' ' 95' ' ' PRO . 8.0 t -80.12 155.29 27.56 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 175.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.454 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 37.1 tt0 -51.83 -31.23 26.66 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 118.902 -0.571 . . . . 0.0 112.291 -174.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -49.86 -43.79 49.3 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.802 0.841 . . . . 0.0 112.427 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -71.57 -38.21 70.96 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.593 0.357 . . . . 0.0 111.804 175.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.0 mp -71.04 -21.54 62.25 Favored 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 122.491 0.317 . . . . 0.0 111.742 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 47' ' ' GLU . 90.4 mt -72.72 -31.61 65.11 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 124.177 0.991 . . . . 0.0 109.565 169.734 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -74.86 -31.42 61.63 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 123.49 0.716 . . . . 0.0 111.465 168.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.9 m -70.11 -36.68 75.03 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.387 0.675 . . . . 0.0 111.781 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -71.69 -32.97 68.41 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 120.939 0.4 . . . . 0.0 110.51 172.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -71.03 -30.19 66.32 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.263 1.025 . . . . 0.0 111.067 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -80.18 -55.33 5.0 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.45 0.7 . . . . 0.0 110.49 174.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -120.15 -88.04 1.06 Allowed Glycine 0 C--N 1.351 1.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 112.745 -177.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -153.27 156.83 39.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.576 0.751 . . . . 0.0 109.961 -174.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -57.89 151.81 17.33 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.742 0.817 . . . . 0.0 111.978 177.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 42.1 tp -138.86 -37.85 0.52 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.239 0.616 . . . . 0.0 111.085 178.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.11 -38.48 56.85 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -175.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 52.6 m 58.95 92.25 0.07 OUTLIER Pre-proline 0 N--CA 1.489 1.509 0 C-N-CA 124.224 1.01 . . . . 0.0 111.475 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -71.5 58.87 2.52 Favored 'Trans proline' 0 CA--C 1.569 2.268 0 C-N-CA 123.425 2.75 . . . . 0.0 113.567 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.432 ' HB3' ' HD2' ' A' ' 65' ' ' PRO . 44.1 mtm180 -139.69 167.2 19.42 Favored Pre-proline 0 CA--C 1.563 1.463 0 C-N-CA 125.146 1.379 . . . . 0.0 109.835 -178.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.432 ' HD2' ' HB3' ' A' ' 64' ' ' ARG . 59.6 Cg_endo -68.87 -1.83 8.43 Favored 'Trans proline' 0 C--N 1.389 2.683 0 C-N-CA 122.682 2.255 . . . . 0.0 113.386 175.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -64.41 97.14 0.18 Allowed 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.736 0.815 . . . . 0.0 111.584 172.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -110.5 75.74 0.94 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 168.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -102.2 21.78 14.37 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.454 -178.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 59.94 82.32 0.23 Allowed Pre-proline 0 CA--C 1.56 1.338 0 C-N-CA 124.97 1.308 . . . . 0.0 111.039 -172.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.59 -17.77 20.4 Favored 'Trans proline' 0 C--N 1.377 2.04 0 C-N-CA 122.484 2.123 . . . . 0.0 112.817 177.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 78.55 93.56 0.29 Allowed Glycine 0 C--N 1.351 1.366 0 CA-C-O 119.65 -0.528 . . . . 0.0 112.05 -178.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.1 tp 64.91 108.85 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.362 1.065 . . . . 0.0 111.926 -175.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -136.62 -172.07 3.07 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.336 0.654 . . . . 0.0 111.359 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.12 126.11 28.14 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.422 0.689 . . . . 0.0 111.89 -176.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 77.01 28.59 58.38 Favored Glycine 0 C--N 1.349 1.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 113.971 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -131.51 102.94 6.14 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 123.601 0.761 . . . . 0.0 110.905 178.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.482 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 11.5 ptt180 -85.57 88.88 7.58 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.881 0.848 . . . . 0.0 111.905 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -160.05 119.73 2.86 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.144 0.977 . . . . 0.0 109.353 -177.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 85.9 m 57.98 20.65 6.97 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.157 0.983 . . . . 0.0 113.179 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.641 HD13 ' HB3' ' A' ' 43' ' ' ALA . 3.5 tm? -68.02 115.97 8.12 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 48.4 m -63.32 114.79 4.04 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 123.649 0.593 . . . . 0.0 109.434 177.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.553 ' HB2' HG11 ' A' ' 110' ' ' VAL . . . -51.83 -35.51 44.75 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.822 0.849 . . . . 0.0 112.695 -176.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.7 m -57.55 -34.95 69.69 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.855 0.862 . . . . 0.0 112.688 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -74.69 -29.5 61.24 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 177.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -67.83 -51.74 44.93 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 169.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.717 ' HB2' HG12 ' A' ' 110' ' ' VAL . 13.3 tp60 -49.9 -35.6 24.25 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.891 0.876 . . . . 0.0 112.79 171.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -56.02 -44.01 78.32 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.934 0.894 . . . . 0.0 111.974 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.72 83.57 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.917 0.887 . . . . 0.0 113.095 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.37 -47.08 87.5 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.313 0.577 . . . . 0.0 110.69 173.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -69.49 -28.39 66.02 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.123 0.969 . . . . 0.0 112.114 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.7 -25.79 49.66 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.279 0.632 . . . . 0.0 111.308 174.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.76 29.82 25.43 Favored Glycine 0 CA--C 1.537 1.444 0 CA-C-N 116.101 -0.499 . . . . 0.0 113.822 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 23.1 ptm -139.6 25.26 2.4 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.209 0.604 . . . . 0.0 111.83 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -40.13 112.6 0.85 Allowed Pre-proline 0 CA--C 1.572 1.802 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 177.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.653 ' HB3' HG21 ' A' ' 46' ' ' THR . 54.3 Cg_exo -60.48 161.61 20.08 Favored 'Trans proline' 0 C--N 1.382 2.296 0 C-N-CA 123.745 2.963 . . . . 0.0 114.157 168.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -73.83 115.1 4.21 Favored 'Trans proline' 0 C--N 1.374 1.9 0 C-N-CA 122.138 1.892 . . . . 0.0 111.237 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 9.0 p -97.17 164.55 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-O 121.394 0.616 . . . . 0.0 109.846 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p -107.86 96.9 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.325 0 C-N-CA 123.882 0.873 . . . . 0.0 110.448 -178.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 25.6 mt -52.27 -41.17 62.63 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 124.248 1.019 . . . . 0.0 113.165 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.412 ' HB3' HG12 ' A' ' 122' ' ' VAL . 18.7 pt20 -74.14 -1.27 19.57 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -176.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.8 t -122.5 -26.18 4.62 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.516 0.726 . . . . 0.0 111.154 172.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 30.4 m -76.3 104.07 6.64 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.19 0.596 . . . . 0.0 109.922 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -65.8 152.32 44.63 Favored 'General case' 0 CA--C 1.564 1.518 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.612 -175.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.16 -14.58 56.05 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 125.155 1.382 . . . . 0.0 112.551 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.508 ' HB3' ' HB3' ' A' ' 39' ' ' HIS . 54.9 m -55.82 -31.14 62.42 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.996 0.918 . . . . 0.0 111.259 169.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.403 ' O ' HG21 ' A' ' 110' ' ' VAL . . . -56.32 -41.24 75.68 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.741 0.817 . . . . 0.0 112.004 175.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.7 -13.81 6.91 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 124.216 1.006 . . . . 0.0 113.502 -177.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -86.62 -8.7 57.25 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.469 0.708 . . . . 0.0 111.483 -179.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.533 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 44.8 m-85 -123.24 -45.41 2.1 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.826 1.251 . . . . 0.0 109.306 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.717 HG12 ' HB2' ' A' ' 86' ' ' GLN . 13.9 m -85.81 -167.81 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 CA-C-O 122.135 0.969 . . . . 0.0 111.608 167.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 43.9 t -115.03 150.85 35.23 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 114.323 -1.308 . . . . 0.0 108.713 156.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.1 tt -48.69 -39.28 23.91 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.079 0.552 . . . . 0.0 111.629 173.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.93 -31.49 65.0 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.15 0.98 . . . . 0.0 113.248 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -64.4 -46.05 85.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.043 0.537 . . . . 0.0 111.058 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.63 HD23 HG22 ' A' ' 110' ' ' VAL . 8.1 mt -66.17 -48.85 69.39 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.815 0.817 . . . . 0.0 109.83 -175.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -74.04 -24.84 59.6 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.26 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.95 -34.05 62.9 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 123.62 0.768 . . . . 0.0 112.704 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.28 33.62 3.06 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.1 0.56 . . . . 0.0 111.546 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -151.37 130.27 12.5 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.227 0.611 . . . . 0.0 110.147 171.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -80.55 144.27 56.6 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 123.065 0.546 . . . . 0.0 111.686 -176.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_exo -62.8 100.0 0.23 Allowed 'Trans proline' 0 C--N 1.381 2.263 0 C-N-CA 123.329 2.686 . . . . 0.0 112.435 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . 0.412 HG12 ' HB3' ' A' ' 100' ' ' GLN . 7.8 p -68.49 143.46 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.328 0 C-N-CA 123.914 0.886 . . . . 0.0 111.356 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 7.8 tt -69.94 112.22 6.2 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.515 0.674 . . . . 0.0 111.439 -175.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -106.74 -60.42 1.67 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.627 1.171 . . . . 0.0 108.914 172.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 44.9 t60 -178.92 109.96 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.083 1.353 . . . . 0.0 108.265 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 50.5 p-80 -92.13 121.53 33.76 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 121.319 0.581 . . . . 0.0 110.889 175.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -143.3 123.21 13.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.813 0.845 . . . . 0.0 109.155 171.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -139.41 161.58 37.13 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.552 0.741 . . . . 0.0 109.405 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -143.65 136.79 27.74 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.764 0.426 . . . . 0.0 110.416 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 . . . . . 0 CA--C 1.562 1.433 0 C-N-CA 123.033 0.533 . . . . 0.0 109.758 170.335 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptm . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 120.561 0.219 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.85 -5.21 51.01 Favored Glycine 0 CA--C 1.537 1.468 0 CA-C-N 116.415 -0.357 . . . . 0.0 113.522 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.47 133.32 46.72 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.627 0.771 . . . . 0.0 109.819 177.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.81 107.13 1.92 Allowed Glycine 0 C--N 1.352 1.472 0 O-C-N 123.189 0.305 . . . . 0.0 113.112 178.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -126.96 127.85 45.49 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.303 1.041 . . . . 0.0 110.032 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -100.0 162.48 12.95 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.543 0.737 . . . . 0.0 110.891 176.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.7 m -62.43 -24.26 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 C-N-CA 124.105 0.962 . . . . 0.0 113.567 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.606 HD11 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -87.85 -11.86 46.6 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.19 0.596 . . . . 0.0 112.451 -179.633 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 72.32 100.84 0.07 OUTLIER Glycine 0 CA--C 1.541 1.676 0 O-C-N 123.141 0.275 . . . . 0.0 113.391 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -136.68 156.42 48.55 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.264 0.626 . . . . 0.0 112.035 -175.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -159.67 17.68 0.16 Allowed 'General case' 0 CA--C 1.559 1.322 0 CA-C-O 121.61 0.719 . . . . 0.0 110.518 177.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 89.9 mt -105.25 166.9 10.08 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.163 0.985 . . . . 0.0 110.135 173.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.4 141.01 43.31 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 122.59 0.356 . . . . 0.0 110.837 176.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.5 p -176.51 147.54 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.635 0.774 . . . . 0.0 110.91 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.412 ' HB3' HG21 ' A' ' 21' ' ' THR . 42.4 t -83.29 -63.77 1.29 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.631 0.372 . . . . 0.0 110.377 169.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 56.9 m -148.47 152.26 36.6 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.504 0.722 . . . . 0.0 110.516 177.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.4 p -84.13 -1.06 54.3 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.624 0.77 . . . . 0.0 111.85 176.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.19 141.26 46.28 Favored Pre-proline 0 CA--C 1.558 1.285 0 C-N-CA 123.754 0.822 . . . . 0.0 111.95 -177.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.98 -15.56 28.05 Favored 'Trans proline' 0 C--N 1.384 2.442 0 C-N-CA 123.547 2.832 . . . . 0.0 114.926 177.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 51.6 ttm -68.56 -42.31 78.52 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.535 0.334 . . . . 0.0 111.302 175.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.412 HG21 ' HB3' ' A' ' 15' ' ' CYS . 47.8 m -72.48 -51.19 21.17 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.027 0.531 . . . . 0.0 110.583 170.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.6 150.5 24.52 Favored Glycine 0 CA--C 1.536 1.375 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.687 -176.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 13.3 m-90 -92.48 101.56 14.01 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.781 0.832 . . . . 0.0 109.631 -178.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.503 ' HB3' ' HG3' ' A' ' 30' ' ' GLN . 89.7 m-85 -81.51 66.03 6.89 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.275 0.63 . . . . 0.0 111.35 -177.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? 59.52 -77.44 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 125.25 1.42 . . . . 0.0 111.724 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -72.29 -63.28 1.18 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.835 0.854 . . . . 0.0 110.055 178.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -165.94 -55.76 0.03 OUTLIER Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.878 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -138.34 -33.79 0.67 Allowed 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.622 0.369 . . . . 0.0 111.271 173.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 28.3 p -97.43 116.61 29.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.489 0.316 . . . . 0.0 110.792 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.503 ' HG3' ' HB3' ' A' ' 24' ' ' TYR . 54.1 mt-30 -84.76 -51.88 6.46 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.627 0.771 . . . . 0.0 111.26 177.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.24 74.75 5.81 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 121.558 0.694 . . . . 0.0 110.522 173.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -169.41 164.3 10.61 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 114.4 -1.273 . . . . 0.0 110.403 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 28.7 m -91.44 27.41 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.566 1.574 0 C-N-CA 124.374 1.07 . . . . 0.0 111.174 173.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 52.46 23.65 2.63 Favored 'General case' 0 N--CA 1.506 2.357 0 C-N-CA 127.103 2.161 . . . . 0.0 113.544 -174.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -117.07 116.08 26.63 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.225 1.01 . . . . 0.0 109.326 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 51.96 10.83 0.12 Allowed 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 126.766 2.026 . . . . 0.0 116.121 -179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.0 127.6 0.42 Allowed Glycine 0 CA--C 1.544 1.888 0 N-CA-C 115.405 0.922 . . . . 0.0 115.405 168.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 97.8 p 50.92 34.16 10.0 Favored 'General case' 0 N--CA 1.501 2.08 0 C-N-CA 125.411 1.485 . . . . 0.0 114.6 168.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -79.95 89.81 5.33 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.569 0.748 . . . . 0.0 111.374 -177.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.77 111.08 9.65 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 123.04 0.536 . . . . 0.0 111.459 178.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.547 HG13 ' HB1' ' A' ' 82' ' ' ALA . 40.9 t -128.13 120.51 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 169.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 81.5 m -116.61 109.14 16.83 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-O 121.192 0.52 . . . . 0.0 109.86 173.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.617 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -132.06 150.38 52.17 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.332 1.053 . . . . 0.0 108.512 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -117.58 109.18 16.37 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.968 0.413 . . . . 0.0 110.236 -176.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.566 ' HE1' ' HE3' ' A' ' 85' ' ' TRP . 60.5 mmm -84.97 131.42 34.48 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.481 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 5.4 t -81.95 153.71 26.13 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 174.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -49.06 -30.04 5.84 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.489 1.116 . . . . 0.0 113.106 -175.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -49.62 -48.41 49.06 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.65 1.18 . . . . 0.0 112.293 175.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.434 ' HB2' ' HG3' ' A' ' 95' ' ' PRO . 59.8 t80 -68.95 -41.35 78.15 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.034 0.533 . . . . 0.0 112.04 176.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.479 HD12 ' HB2' ' A' ' 45' ' ' MET . 6.3 mp -70.94 -29.45 65.47 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 122.592 0.357 . . . . 0.0 111.713 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 67.9 mt -76.38 -32.86 58.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.695 0.798 . . . . 0.0 110.527 171.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -68.27 -32.19 72.18 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.08 0.552 . . . . 0.0 111.08 171.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 70.0 m -63.67 -49.59 72.58 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.327 0.651 . . . . 0.0 110.658 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.413 ' HD2' ' SD ' ' A' ' 61' ' ' MET . 16.3 ptm180 -72.14 -22.83 61.26 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 177.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -76.48 -28.82 56.63 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 123.781 0.832 . . . . 0.0 111.931 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -130.08 -59.17 1.06 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -175.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -76.11 -88.96 0.27 Allowed Glycine 0 CA--C 1.541 1.697 0 N-CA-C 114.128 0.411 . . . . 0.0 114.128 -174.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 -140.36 142.62 35.53 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.719 0.808 . . . . 0.0 109.935 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -66.83 87.11 0.13 Allowed 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 122.288 1.042 . . . . 0.0 111.738 177.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 34.5 tp -65.52 -11.92 48.01 Favored 'General case' 0 CA--C 1.562 1.427 0 C-N-CA 125.267 1.427 . . . . 0.0 112.946 -176.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.413 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 20.5 ptp -126.01 39.36 3.96 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.656 0.783 . . . . 0.0 112.191 -174.039 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 14.1 t -86.65 152.18 53.96 Favored Pre-proline 0 N--CA 1.489 1.486 0 C-N-CA 122.854 0.462 . . . . 0.0 110.538 171.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -60.82 -166.32 0.04 OUTLIER 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.863 2.376 . . . . 0.0 113.404 166.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 70.71 159.34 0.16 Allowed Pre-proline 0 N--CA 1.501 2.113 0 C-N-CA 124.605 1.162 . . . . 0.0 111.6 -175.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo -58.18 -55.6 2.13 Favored 'Trans proline' 0 C--N 1.39 2.75 0 C-N-CA 122.135 1.89 . . . . 0.0 111.333 173.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 69.04 148.76 0.07 Allowed 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 125.485 1.514 . . . . 0.0 113.823 171.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -122.75 -19.61 6.17 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.224 1.01 . . . . 0.0 112.077 -179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -53.58 -34.31 57.9 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -174.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 32.3 p90 -138.18 156.21 73.92 Favored Pre-proline 0 N--CA 1.481 1.102 0 C-N-CA 123.582 0.753 . . . . 0.0 111.504 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.15 175.04 10.17 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.449 2.099 . . . . 0.0 111.587 166.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -75.96 -119.86 0.14 Allowed Glycine 0 CA--C 1.537 1.452 0 C-N-CA 121.795 -0.24 . . . . 0.0 113.435 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.3 mm? 56.2 91.08 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.881 1.273 . . . . 0.0 112.093 -178.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.48 174.06 6.45 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.371 -176.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.03 116.74 4.74 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.611 0.765 . . . . 0.0 112.242 -173.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 102.34 14.73 27.36 Favored Glycine 0 CA--C 1.536 1.347 0 N-CA-C 114.456 0.543 . . . . 0.0 114.456 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -122.55 103.8 8.94 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 117.783 0.791 . . . . 0.0 111.815 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.425 ' HB3' HG11 ' A' ' 98' ' ' VAL . 0.0 OUTLIER -86.75 91.98 8.8 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.365 0.603 . . . . 0.0 111.324 168.712 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -166.71 121.01 1.07 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.278 0.631 . . . . 0.0 109.323 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 73.4 m 52.78 24.81 3.44 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 175.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.617 HD13 ' HB3' ' A' ' 43' ' ' ALA . 3.3 tm? -72.29 105.25 3.98 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 175.207 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 49.5 t -55.72 120.66 7.64 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 123.551 0.532 . . . . 0.0 110.567 175.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.547 ' HB1' HG13 ' A' ' 41' ' ' VAL . . . -56.84 -22.72 38.7 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.842 0.857 . . . . 0.0 113.131 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 64.6 m -54.1 -39.98 66.88 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.078 0.551 . . . . 0.0 112.348 170.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -66.84 -44.56 80.75 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.92 0.888 . . . . 0.0 111.552 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.604 ' HE1' HD21 ' A' ' 115' ' ' LEU . 5.3 t-105 -70.53 -54.02 13.82 Favored 'General case' 0 CA--C 1.566 1.559 0 C-N-CA 123.215 0.606 . . . . 0.0 110.99 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.701 ' HB2' HG12 ' A' ' 110' ' ' VAL . 6.5 tp60 -49.64 -42.51 45.33 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.31 0.644 . . . . 0.0 112.303 175.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.23 -32.7 62.49 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 123.56 0.744 . . . . 0.0 112.752 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.93 -43.12 91.13 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.111 0.564 . . . . 0.0 111.839 175.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -69.83 -41.24 75.22 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.483 0.713 . . . . 0.0 111.232 176.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 9.4 mm-40 -65.35 -23.71 67.06 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.458 0.703 . . . . 0.0 111.372 178.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.05 -25.63 29.7 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.865 0.866 . . . . 0.0 111.523 172.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 117.7 -12.92 13.36 Favored Glycine 0 N--CA 1.48 1.572 0 N-CA-C 114.187 0.435 . . . . 0.0 114.187 177.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 91.1 mmm -83.92 -80.84 0.18 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.336 0.654 . . . . 0.0 111.773 -176.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.46 92.17 0.07 OUTLIER Pre-proline 0 N--CA 1.487 1.422 0 C-N-CA 124.664 1.185 . . . . 0.0 113.043 -174.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.434 ' HG3' ' HB2' ' A' ' 49' ' ' PHE . 67.6 Cg_endo -77.6 179.27 6.67 Favored 'Trans proline' 0 CA--C 1.574 2.492 0 C-N-CA 123.215 2.61 . . . . 0.0 112.734 174.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -62.06 127.8 22.27 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 121.953 1.768 . . . . 0.0 113.971 174.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.7 p -104.01 145.4 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 124.119 0.968 . . . . 0.0 109.884 173.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.425 HG11 ' HB3' ' A' ' 77' ' ' ARG . 7.5 p -85.67 89.44 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.842 0 CA-C-O 122.192 0.996 . . . . 0.0 111.873 -176.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.551 HD13 ' H ' ' A' ' 120' ' ' LEU . 7.9 mt -64.36 -24.06 67.51 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -177.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -73.27 -6.72 47.86 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 177.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.8 t -123.3 -12.99 7.76 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.679 0.791 . . . . 0.0 112.022 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 91.1 m -85.67 127.09 34.4 Favored 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 123.424 0.689 . . . . 0.0 112.171 -175.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -91.04 165.67 13.4 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.528 0.731 . . . . 0.0 111.518 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -63.32 -17.34 62.46 Favored 'General case' 0 CA--C 1.564 1.519 0 C-N-CA 124.398 1.079 . . . . 0.0 113.867 177.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 64.2 m -61.23 -24.91 66.7 Favored 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 122.696 0.398 . . . . 0.0 111.898 173.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.09 -38.9 68.68 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.418 0.687 . . . . 0.0 111.782 172.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.436 HD22 ' HB2' ' A' ' 112' ' ' LEU . 8.8 mp -67.47 3.4 1.33 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 124.647 1.179 . . . . 0.0 113.47 -176.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -95.72 -2.85 47.04 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.101 0.56 . . . . 0.0 110.357 174.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.472 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 75.6 m-85 -130.39 -53.24 1.1 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.122 1.369 . . . . 0.0 108.542 -177.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.701 HG12 ' HB2' ' A' ' 86' ' ' GLN . 17.0 m -89.07 177.87 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-O 122.256 1.027 . . . . 0.0 112.348 172.281 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.0 t -97.13 148.87 22.6 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 113.924 -1.489 . . . . 0.0 108.888 156.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.436 ' HB2' HD22 ' A' ' 107' ' ' LEU . 1.8 tt -57.99 -34.29 69.82 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 120.98 0.419 . . . . 0.0 109.958 170.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.91 -30.22 65.72 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.694 0.797 . . . . 0.0 112.524 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -71.57 -37.69 71.02 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.346 0.594 . . . . 0.0 110.131 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.604 HD21 ' HE1' ' A' ' 85' ' ' TRP . 75.9 mt -66.62 -50.0 64.44 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.652 0.781 . . . . 0.0 110.98 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.643 HE22 ' HB ' ' A' ' 122' ' ' VAL . 14.7 mt-30 -75.04 -37.7 61.65 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.065 -0.971 . . . . 0.0 112.582 -173.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -59.31 -25.65 64.33 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.469 173.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -120.05 19.84 12.22 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 123.526 0.731 . . . . 0.0 112.14 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -155.05 -101.69 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 170.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.551 ' H ' HD13 ' A' ' 99' ' ' LEU . 3.7 mm? -117.94 133.95 23.34 Favored Pre-proline 0 N--CA 1.483 1.193 0 C-N-CA 123.563 0.745 . . . . 0.0 111.444 -171.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -87.63 135.37 3.53 Favored 'Trans proline' 0 CA--C 1.561 1.83 0 C-N-CA 123.16 2.574 . . . . 0.0 112.968 -176.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . 0.643 ' HB ' HE22 ' A' ' 116' ' ' GLN . 7.5 p -75.39 153.17 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 C-N-CA 122.884 0.474 . . . . 0.0 110.821 176.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.494 ' H ' HD12 ' A' ' 123' ' ' LEU . 0.0 OUTLIER -115.89 171.85 7.51 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.402 0.681 . . . . 0.0 110.108 170.276 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.92 161.42 27.52 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.724 0.81 . . . . 0.0 110.746 -177.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -71.2 111.88 6.9 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.44 176.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -83.86 127.07 33.57 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.968 0.507 . . . . 0.0 111.745 -175.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -156.76 167.44 30.46 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.817 0.847 . . . . 0.0 110.892 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -65.48 121.65 15.37 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.675 0.39 . . . . 0.0 110.743 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -79.68 101.91 8.66 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.507 0.723 . . . . 0.0 111.512 -174.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 . . . . . 0 N--CA 1.488 1.455 0 C-N-CA 125.287 1.435 . . . . 0.0 112.608 176.099 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -148.49 80.01 0.21 Allowed Glycine 0 N--CA 1.477 1.38 0 CA-C-N 116.382 -0.372 . . . . 0.0 112.783 -176.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -73.19 -27.38 61.59 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.928 0.891 . . . . 0.0 111.773 177.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.62 108.76 2.55 Favored Glycine 0 C--N 1.354 1.577 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.618 174.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -139.65 170.46 15.86 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.874 0.87 . . . . 0.0 111.672 -174.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -114.29 150.3 34.64 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.627 0.771 . . . . 0.0 111.405 178.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -78.2 -12.57 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 123.9 0.88 . . . . 0.0 111.053 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 78.3 mt -84.63 -40.8 17.02 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.564 1.146 . . . . 0.0 111.981 -176.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.77 58.59 4.75 Favored Glycine 0 N--CA 1.481 1.678 0 CA-C-N 116.263 -0.426 . . . . 0.0 114.131 -177.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -157.18 -49.78 0.07 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.087 0.955 . . . . 0.0 110.778 -178.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -77.37 158.78 29.93 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.513 0.725 . . . . 0.0 111.611 -178.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.4 mp -79.29 132.02 36.33 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.413 0.685 . . . . 0.0 110.961 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -65.87 -31.1 71.85 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.768 0.827 . . . . 0.0 112.682 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.2 p -138.09 139.1 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 124.193 0.997 . . . . 0.0 110.746 -175.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 51.1 t -99.52 -16.55 18.26 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.287 0.635 . . . . 0.0 111.847 177.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.8 t -74.48 77.15 1.93 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-O 121.521 0.676 . . . . 0.0 112.336 -176.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.0 m -116.8 -66.85 1.04 Allowed 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 168.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.57 -48.15 0.47 Allowed Pre-proline 0 CA--C 1.57 1.724 0 CA-C-O 118.605 -0.712 . . . . 0.0 111.802 173.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -82.24 172.71 11.45 Favored 'Trans proline' 0 C--N 1.392 2.844 0 C-N-CA 122.127 1.884 . . . . 0.0 113.236 173.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 42.0 mtt -105.45 90.94 3.57 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.146 0.979 . . . . 0.0 109.026 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 56.5 p -107.87 79.23 1.26 Allowed 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.696 0.76 . . . . 0.0 110.569 -177.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 69.59 -145.51 42.24 Favored Glycine 0 C--N 1.355 1.632 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.875 -171.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.455 ' HE3' ' HB2' ' A' ' 124' ' ' GLU . 20.5 m0 -111.4 -64.98 1.22 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 167.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -174.97 87.83 0.04 OUTLIER 'General case' 0 C--N 1.36 1.058 0 C-N-CA 123.659 0.784 . . . . 0.0 110.482 174.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.47 ' NH2' HG12 ' A' ' 122' ' ' VAL . 37.1 ttm105 -125.93 -71.75 0.68 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.298 0.639 . . . . 0.0 110.41 174.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -93.79 1.57 56.44 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.11 0.564 . . . . 0.0 110.873 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.41 -50.84 4.41 Favored Glycine 0 C--N 1.356 1.668 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.937 -175.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -148.05 152.99 38.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.185 0.994 . . . . 0.0 110.814 177.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.1 m 66.78 161.72 0.16 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 168.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -170.02 21.62 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 115.25 -0.887 . . . . 0.0 112.196 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.4 t -155.47 155.74 34.03 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -85.12 -14.24 47.71 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.626 1.171 . . . . 0.0 112.072 175.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.1 t 71.83 -66.2 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 C-N-CA 124.958 1.303 . . . . 0.0 111.535 -175.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -80.85 105.58 12.19 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.519 0.728 . . . . 0.0 110.487 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -118.55 -9.9 10.19 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.149 0.98 . . . . 0.0 113.241 -176.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 76.12 -30.09 0.18 Allowed 'General case' 0 N--CA 1.501 2.123 0 C-N-CA 125.334 1.454 . . . . 0.0 114.246 -177.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -93.77 -0.13 66.86 Favored Glycine 0 CA--C 1.54 1.651 0 CA-C-O 119.147 -0.807 . . . . 0.0 114.321 -177.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.7 p 71.15 -5.67 1.49 Allowed 'General case' 0 N--CA 1.512 2.631 0 C-N-CA 126.378 1.871 . . . . 0.0 113.705 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 p-80 -148.65 99.99 3.06 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.654 0.782 . . . . 0.0 109.786 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.7 t -96.2 116.51 29.12 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.555 0.742 . . . . 0.0 111.235 -175.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.493 HG22 ' HB1' ' A' ' 82' ' ' ALA . 48.2 t -139.75 106.18 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.549 0.74 . . . . 0.0 109.871 -179.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 76.2 m -95.8 105.93 18.0 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.492 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -144.97 150.54 37.12 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.232 1.013 . . . . 0.0 108.793 -179.419 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -122.84 119.03 29.35 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 117.938 0.335 . . . . 0.0 110.632 -176.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 56.9 mtp -109.93 158.01 18.66 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.931 0.893 . . . . 0.0 111.274 178.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.404 ' OG1' ' HG2' ' A' ' 48' ' ' GLU . 25.6 p -96.86 158.85 15.23 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.971 0.908 . . . . 0.0 111.073 -177.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.607 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 23.7 tt0 -62.75 -29.12 70.45 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.973 -178.173 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.404 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 12.3 pt-20 -52.34 -45.41 65.65 Favored 'General case' 0 CA--C 1.565 1.548 0 C-N-CA 123.45 0.7 . . . . 0.0 112.73 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -79.38 -37.79 36.46 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 173.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.1 -20.16 64.91 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.73 -0.607 . . . . 0.0 111.616 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.607 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 76.4 mt -73.46 -30.74 63.37 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.536 1.134 . . . . 0.0 110.939 168.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.528 ' HE2' ' SD ' ' A' ' 93' ' ' MET . 13.7 m-85 -64.49 -47.65 78.15 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 118.319 0.509 . . . . 0.0 110.783 169.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.2 t -55.42 -35.19 65.12 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.43 0.633 . . . . 0.0 111.577 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.501 HH11 HD23 ' A' ' 51' ' ' LEU . 25.6 ttt180 -71.67 -60.15 2.38 Favored 'General case' 0 CA--C 1.564 1.516 0 C-N-CA 124.032 0.933 . . . . 0.0 112.016 173.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -85.19 -4.9 59.32 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.677 0.791 . . . . 0.0 112.273 -163.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -111.91 -24.68 9.83 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.467 0.707 . . . . 0.0 109.626 175.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -81.96 -112.28 0.41 Allowed Glycine 0 CA--C 1.538 1.505 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.849 176.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -130.47 20.58 5.19 Favored 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 123.909 0.883 . . . . 0.0 111.459 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.6 t70 67.74 157.33 0.13 Allowed 'General case' 0 CA--C 1.564 1.496 0 C-N-CA 125.008 1.323 . . . . 0.0 112.718 -175.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.419 ' H ' ' HG3' ' A' ' 54' ' ' ARG . 50.7 tp -154.68 -57.57 0.11 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.516 0.726 . . . . 0.0 110.314 178.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 66.8 mtm -101.34 92.04 4.76 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.489 0.715 . . . . 0.0 111.986 -171.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.9 p -134.01 163.34 51.89 Favored Pre-proline 0 N--CA 1.495 1.796 0 C-N-CA 124.334 1.054 . . . . 0.0 110.871 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -61.89 85.88 0.1 OUTLIER 'Trans proline' 0 C--N 1.392 2.852 0 C-N-CA 122.612 2.208 . . . . 0.0 112.214 172.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -129.17 153.95 80.46 Favored Pre-proline 0 N--CA 1.48 1.044 0 C-N-CA 124.945 1.298 . . . . 0.0 110.376 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.26 -53.28 2.03 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.435 2.09 . . . . 0.0 111.307 169.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 64.17 153.36 0.05 Allowed 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 125.767 1.627 . . . . 0.0 114.039 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -97.97 -84.54 0.38 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.25 0.62 . . . . 0.0 112.119 -177.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -157.96 99.97 1.7 Allowed 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 121.251 0.548 . . . . 0.0 110.635 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -128.76 98.46 24.72 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 123.923 0.889 . . . . 0.0 109.047 174.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -84.54 -171.41 1.0 Allowed 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.959 2.439 . . . . 0.0 113.805 178.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 104.0 -157.86 17.09 Favored Glycine 0 N--CA 1.479 1.528 0 N-CA-C 114.345 0.498 . . . . 0.0 114.345 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.71 117.96 13.94 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.168 0.987 . . . . 0.0 111.052 -177.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -113.63 -53.8 2.66 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.539 0.736 . . . . 0.0 110.733 179.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 170.41 137.45 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 126.436 1.894 . . . . 0.0 109.634 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 68.87 26.33 74.69 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 116.69 -0.232 . . . . 0.0 113.118 -174.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -110.1 115.47 29.81 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.791 0.836 . . . . 0.0 110.065 176.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -99.17 84.89 3.11 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 171.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -158.76 116.63 2.88 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.244 0.618 . . . . 0.0 109.798 -175.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.0 t 43.84 33.86 0.8 Allowed 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 124.462 1.105 . . . . 0.0 113.218 175.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.492 HD13 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -62.85 123.42 18.44 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.97 0.908 . . . . 0.0 109.968 -174.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 63.0 m -62.6 105.44 0.64 Allowed 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.493 ' HB1' HG22 ' A' ' 41' ' ' VAL . . . -55.59 -26.05 41.71 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.208 1.003 . . . . 0.0 112.692 -177.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 65.2 m -58.87 -42.26 89.04 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.687 0.795 . . . . 0.0 112.474 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.7 mmt85 -69.68 -40.56 76.3 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.671 0.788 . . . . 0.0 112.04 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.576 ' HE1' HD21 ' A' ' 115' ' ' LEU . 15.9 t-105 -64.7 -54.14 36.37 Favored 'General case' 0 CA--C 1.559 1.296 0 C-N-CA 122.535 0.334 . . . . 0.0 110.162 175.502 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.723 ' HB2' HG13 ' A' ' 110' ' ' VAL . 29.5 tp60 -48.85 -43.64 38.9 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.906 0.882 . . . . 0.0 112.718 174.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -67.46 -33.48 75.21 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.839 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.22 -37.05 82.94 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 122.836 0.454 . . . . 0.0 111.361 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.644 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 81.5 t80 -58.13 -52.13 66.81 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.55 170.215 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -66.13 -23.97 66.59 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.749 0.819 . . . . 0.0 112.392 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.12 -5.89 59.32 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.783 0.833 . . . . 0.0 112.516 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.67 10.68 72.55 Favored Glycine 0 CA--C 1.538 1.496 0 N-CA-C 114.249 0.46 . . . . 0.0 114.249 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' MET . . . . . 0.528 ' SD ' ' HE2' ' A' ' 52' ' ' PHE . 97.2 mmm -97.98 -75.39 0.55 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.649 0.78 . . . . 0.0 110.902 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.644 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 53.95 82.85 0.24 Allowed Pre-proline 0 CA--C 1.565 1.553 0 C-N-CA 125.0 1.32 . . . . 0.0 113.494 -178.251 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -56.89 160.15 12.94 Favored 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.677 2.918 . . . . 0.0 114.557 170.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -63.79 106.32 0.62 Allowed 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 122.776 2.318 . . . . 0.0 113.234 174.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 10.6 p -96.05 154.25 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 C-N-CA 123.481 0.712 . . . . 0.0 110.261 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.537 HG23 ' HB3' ' A' ' 101' ' ' SER . 27.7 m -73.1 141.98 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.446 0 C-N-CA 123.472 0.709 . . . . 0.0 111.864 173.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 73.1 mt -105.32 -8.62 18.12 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 123.265 0.626 . . . . 0.0 111.252 167.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.15 2.73 29.53 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.531 1.132 . . . . 0.0 112.312 -170.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.537 ' HB3' HG23 ' A' ' 98' ' ' VAL . 21.8 t -132.51 -51.64 0.93 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.884 0.874 . . . . 0.0 110.989 -179.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 98.3 m -38.11 123.6 1.13 Allowed 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 125.222 1.409 . . . . 0.0 113.87 -177.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -83.54 174.54 10.49 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.314 1.045 . . . . 0.0 113.419 -171.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -61.32 -38.74 87.95 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.402 1.081 . . . . 0.0 112.468 177.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 39.3 t -63.36 -28.12 69.78 Favored 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.805 -176.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.47 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -64.55 -47.14 79.88 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.15 0.58 . . . . 0.0 111.725 173.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.62 -15.78 13.11 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 124.369 1.068 . . . . 0.0 113.117 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -75.93 -39.27 56.5 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.503 0.721 . . . . 0.0 110.189 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -87.38 -36.31 17.85 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.696 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.723 HG13 ' HB2' ' A' ' 86' ' ' GLN . 26.8 m -97.55 -56.42 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 -176.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 38.4 t 83.67 134.11 0.05 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 125.924 1.689 . . . . 0.0 110.579 -151.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.634 ' HA ' HD13 ' A' ' 115' ' ' LEU . 1.7 tt -50.07 -30.64 11.31 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.281 1.032 . . . . 0.0 113.628 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.85 -36.11 71.86 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.179 0.592 . . . . 0.0 112.436 -178.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.65 -31.07 57.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.755 0.822 . . . . 0.0 110.637 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.634 HD13 ' HA ' ' A' ' 112' ' ' LEU . 56.9 mt -63.88 -56.18 17.25 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 123.879 0.872 . . . . 0.0 110.013 173.005 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -65.72 -28.72 69.26 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.074 0.95 . . . . 0.0 112.371 -175.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -49.17 -38.53 25.94 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -138.36 39.49 2.27 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-O 121.224 0.535 . . . . 0.0 111.818 178.183 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -114.59 -172.24 2.08 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.55 0.74 . . . . 0.0 111.094 170.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.3 pp -61.74 141.13 95.23 Favored Pre-proline 0 CA--C 1.564 1.493 0 C-N-CA 123.223 0.609 . . . . 0.0 112.298 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.82 128.96 16.73 Favored 'Trans proline' 0 C--N 1.371 1.758 0 C-N-CA 122.83 2.353 . . . . 0.0 111.884 172.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . 0.47 HG12 ' NH2' ' A' ' 25' ' ' ARG . 9.1 p -149.43 141.36 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 123.099 0.56 . . . . 0.0 110.974 -175.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.6 81.65 2.0 Allowed 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 122.206 1.003 . . . . 0.0 110.533 176.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.455 ' HB2' ' HE3' ' A' ' 23' ' ' TRP . 41.2 mt-10 -72.46 131.72 42.94 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.116 -178.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -76.31 121.37 22.88 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.944 0.497 . . . . 0.0 110.985 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 22.3 m80 -77.44 -25.03 50.24 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.709 0.804 . . . . 0.0 111.754 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 45.3 m80 59.55 -89.79 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 125.257 1.423 . . . . 0.0 111.537 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 25.5 t60 63.12 -75.7 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.711 1.605 . . . . 0.0 113.174 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 68.95 126.53 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 125.591 1.556 . . . . 0.0 110.759 -173.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 . . . . . 0 CA--C 1.568 1.654 0 C-N-CA 123.936 0.894 . . . . 0.0 110.674 -171.314 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.484 1.264 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.65 128.87 1.25 Allowed Glycine 0 C--N 1.35 1.344 0 CA-C-N 116.424 -0.353 . . . . 0.0 112.75 179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -141.6 104.68 4.6 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.014 0.926 . . . . 0.0 109.884 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.07 114.91 4.18 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 116.63 -0.259 . . . . 0.0 113.377 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -134.09 126.75 30.74 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.041 0.537 . . . . 0.0 110.936 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -168.49 140.64 2.82 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.182 0.993 . . . . 0.0 110.029 176.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 20.0 t 67.18 -57.77 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.646 0 C-N-CA 126.361 1.865 . . . . 0.0 113.307 -176.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.2 pp -65.85 -5.53 9.37 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.319 1.448 . . . . 0.0 114.427 -179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -59.39 -22.55 56.43 Favored Glycine 0 CA--C 1.543 1.828 0 N-CA-C 115.374 0.909 . . . . 0.0 115.374 -176.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.2 pm0 -153.0 165.07 36.73 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.548 0.739 . . . . 0.0 109.906 176.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -155.0 148.06 24.75 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.404 0.682 . . . . 0.0 111.48 -177.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 18.2 tp -142.67 12.84 1.91 Allowed 'General case' 0 CA--C 1.555 1.154 0 CA-C-O 121.596 0.713 . . . . 0.0 110.051 170.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -80.35 -53.06 6.97 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 121.026 0.441 . . . . 0.0 110.004 177.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.426 HG11 ' H ' ' A' ' 15' ' ' CYS . 5.6 p -116.71 -68.36 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.6 0 C-N-CA 123.141 0.576 . . . . 0.0 112.258 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.426 ' H ' HG11 ' A' ' 14' ' ' VAL . 83.3 m 47.91 51.42 14.4 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 124.216 1.006 . . . . 0.0 113.242 -174.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.4 t -76.63 130.72 38.21 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.288 177.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 53.4 t 69.02 -63.73 0.36 Allowed 'General case' 0 N--CA 1.497 1.903 0 C-N-CA 125.202 1.401 . . . . 0.0 112.791 179.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.89 159.94 37.16 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 124.518 1.127 . . . . 0.0 110.859 178.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -70.96 169.96 19.18 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.264 1.976 . . . . 0.0 112.075 166.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 83.2 mtp 66.44 14.79 9.88 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.576 1.15 . . . . 0.0 113.495 175.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 42.5 p -79.89 114.59 18.92 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 118.388 0.54 . . . . 0.0 110.52 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.0 -101.64 0.28 Allowed Glycine 0 CA--C 1.534 1.275 0 CA-C-N 116.734 -0.212 . . . . 0.0 112.586 178.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 56.5 p-90 -150.51 168.04 25.41 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.264 0.626 . . . . 0.0 111.242 178.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -166.07 -57.54 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.007 0.923 . . . . 0.0 109.425 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -118.35 -75.52 0.58 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.088 0.555 . . . . 0.0 111.605 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -123.37 91.19 3.43 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.341 0.657 . . . . 0.0 110.36 -171.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.52 -75.78 1.0 Allowed Glycine 0 N--CA 1.48 1.591 0 CA-C-N 116.524 -0.307 . . . . 0.0 113.266 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.403 ' HA ' HG13 ' A' ' 14' ' ' VAL . 45.4 p90 -73.53 -176.92 2.47 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.933 0.893 . . . . 0.0 111.828 174.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 64.3 m -72.99 -91.07 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.613 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.789 172.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.485 ' NE2' ' SG ' ' A' ' 79' ' ' CYS . 13.8 pt20 -159.17 24.9 0.2 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.543 0.687 . . . . 0.0 111.172 -177.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.8 t -88.03 7.61 30.48 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.342 1.057 . . . . 0.0 113.109 -169.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -101.81 -76.75 0.56 Allowed 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.127 0.571 . . . . 0.0 110.515 178.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.4 p -147.16 -40.64 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 C-N-CA 124.127 0.971 . . . . 0.0 109.71 173.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 63.61 -77.01 0.03 OUTLIER 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 125.914 1.686 . . . . 0.0 112.005 -171.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -140.03 -175.41 4.22 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 124.236 1.014 . . . . 0.0 110.741 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -83.86 36.12 0.54 Allowed 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 123.56 0.744 . . . . 0.0 112.435 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -96.49 -128.72 5.86 Favored Glycine 0 C--N 1.35 1.325 0 O-C-N 122.094 -0.379 . . . . 0.0 113.75 -176.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 t -80.25 -11.32 59.74 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.614 0.766 . . . . 0.0 112.974 -175.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 70.1 m80 62.94 -163.38 0.27 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.479 1.112 . . . . 0.0 112.339 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.2 p -94.82 102.9 14.78 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-O 121.558 0.694 . . . . 0.0 110.966 -171.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.699 HG12 ' HB3' ' A' ' 82' ' ' ALA . 39.6 t -127.78 101.14 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.095 0.558 . . . . 0.0 109.831 174.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.5 m -111.38 106.59 15.57 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 171.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.415 ' HB2' HD13 ' A' ' 80' ' ' LEU . . . -139.32 150.67 45.65 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.36 1.064 . . . . 0.0 108.919 -176.454 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -116.62 108.54 16.07 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 122.065 -0.397 . . . . 0.0 110.584 -172.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.558 ' HB2' HD11 ' A' ' 50' ' ' LEU . 85.3 mmm -95.29 153.91 17.44 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.651 0.78 . . . . 0.0 111.024 177.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.405 ' OG1' ' HG2' ' A' ' 48' ' ' GLU . 73.0 p -90.94 156.47 17.96 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.898 0.879 . . . . 0.0 111.084 177.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.422 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 34.8 tt0 -62.7 -28.71 70.13 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.206 0.602 . . . . 0.0 112.146 -177.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.405 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 7.8 pt-20 -54.11 -38.05 64.97 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 122.825 0.45 . . . . 0.0 110.875 173.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.49 ' HB2' ' HG2' ' A' ' 95' ' ' PRO . 74.8 t80 -77.4 -45.59 25.4 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 123.658 0.783 . . . . 0.0 112.031 173.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.558 HD11 ' HB2' ' A' ' 45' ' ' MET . 9.0 mp -64.08 -41.12 97.42 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -174.171 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.422 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 88.6 mt -65.12 -31.33 72.48 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.768 0.427 . . . . 0.0 111.353 174.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -67.32 -44.07 80.05 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 123.647 0.779 . . . . 0.0 111.461 172.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.463 ' HG ' ' HA ' ' A' ' 50' ' ' LEU . 97.7 p -73.64 -30.39 62.92 Favored 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 123.499 0.72 . . . . 0.0 111.68 -179.253 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.542 ' HG3' ' HB2' ' A' ' 60' ' ' LEU . 8.2 mpt_? -67.73 -47.25 69.84 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.937 0.895 . . . . 0.0 110.569 174.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -69.57 -28.12 65.71 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 124.103 0.961 . . . . 0.0 111.536 176.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -58.01 -45.25 87.19 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.534 1.133 . . . . 0.0 110.566 175.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.43 -72.8 1.27 Allowed Glycine 0 CA--C 1.536 1.357 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.389 175.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 59.4 t30 -162.74 -72.61 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.297 0.639 . . . . 0.0 110.512 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -141.58 -51.43 0.42 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.316 0.647 . . . . 0.0 111.071 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.542 ' HB2' ' HG3' ' A' ' 54' ' ' ARG . 87.5 mt 66.68 -21.91 0.1 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 116.302 1.964 . . . . 0.0 116.302 170.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -158.06 -48.53 0.06 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 119.321 0.964 . . . . 0.0 112.215 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 85.4 m 65.28 133.26 0.04 OUTLIER Pre-proline 0 N--CA 1.496 1.858 0 C-N-CA 124.152 0.981 . . . . 0.0 112.763 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -59.06 104.77 0.21 Allowed 'Trans proline' 0 C--N 1.386 2.513 0 C-N-CA 122.547 2.165 . . . . 0.0 111.581 170.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 44.7 ttt180 -150.91 141.98 15.07 Favored Pre-proline 0 CA--C 1.562 1.404 0 C-N-CA 123.318 0.647 . . . . 0.0 110.293 -171.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -74.03 14.3 0.72 Allowed 'Trans proline' 0 C--N 1.386 2.518 0 C-N-CA 122.988 2.459 . . . . 0.0 115.219 -177.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -107.55 149.36 28.09 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.6 0.76 . . . . 0.0 111.957 -177.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -91.02 20.65 4.74 Favored 'General case' 0 CA--C 1.565 1.521 0 C-N-CA 124.502 1.121 . . . . 0.0 111.159 -178.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -64.98 -18.93 65.71 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.639 0.776 . . . . 0.0 112.874 -175.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -123.07 94.29 47.32 Favored Pre-proline 0 N--CA 1.488 1.439 0 C-N-CA 123.815 0.846 . . . . 0.0 111.119 -178.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -93.97 26.87 0.33 Allowed 'Trans proline' 0 CA--C 1.56 1.816 0 C-N-CA 123.19 2.593 . . . . 0.0 112.699 170.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -87.7 64.82 3.64 Favored Glycine 0 C--N 1.352 1.446 0 N-CA-C 114.121 0.409 . . . . 0.0 114.121 -174.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 58.93 99.94 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.734 1.214 . . . . 0.0 113.305 176.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.8 pttt -96.53 170.42 9.23 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.228 0.611 . . . . 0.0 109.857 174.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.61 113.53 3.04 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.004 0.522 . . . . 0.0 110.941 176.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 116.54 -11.17 16.27 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 116.193 -0.458 . . . . 0.0 113.668 -175.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -85.21 97.34 9.86 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 117.242 0.521 . . . . 0.0 110.59 175.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.502 ' HD2' HG22 ' A' ' 98' ' ' VAL . 44.8 ttp180 -96.66 84.12 3.58 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -174.95 120.7 0.21 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 125.873 1.669 . . . . 0.0 108.075 -174.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.485 ' SG ' ' NE2' ' A' ' 30' ' ' GLN . 36.2 m 59.47 27.99 17.26 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.511 0.724 . . . . 0.0 112.888 173.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.415 HD13 ' HB2' ' A' ' 43' ' ' ALA . 2.9 tm? -67.78 135.76 53.14 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 123.817 0.847 . . . . 0.0 110.559 -177.4 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.2 m -66.51 95.26 0.32 Allowed 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.845 0.858 . . . . 0.0 111.083 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.699 ' HB3' HG12 ' A' ' 41' ' ' VAL . . . -60.23 -29.42 68.74 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.847 0.859 . . . . 0.0 113.163 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.7 m -56.45 -35.21 67.62 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.553 0.741 . . . . 0.0 112.184 175.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -73.62 -41.56 62.64 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.136 0.974 . . . . 0.0 111.472 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 3.0 t-105 -66.54 -48.59 69.22 Favored 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 122.816 0.446 . . . . 0.0 110.366 176.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.564 ' HB2' HG13 ' A' ' 110' ' ' VAL . 11.0 tp60 -49.43 -43.28 44.61 Favored 'General case' 0 CA--C 1.564 1.481 0 C-N-CA 124.052 0.941 . . . . 0.0 111.885 169.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.11 -47.27 85.89 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.949 0.5 . . . . 0.0 111.765 175.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.05 -39.34 74.68 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -173.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.54 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 49.7 t80 -72.18 -45.06 61.92 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.354 0.261 . . . . 0.0 111.495 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -71.71 -21.59 61.75 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.253 0.621 . . . . 0.0 112.173 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.29 -24.59 29.81 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.036 0.934 . . . . 0.0 111.216 175.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.62 42.42 7.81 Favored Glycine 0 C--N 1.349 1.281 0 CA-C-N 116.418 -0.355 . . . . 0.0 113.474 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -142.05 12.54 2.02 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.032 0.933 . . . . 0.0 111.33 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.54 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -50.66 114.08 4.29 Favored Pre-proline 0 CA--C 1.566 1.586 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -176.028 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.49 ' HG2' ' HB2' ' A' ' 49' ' ' PHE . 12.0 Cg_exo -74.92 177.04 9.09 Favored 'Trans proline' 0 CA--C 1.57 2.296 0 C-N-CA 123.978 3.119 . . . . 0.0 112.651 170.165 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.455 ' HA ' ' HB3' ' A' ' 118' ' ' HIS . 65.5 Cg_endo -70.55 152.59 65.32 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.178 1.919 . . . . 0.0 113.715 174.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 14.9 p -138.1 167.68 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 124.294 1.038 . . . . 0.0 109.461 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.502 HG22 ' HD2' ' A' ' 77' ' ' ARG . 16.6 m -90.7 135.69 25.96 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 123.159 0.584 . . . . 0.0 111.231 169.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 12.5 mt -90.9 -36.9 13.89 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.598 0.713 . . . . 0.0 109.532 161.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -78.99 13.57 1.71 Allowed 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 125.093 1.357 . . . . 0.0 113.671 -171.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.478 ' HB3' HG22 ' A' ' 98' ' ' VAL . 46.3 t -147.01 -39.82 0.2 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.124 0.569 . . . . 0.0 111.279 179.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.7 m -61.78 130.14 44.32 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 122.697 0.399 . . . . 0.0 111.248 174.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -75.81 161.41 29.04 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.061 0.545 . . . . 0.0 111.957 -177.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.4 ' HA ' HD13 ' A' ' 107' ' ' LEU . 13.8 mptt -70.97 -17.5 62.65 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.532 0.733 . . . . 0.0 112.126 178.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.6 m -60.82 -26.94 67.69 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.269 0.628 . . . . 0.0 111.938 174.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.402 ' O ' HG21 ' A' ' 110' ' ' VAL . . . -61.72 -32.56 72.79 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.729 0.811 . . . . 0.0 112.587 176.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.5 mp -62.75 1.86 0.35 Allowed 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 125.027 1.331 . . . . 0.0 114.534 -174.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -96.12 -28.81 14.42 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.397 0.679 . . . . 0.0 110.214 177.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -97.64 -43.8 7.05 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.139 1.375 . . . . 0.0 109.139 -177.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.765 HG22 HD23 ' A' ' 115' ' ' LEU . 35.5 m -93.39 -171.25 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 122.087 0.946 . . . . 0.0 110.646 163.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 44.7 t -115.39 154.29 29.48 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 114.549 -1.205 . . . . 0.0 108.566 155.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.0 tt -48.8 -36.02 15.73 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.762 0.825 . . . . 0.0 111.513 170.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.64 74.63 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 123.937 0.895 . . . . 0.0 113.388 -177.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.72 -42.38 91.17 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.373 0.606 . . . . 0.0 110.463 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.765 HD23 HG22 ' A' ' 110' ' ' VAL . 6.4 mt -66.36 -52.43 46.98 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.791 -178.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.38 -25.11 63.1 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.173 0.989 . . . . 0.0 112.505 -174.126 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.78 -26.26 67.13 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 170.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 96' ' ' PRO . 78.0 m80 -132.54 26.68 4.41 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.76 0.824 . . . . 0.0 112.16 -177.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -166.68 155.8 10.84 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.125 0.97 . . . . 0.0 110.387 176.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.496 HD12 HD13 ' A' ' 123' ' ' LEU . 2.4 pt? -140.58 161.57 53.88 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 122.875 0.47 . . . . 0.0 110.79 175.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -49.68 139.09 31.9 Favored 'Trans proline' 0 C--N 1.378 2.088 0 C-N-CA 123.317 2.678 . . . . 0.0 113.265 165.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 9.9 p -65.48 126.53 24.78 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.339 0 CA-C-O 121.252 0.548 . . . . 0.0 110.049 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.496 HD13 HD12 ' A' ' 120' ' ' LEU . 5.3 mp -72.93 100.74 3.01 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.733 0.813 . . . . 0.0 112.069 -163.297 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.03 -21.13 12.14 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.074 0.949 . . . . 0.0 111.544 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -128.21 178.98 5.86 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.619 0.767 . . . . 0.0 111.844 173.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 55.3 t60 -72.93 134.06 44.6 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.096 0.958 . . . . 0.0 112.746 -171.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -121.93 171.17 9.12 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.611 1.165 . . . . 0.0 108.665 166.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 66.97 98.99 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.305 1.042 . . . . 0.0 111.203 -174.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -160.69 167.06 27.71 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.051 0.94 . . . . 0.0 110.92 -176.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 . . . . . 0 CA--C 1.564 1.499 0 C-N-CA 123.24 0.616 . . . . 0.0 110.606 176.793 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.424 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.5 mpt? . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -74.3 107.48 2.28 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 120.178 -0.235 . . . . 0.0 112.903 176.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -72.3 115.55 11.68 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.199 0.599 . . . . 0.0 110.394 176.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.57 108.87 3.09 Favored Glycine 0 C--N 1.347 1.191 0 O-C-N 123.187 0.304 . . . . 0.0 112.934 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -90.24 143.6 26.62 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -153.27 121.16 6.06 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.631 0.372 . . . . 0.0 111.767 -174.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.406 HG12 ' NE2' ' A' ' 34' ' ' GLN . 1.9 t 52.67 20.22 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.897 0 C-N-CA 126.176 1.79 . . . . 0.0 114.117 173.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -71.41 -18.86 62.32 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.154 0.981 . . . . 0.0 113.128 -178.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 161.29 89.71 0.07 OUTLIER Glycine 0 CA--C 1.53 0.987 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -156.61 -48.49 0.07 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.626 0.77 . . . . 0.0 111.765 -171.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -86.19 -171.27 3.48 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.579 0.751 . . . . 0.0 109.542 -176.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.3 mp -80.48 71.07 7.3 Favored 'General case' 0 CA--C 1.555 1.14 0 O-C-N 121.173 -0.954 . . . . 0.0 110.348 174.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -59.86 -47.36 86.06 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.321 0.648 . . . . 0.0 109.472 169.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.1 p -148.17 141.8 18.99 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.953 0.901 . . . . 0.0 109.317 169.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.646 ' HA ' ' HD2' ' A' ' 28' ' ' PHE . 42.0 t -147.32 122.46 10.17 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.236 0.614 . . . . 0.0 111.061 -177.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.461 ' HB2' ' HB3' ' A' ' 26' ' ' ASN . 29.9 p -84.76 144.95 28.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.424 0.69 . . . . 0.0 111.753 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.0 m -69.44 -15.59 63.31 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.073 0.549 . . . . 0.0 112.121 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.05 127.99 93.54 Favored Pre-proline 0 CA--C 1.558 1.274 0 C-N-CA 123.575 0.75 . . . . 0.0 111.768 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -53.19 155.16 12.49 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 123.675 2.917 . . . . 0.0 114.198 176.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 85.4 mtp 63.03 46.95 4.45 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.34 1.056 . . . . 0.0 111.846 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.0 p -51.9 96.51 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 123.738 0.815 . . . . 0.0 112.433 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -158.87 -101.92 0.18 Allowed Glycine 0 C--N 1.347 1.148 0 CA-C-N 116.316 -0.402 . . . . 0.0 112.642 -176.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.9 t90 -70.56 93.24 0.89 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.71 0.804 . . . . 0.0 111.389 -176.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 61.66 -76.44 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.417 1.487 . . . . 0.0 112.742 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? 69.2 -76.13 0.06 Allowed 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 125.016 1.326 . . . . 0.0 112.896 175.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.461 ' HB3' ' HB2' ' A' ' 16' ' ' CYS . 5.0 t30 -155.16 10.48 0.32 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.658 0.783 . . . . 0.0 109.893 177.136 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 129.58 64.38 0.11 Allowed Glycine 0 C--N 1.351 1.386 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.774 -175.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.646 ' HD2' ' HA ' ' A' ' 15' ' ' CYS . 41.5 t80 -145.52 138.78 26.31 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.656 0.782 . . . . 0.0 109.048 174.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.0 t -154.11 -35.76 0.1 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.126 0.57 . . . . 0.0 110.8 171.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 60.53 29.46 19.03 Favored 'General case' 0 N--CA 1.501 2.115 0 CA-C-O 123.013 1.387 . . . . 0.0 112.412 172.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.9 t -135.88 16.67 3.29 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 122.392 1.091 . . . . 0.0 109.05 171.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -88.38 145.85 25.58 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 113.923 -1.49 . . . . 0.0 108.87 -177.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.435 HG21 ' SG ' ' A' ' 79' ' ' CYS . 48.5 t -86.43 74.4 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.171 0 CA-C-O 121.123 0.487 . . . . 0.0 111.127 -176.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.406 ' NE2' HG12 ' A' ' 7' ' ' VAL . 78.3 mm-40 64.03 -65.99 0.12 Allowed 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 126.113 1.765 . . . . 0.0 115.354 166.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -52.38 148.43 6.74 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 124.726 1.211 . . . . 0.0 114.084 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.662 ' HD3' ' H ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -86.74 118.37 26.1 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.905 0.882 . . . . 0.0 111.154 -177.174 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 129.13 -168.68 20.73 Favored Glycine 0 N--CA 1.477 1.411 0 CA-C-N 116.113 -0.494 . . . . 0.0 113.46 177.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.1 m 61.65 -172.39 0.15 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.477 1.111 . . . . 0.0 112.456 -179.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -126.3 174.62 8.43 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.939 0.896 . . . . 0.0 109.911 171.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.2 m -93.11 105.9 17.93 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.038 0.447 . . . . 0.0 110.742 -172.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.9 t -125.62 122.8 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.708 0.803 . . . . 0.0 110.448 176.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 79.4 m -121.08 107.29 12.44 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 168.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.496 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -136.18 142.89 44.17 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.147 0.979 . . . . 0.0 108.645 179.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.465 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 17.4 tt0 -122.02 110.02 15.3 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.808 0.337 . . . . 0.0 110.548 -171.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.625 ' HB2' HD12 ' A' ' 50' ' ' LEU . 42.7 mmm -89.56 136.02 33.27 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.803 0.841 . . . . 0.0 109.157 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 14.7 t -82.23 159.98 23.1 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 176.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.486 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 31.7 tt0 -54.57 -32.07 57.82 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.364 0.666 . . . . 0.0 112.601 -172.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -57.29 -37.55 72.6 Favored 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -175.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -76.01 -39.83 54.91 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.625 HD12 ' HB2' ' A' ' 45' ' ' MET . 6.3 mp -68.41 -25.02 64.83 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 120.97 0.414 . . . . 0.0 110.765 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.486 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 94.1 mt -74.98 -44.75 46.48 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.483 1.113 . . . . 0.0 109.835 170.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -55.99 -39.53 71.98 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.915 0.486 . . . . 0.0 111.006 174.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.0 t -66.1 -42.21 89.56 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.741 0.816 . . . . 0.0 111.892 -176.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.515 ' HB2' ' HA ' ' A' ' 59' ' ' ASP . 7.8 ptm180 -77.68 -47.66 18.65 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 179.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -69.46 -19.09 63.77 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.169 0.988 . . . . 0.0 113.012 -176.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -69.97 -32.57 70.86 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 122.701 0.4 . . . . 0.0 111.499 176.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -119.34 -81.89 0.75 Allowed Glycine 0 C--N 1.352 1.453 0 CA-C-N 116.655 -0.248 . . . . 0.0 113.543 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -138.06 -79.9 0.35 Allowed 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 124.028 0.931 . . . . 0.0 110.528 -179.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.515 ' HA ' ' HB2' ' A' ' 54' ' ' ARG . 6.9 p-10 -167.91 121.34 0.92 Allowed 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 123.94 0.896 . . . . 0.0 110.593 175.118 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 94.2 mt -110.75 -65.6 1.15 Allowed 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.857 0.863 . . . . 0.0 110.337 174.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 44.3 ttp -80.5 91.02 5.7 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-O 121.049 0.452 . . . . 0.0 109.834 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.448 HG22 ' HB2' ' A' ' 59' ' ' ASP . 4.7 p -145.65 163.29 32.25 Favored Pre-proline 0 N--CA 1.49 1.533 0 C-N-CA 124.609 1.164 . . . . 0.0 110.409 -178.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -60.89 86.4 0.08 OUTLIER 'Trans proline' 0 C--N 1.39 2.734 0 C-N-CA 123.015 2.477 . . . . 0.0 112.434 173.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.641 ' HB3' ' HB2' ' A' ' 67' ' ' PHE . 27.0 mmt180 -122.08 74.47 38.69 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 124.425 1.09 . . . . 0.0 109.383 178.155 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.87 -33.87 9.44 Favored 'Trans proline' 0 C--N 1.371 1.746 0 C-N-CA 122.406 2.071 . . . . 0.0 113.358 -169.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -97.09 -5.44 37.4 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.089 0.955 . . . . 0.0 111.783 -178.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.641 ' HB2' ' HB3' ' A' ' 64' ' ' ARG . 59.6 m-85 -108.87 -30.79 7.95 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.753 0.821 . . . . 0.0 111.115 -176.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.453 HD22 ' HA3' ' A' ' 71' ' ' GLY . 7.7 t30 -154.27 96.53 1.94 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.86 0.864 . . . . 0.0 109.934 -175.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.4 ' HB3' ' HD3' ' A' ' 70' ' ' PRO . 85.7 t80 -74.56 -49.68 4.83 Favored Pre-proline 0 CA--C 1.573 1.856 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.644 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.4 ' HD3' ' HB3' ' A' ' 69' ' ' PHE . 33.6 Cg_endo -91.57 -93.95 0.0 OUTLIER 'Trans proline' 0 C--N 1.394 2.963 0 C-N-CA 122.219 1.946 . . . . 0.0 112.259 173.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.453 ' HA3' HD22 ' A' ' 68' ' ' ASN . . . 72.74 -9.35 6.36 Favored Glycine 0 C--N 1.358 1.788 0 N-CA-C 115.537 0.975 . . . . 0.0 115.537 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.2 mm? 64.63 108.91 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 125.048 1.339 . . . . 0.0 112.609 -174.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.483 ' HZ1' ' HB2' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -96.05 167.71 11.06 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 173.091 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.67 125.69 24.65 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.407 0.683 . . . . 0.0 112.344 -176.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 99.8 2.28 56.23 Favored Glycine 0 CA--C 1.537 1.465 0 N-CA-C 114.738 0.655 . . . . 0.0 114.738 -177.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -97.14 109.27 22.06 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 117.96 0.88 . . . . 0.0 111.834 173.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.465 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 27.6 ptt-85 -90.95 87.84 6.78 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-O 122.079 0.943 . . . . 0.0 109.482 168.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -166.75 118.67 0.97 Allowed 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.67 -167.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.435 ' SG ' HG21 ' A' ' 33' ' ' VAL . 73.5 m 50.03 22.47 0.91 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 178.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.496 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -59.08 -31.03 68.51 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.823 0.849 . . . . 0.0 112.103 -169.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 42.4 t 67.11 113.53 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.685 1.194 . . . . 0.0 110.613 -172.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.86 -29.42 66.95 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -172.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.7 t -63.69 -33.23 75.18 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.466 0.706 . . . . 0.0 112.417 177.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -66.09 -41.83 90.13 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.624 0.769 . . . . 0.0 111.406 177.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.49 ' NE1' HD21 ' A' ' 115' ' ' LEU . 1.5 t-105 -69.26 -49.34 56.99 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 123.107 0.563 . . . . 0.0 110.822 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -52.98 -41.79 64.92 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.783 0.833 . . . . 0.0 111.397 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -64.12 -24.57 67.74 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.596 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.43 82.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.086 0.555 . . . . 0.0 111.477 176.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -65.03 -43.59 91.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.197 0.599 . . . . 0.0 110.552 173.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -68.0 -22.64 64.99 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.95 0.9 . . . . 0.0 111.665 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.6 -3.68 56.49 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.916 0.886 . . . . 0.0 112.206 173.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.03 41.2 23.05 Favored Glycine 0 C--N 1.352 1.444 0 C-N-CA 122.937 0.303 . . . . 0.0 113.25 -178.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 1.8 mmt -130.19 -78.02 0.54 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.501 0.721 . . . . 0.0 110.879 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.74 94.39 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.262 0 C-N-CA 124.624 1.169 . . . . 0.0 112.69 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -74.27 158.02 45.3 Favored 'Trans proline' 0 CA--C 1.567 2.13 0 C-N-CA 122.533 2.155 . . . . 0.0 112.663 170.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -59.6 111.42 0.94 Allowed 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 122.295 1.997 . . . . 0.0 113.1 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 6.6 p -95.07 149.49 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.41 0 C-N-CA 123.914 0.886 . . . . 0.0 111.318 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.5 p -80.32 91.79 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.865 0 CA-C-O 122.259 1.028 . . . . 0.0 113.036 -173.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -70.48 -22.08 62.7 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -178.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -73.91 -17.61 61.01 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 71.6 m -124.92 -4.78 7.51 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 96.7 m -71.0 126.42 29.53 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.422 0.556 . . . . 0.0 111.388 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -85.38 157.74 20.43 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.549 0.74 . . . . 0.0 111.712 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -58.07 -31.83 67.45 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.804 1.242 . . . . 0.0 113.488 -176.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 73.4 m -60.87 -29.13 69.36 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.2 70.74 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.312 0.645 . . . . 0.0 112.611 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.18 -24.68 65.9 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.834 0.854 . . . . 0.0 111.995 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -68.42 -18.14 64.37 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.928 0.491 . . . . 0.0 111.678 178.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -102.81 -53.07 2.93 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.101 0.96 . . . . 0.0 110.803 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.7 HG21 ' HB3' ' A' ' 114' ' ' ASP . 0.9 OUTLIER -99.34 -37.22 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 C-N-CA 122.625 0.37 . . . . 0.0 111.901 -172.481 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.1 t 73.25 134.37 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 125.135 1.522 . . . . 0.0 110.817 -166.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.563 ' HA ' HD12 ' A' ' 115' ' ' LEU . 5.5 tt -45.88 -29.46 1.39 Allowed 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -175.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.62 -34.84 74.83 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.731 0.412 . . . . 0.0 112.07 -179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.7 ' HB3' HG21 ' A' ' 110' ' ' VAL . 27.7 t70 -73.74 -40.44 63.53 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.568 0.747 . . . . 0.0 111.073 177.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 112' ' ' LEU . 82.1 mt -54.93 -51.84 64.84 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.205 1.002 . . . . 0.0 111.36 173.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -75.34 -22.79 57.34 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.29 -1.323 . . . . 0.0 112.492 -176.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.23 -19.4 5.17 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 172.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -138.76 21.01 2.68 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 174.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -142.55 -172.82 3.71 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.772 -0.58 . . . . 0.0 111.329 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.0 pp -63.47 149.84 91.15 Favored Pre-proline 0 CA--C 1.562 1.421 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -177.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -77.56 149.41 27.05 Favored 'Trans proline' 0 C--N 1.379 2.156 0 C-N-CA 122.586 2.191 . . . . 0.0 112.444 174.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 8.7 p -100.98 120.18 50.15 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 CA-C-O 121.504 0.669 . . . . 0.0 109.652 171.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 49.3 tp -108.05 125.66 51.82 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.472 0.709 . . . . 0.0 110.018 176.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -83.74 162.63 20.61 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-O 121.296 0.569 . . . . 0.0 111.24 174.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -88.1 -66.31 0.93 Allowed 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 167.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -144.41 152.17 40.29 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.412 1.085 . . . . 0.0 108.706 171.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -63.52 -73.85 0.11 Allowed 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 121.177 0.513 . . . . 0.0 110.177 174.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -170.11 60.88 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.174 1.39 . . . . 0.0 108.484 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 67.5 m80 58.63 -93.29 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.071 1.348 . . . . 0.0 111.903 -170.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 . . . . . 0 CA--C 1.572 1.827 0 C-N-CA 124.697 1.199 . . . . 0.0 112.261 -175.179 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 120.482 0.182 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.1 -140.08 3.87 Favored Glycine 0 C--N 1.344 0.981 0 N-CA-C 112.028 -0.429 . . . . 0.0 112.028 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -94.91 89.38 5.61 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 117.996 0.898 . . . . 0.0 111.453 179.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -98.88 -153.76 28.41 Favored Glycine 0 N--CA 1.473 1.13 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 167.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -95.37 117.58 30.59 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 117.826 0.813 . . . . 0.0 109.973 174.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.5 p-10 -135.69 98.69 3.98 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.588 -178.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.8 t 61.13 -0.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.584 2.278 0 C-N-CA 125.891 1.677 . . . . 0.0 114.062 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.5 pp -89.1 5.06 46.26 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.928 0.891 . . . . 0.0 112.79 -174.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.79 -110.34 0.3 Allowed Glycine 0 CA--C 1.532 1.123 0 N-CA-C 111.773 -0.531 . . . . 0.0 111.773 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -142.41 123.39 14.45 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.751 0.821 . . . . 0.0 110.287 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -175.93 137.18 0.32 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.945 0.898 . . . . 0.0 110.248 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 63.91 -83.05 0.03 OUTLIER 'General case' 0 CA--C 1.568 1.652 0 C-N-CA 124.656 1.182 . . . . 0.0 110.484 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 52.2 94.78 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 125.22 1.408 . . . . 0.0 113.27 176.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 14.4 p -137.82 168.4 20.64 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.357 0 C-N-CA 123.54 0.736 . . . . 0.0 111.913 -164.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 45.9 t -69.34 -13.87 62.61 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.687 1.195 . . . . 0.0 112.424 172.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.9 t 82.96 131.26 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 126.409 1.884 . . . . 0.0 112.011 177.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.542 ' HB3' HG23 ' A' ' 21' ' ' THR . 39.8 t -171.6 -48.04 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.753 1.221 . . . . 0.0 109.344 -175.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -155.44 160.62 30.71 Favored Pre-proline 0 CA--C 1.557 1.228 0 C-N-CA 124.537 1.135 . . . . 0.0 109.42 176.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -44.32 -50.12 8.19 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 123.256 2.637 . . . . 0.0 114.947 172.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 23.7 ptp -88.05 -27.36 22.05 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.501 0.32 . . . . 0.0 111.023 173.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.542 HG23 ' HB3' ' A' ' 17' ' ' CYS . 90.1 m 65.22 -75.63 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 125.416 1.487 . . . . 0.0 112.179 -174.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -170.66 137.18 4.3 Favored Glycine 0 C--N 1.349 1.261 0 CA-C-O 119.597 -0.557 . . . . 0.0 112.474 -178.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -61.75 -25.8 67.68 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -76.26 81.14 3.03 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.259 0.623 . . . . 0.0 109.692 171.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? 62.52 85.93 0.12 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.763 1.225 . . . . 0.0 112.067 -171.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -59.27 -28.05 66.38 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.888 0.875 . . . . 0.0 111.204 176.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -96.3 63.38 1.18 Allowed Glycine 0 CA--C 1.538 1.494 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.645 170.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -52.5 107.67 0.23 Allowed 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.645 0.778 . . . . 0.0 111.755 168.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.6 t -89.01 58.46 4.57 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.315 0.579 . . . . 0.0 110.6 177.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 57.07 17.39 3.41 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 125.08 1.352 . . . . 0.0 113.189 -174.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 61.2 m -109.43 98.01 7.48 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.243 0.617 . . . . 0.0 111.154 -174.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -87.37 138.53 31.4 Favored 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 165.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.552 HG21 HH11 ' A' ' 108' ' ' ARG . 11.8 p -68.9 -31.09 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.429 0 C-N-CA 123.383 0.673 . . . . 0.0 112.708 -173.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -140.89 -43.4 0.39 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.066 0.546 . . . . 0.0 111.558 -175.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.4 t70 70.47 161.85 0.23 Allowed 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.277 1.431 . . . . 0.0 112.415 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -75.53 -51.83 12.04 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.981 0.512 . . . . 0.0 111.356 -179.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.97 -62.26 1.94 Allowed Glycine 0 C--N 1.35 1.332 0 CA-C-N 116.301 -0.408 . . . . 0.0 112.556 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.3 t -158.06 136.55 11.1 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.175 0.59 . . . . 0.0 110.864 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.5 p80 -56.8 149.9 17.31 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.854 0.862 . . . . 0.0 112.539 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.2 t -95.44 114.65 26.44 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 121.448 0.642 . . . . 0.0 111.54 -171.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.429 HG13 ' HB1' ' A' ' 82' ' ' ALA . 82.2 t -140.38 110.33 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.214 1.006 . . . . 0.0 108.747 174.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 71.9 m -95.99 105.53 17.57 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.533 ' HB1' HD11 ' A' ' 80' ' ' LEU . . . -143.38 151.25 40.2 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.084 1.354 . . . . 0.0 108.26 -178.429 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.542 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 24.2 tt0 -125.24 108.52 11.82 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.013 0.824 . . . . 0.0 112.245 -174.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 70.6 mtp -87.41 135.22 33.42 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.355 0.662 . . . . 0.0 109.522 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.547 HG22 ' HD1' ' A' ' 49' ' ' PHE . 0.9 OUTLIER -91.63 155.18 18.52 Favored 'General case' 0 N--CA 1.502 2.142 0 CA-C-N 118.154 0.433 . . . . 0.0 110.734 -179.952 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -56.11 -32.1 63.89 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.944 0.898 . . . . 0.0 113.024 -169.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -53.69 -45.04 70.24 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.584 0.707 . . . . 0.0 110.621 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.547 ' HD1' HG22 ' A' ' 46' ' ' THR . 86.7 m-85 -78.58 -35.16 46.23 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.958 1.303 . . . . 0.0 113.899 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.597 ' HB3' ' HE3' ' A' ' 61' ' ' MET . 6.9 mp -68.08 -42.22 80.71 Favored 'General case' 0 N--CA 1.499 2.011 0 CA-C-N 119.365 0.984 . . . . 0.0 110.727 177.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 83.5 mt -67.93 -37.34 81.53 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.072 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.412 ' HD2' ' SD ' ' A' ' 93' ' ' MET . 68.9 t80 -65.9 -39.35 90.52 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.261 0.624 . . . . 0.0 111.425 176.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 43.8 t -61.77 -44.68 96.41 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.612 0.765 . . . . 0.0 110.694 177.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -61.26 -47.37 86.35 Favored 'General case' 0 CA--C 1.559 1.304 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.278 175.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -71.73 -27.87 63.29 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 124.11 0.964 . . . . 0.0 112.284 -175.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.6 ttt85 -68.06 -44.21 76.89 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.643 0.777 . . . . 0.0 111.121 -175.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -96.19 -92.69 1.8 Allowed Glycine 0 CA--C 1.532 1.117 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.204 175.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -145.61 -59.27 0.33 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.765 1.226 . . . . 0.0 108.512 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -156.53 115.45 3.41 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.172 173.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 82.5 mt -119.37 7.73 11.27 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.338 0.655 . . . . 0.0 111.367 175.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.597 ' HE3' ' HB3' ' A' ' 50' ' ' LEU . 13.3 tmm? 176.78 111.72 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.09 1.356 . . . . 0.0 108.885 -178.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.5 m -93.38 105.95 18.19 Favored Pre-proline 0 N--CA 1.495 1.806 0 C-N-CA 122.783 0.433 . . . . 0.0 110.671 176.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -82.32 -49.77 0.05 OUTLIER 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.47 2.113 . . . . 0.0 113.504 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 75.8 mtt-85 66.31 136.02 0.04 OUTLIER Pre-proline 0 N--CA 1.493 1.702 0 C-N-CA 125.331 1.452 . . . . 0.0 113.041 -172.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.35 45.78 2.03 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 122.739 2.292 . . . . 0.0 112.753 172.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -136.54 163.71 29.89 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 125.713 1.605 . . . . 0.0 107.847 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -84.86 37.67 0.67 Allowed 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 123.355 0.662 . . . . 0.0 112.383 -175.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -66.75 -44.07 82.44 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 124.236 1.014 . . . . 0.0 112.436 -176.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.4 t80 63.84 100.0 0.04 OUTLIER Pre-proline 0 CA--C 1.564 1.494 0 C-N-CA 125.165 1.386 . . . . 0.0 112.705 -176.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -77.51 159.29 32.38 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 123.032 2.488 . . . . 0.0 112.846 169.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.49 112.3 4.7 Favored Glycine 0 C--N 1.352 1.458 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 171.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.5 mp 66.54 133.64 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.459 1.104 . . . . 0.0 111.175 -164.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.84 175.97 10.8 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.327 0.651 . . . . 0.0 111.623 -177.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.06 131.46 50.66 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -173.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 66.4 40.95 94.65 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.486 -0.779 . . . . 0.0 113.464 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -124.94 104.88 8.83 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 122.854 0.461 . . . . 0.0 110.247 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.542 ' HB2' ' HB2' ' A' ' 44' ' ' GLU . 0.1 OUTLIER -83.5 88.03 7.0 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 122.813 0.445 . . . . 0.0 110.024 174.934 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -168.61 120.79 0.81 Allowed 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 124.261 1.024 . . . . 0.0 110.115 177.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 39.3 t 53.36 26.4 5.32 Favored 'General case' 0 N--CA 1.5 2.066 0 C-N-CA 124.687 1.195 . . . . 0.0 112.937 174.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.533 HD11 ' HB1' ' A' ' 43' ' ' ALA . 3.1 tm? -62.77 131.39 48.73 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.451 1.1 . . . . 0.0 111.041 -176.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 42.6 t -63.06 101.4 0.28 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.644 0.778 . . . . 0.0 111.394 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.429 ' HB1' HG13 ' A' ' 41' ' ' VAL . . . -59.08 -25.95 64.23 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.722 0.809 . . . . 0.0 112.297 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.5 m -69.33 -39.88 77.92 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.718 0.807 . . . . 0.0 112.029 174.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -74.99 -32.76 61.74 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.172 0.589 . . . . 0.0 111.338 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.545 ' HE1' HD21 ' A' ' 115' ' ' LEU . 3.4 t-105 -65.1 -46.73 79.87 Favored 'General case' 0 CA--C 1.567 1.598 0 C-N-CA 123.456 0.702 . . . . 0.0 109.377 171.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -57.49 -44.45 84.96 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.12 0.968 . . . . 0.0 111.576 174.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -60.25 -34.82 74.24 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.056 0.942 . . . . 0.0 111.42 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.89 -39.12 87.38 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 122.927 0.491 . . . . 0.0 111.739 175.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.429 ' HA ' ' HB3' ' A' ' 94' ' ' ALA . 32.6 t80 -66.76 -39.78 88.0 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 121.074 0.464 . . . . 0.0 110.715 176.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -69.22 -28.44 66.35 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 123.728 0.811 . . . . 0.0 111.425 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.18 -5.68 57.99 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.852 0.861 . . . . 0.0 111.978 173.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 92.76 -20.94 41.91 Favored Glycine 0 C--N 1.353 1.497 0 N-CA-C 114.226 0.45 . . . . 0.0 114.226 177.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' MET . . . . . 0.412 ' SD ' ' HD2' ' A' ' 52' ' ' PHE . 6.3 ptm -71.27 -87.92 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.773 0 C-N-CA 124.03 0.932 . . . . 0.0 112.59 -177.08 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.429 ' HB3' ' HA ' ' A' ' 89' ' ' PHE . . . 61.58 112.67 0.02 OUTLIER Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 178.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -67.69 176.72 4.77 Favored 'Trans proline' 0 N--CA 1.507 2.304 0 C-N-CA 123.498 2.799 . . . . 0.0 113.661 170.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -82.01 134.47 8.23 Favored 'Trans proline' 0 C--N 1.381 2.267 0 C-N-CA 122.402 2.068 . . . . 0.0 111.897 166.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.9 p -122.79 143.74 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.912 0.885 . . . . 0.0 110.179 177.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.3 p -94.65 120.2 43.72 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.652 0 C-N-CA 123.216 0.606 . . . . 0.0 111.852 -178.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.4 mt -61.0 -45.82 93.28 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.161 0.985 . . . . 0.0 113.384 -176.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -75.14 14.75 0.5 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.988 0.915 . . . . 0.0 113.451 -172.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.2 t -137.39 -5.73 1.8 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 123.521 0.728 . . . . 0.0 112.07 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 53.5 m -91.24 124.2 35.26 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.029 0.532 . . . . 0.0 110.888 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.8 mp0 -66.39 154.6 39.71 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.001 0.52 . . . . 0.0 112.194 175.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.434 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 1.4 tmtp? -67.17 -19.32 65.56 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 123.633 0.773 . . . . 0.0 111.545 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 42.9 t -56.43 -26.68 54.35 Favored 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 123.715 0.806 . . . . 0.0 111.918 176.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.37 73.73 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.956 0.902 . . . . 0.0 112.692 174.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 10.6 mp -62.9 -6.82 4.16 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -173.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.552 HH11 HG21 ' A' ' 33' ' ' VAL . 59.6 mtp180 -83.67 -34.2 25.04 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 121.084 0.469 . . . . 0.0 111.526 172.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -102.21 -22.73 14.12 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.501 1.121 . . . . 0.0 111.524 -173.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.41 HG22 ' NE1' ' A' ' 85' ' ' TRP . 7.6 p -136.24 170.98 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 124.331 1.052 . . . . 0.0 108.756 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' SER . . . . . 0.495 ' HB3' ' HB2' ' A' ' 114' ' ' ASP . 28.7 t -92.97 151.29 20.0 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 121.747 -0.596 . . . . 0.0 111.277 170.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.9 tt -59.9 -44.63 94.16 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.551 0.34 . . . . 0.0 110.196 167.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.07 -30.65 69.35 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.298 0.639 . . . . 0.0 111.356 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.495 ' HB2' ' HB3' ' A' ' 111' ' ' SER . 5.5 t70 -67.1 -41.01 86.98 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.588 1.155 . . . . 0.0 110.45 175.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.545 HD21 ' HE1' ' A' ' 85' ' ' TRP . 71.3 mt -66.33 -53.48 35.88 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.845 0.858 . . . . 0.0 110.509 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.432 ' HA ' ' HB3' ' A' ' 119' ' ' ALA . 11.3 mt-30 -69.47 -28.03 65.74 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.445 1.098 . . . . 0.0 111.947 -173.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -55.2 -37.03 66.56 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.283 0.633 . . . . 0.0 112.43 171.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -113.22 30.26 7.34 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.757 0.823 . . . . 0.0 111.455 178.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.432 ' HB3' ' HA ' ' A' ' 116' ' ' GLN . . . -139.14 177.99 7.5 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -85.27 163.12 46.52 Favored Pre-proline 0 CA--C 1.562 1.418 0 C-N-CA 124.096 0.958 . . . . 0.0 111.962 177.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_exo -51.85 115.21 1.98 Allowed 'Trans proline' 0 C--N 1.375 1.956 0 C-N-CA 123.133 2.556 . . . . 0.0 113.748 162.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.3 p -86.26 129.48 38.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 122.618 0.367 . . . . 0.0 110.364 174.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.0 pp -151.6 143.34 23.69 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.342 0.657 . . . . 0.0 112.061 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -160.96 140.17 10.41 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.631 0.772 . . . . 0.0 110.981 174.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -157.71 131.35 7.89 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.931 0.492 . . . . 0.0 110.886 173.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -110.92 147.67 34.13 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.605 1.162 . . . . 0.0 108.798 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -144.28 -59.82 0.38 Allowed 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -173.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 56.7 m80 70.2 149.19 0.08 Allowed 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 124.863 1.265 . . . . 0.0 112.266 -168.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -99.03 125.82 44.6 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.505 0.722 . . . . 0.0 110.073 176.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 55.8 t60 . . . . . 0 CA--C 1.568 1.643 0 C-N-CA 123.404 0.682 . . . . 0.0 110.943 178.458 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.8 ttm . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 120.463 0.173 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.65 118.18 0.81 Allowed Glycine 0 CA--C 1.533 1.205 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 177.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -72.24 123.9 23.92 Favored 'General case' 0 CA--C 1.556 1.201 0 CA-C-N 117.326 0.563 . . . . 0.0 112.087 -177.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.66 141.82 32.65 Favored Glycine 0 CA--C 1.539 1.543 0 CA-C-N 115.918 -0.583 . . . . 0.0 113.521 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -147.53 155.6 42.02 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.345 0.658 . . . . 0.0 111.532 -176.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -117.35 177.3 4.79 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -170.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 m -89.65 -14.12 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 124.593 1.157 . . . . 0.0 111.325 -174.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 43.0 mt -62.73 -55.11 29.72 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.619 1.168 . . . . 0.0 112.914 -161.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 80.68 -51.48 4.27 Favored Glycine 0 N--CA 1.481 1.674 0 CA-C-O 121.589 0.549 . . . . 0.0 112.195 -174.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -151.66 119.67 6.24 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.153 1.381 . . . . 0.0 107.657 172.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -104.71 -24.56 12.92 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.026 0.53 . . . . 0.0 111.437 -174.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.59 98.49 1.16 Allowed 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.387 0.675 . . . . 0.0 109.898 174.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -74.94 170.11 16.62 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.81 0.444 . . . . 0.0 110.876 172.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.531 HG22 ' H ' ' A' ' 16' ' ' CYS . 10.6 p -143.75 130.77 17.27 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 CA-C-O 120.887 0.375 . . . . 0.0 111.627 -173.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 90.3 m -69.9 -15.49 63.08 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.542 0.737 . . . . 0.0 112.351 176.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.531 ' H ' HG22 ' A' ' 14' ' ' VAL . 60.6 m -71.62 -38.6 70.79 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 122.862 0.465 . . . . 0.0 112.081 174.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 52.8 t 66.93 -71.02 0.1 Allowed 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 125.47 1.508 . . . . 0.0 112.268 -174.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.516 ' H ' ' HD2' ' A' ' 19' ' ' PRO . . . -143.32 -49.23 0.02 OUTLIER Pre-proline 0 CA--C 1.572 1.799 0 C-N-CA 123.86 0.864 . . . . 0.0 112.733 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.516 ' HD2' ' H ' ' A' ' 18' ' ' ALA . 60.2 Cg_endo -68.1 160.3 49.3 Favored 'Trans proline' 0 C--N 1.399 3.204 0 C-N-CA 121.794 1.663 . . . . 0.0 113.797 174.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.0 57.53 2.43 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.231 1.012 . . . . 0.0 112.485 -167.474 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.8 t -69.76 -21.88 63.4 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 123.514 0.726 . . . . 0.0 112.56 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 170.36 -179.17 42.67 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-O 120.89 0.161 . . . . 0.0 113.426 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -94.09 -53.98 3.76 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.458 0.703 . . . . 0.0 109.856 175.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 67.57 -1.87 1.49 Allowed 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 125.84 1.656 . . . . 0.0 113.634 179.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 60.2 -70.12 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 125.548 1.539 . . . . 0.0 112.249 -173.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -61.51 -28.29 69.2 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.554 1.142 . . . . 0.0 112.001 175.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.68 -40.99 2.25 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.259 -176.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -126.94 96.59 4.67 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-O 121.925 0.869 . . . . 0.0 111.35 -177.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.0 p -172.36 -179.96 2.39 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.69 1.196 . . . . 0.0 110.619 178.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 63.74 83.06 0.17 Allowed 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.331 1.052 . . . . 0.0 111.619 -178.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 13.4 t -77.65 -13.39 59.92 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 171.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 60.49 -85.98 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 125.15 1.38 . . . . 0.0 112.446 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.402 HG23 ' HG2' ' A' ' 34' ' ' GLN 0.263 10.4 p 44.19 -68.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 C-N-CA 127.049 2.14 . . . . 0.0 115.348 -172.019 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.402 ' HG2' HG23 ' A' ' 33' ' ' VAL . 8.5 pt20 -174.29 -31.97 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 125.695 1.598 . . . . 0.0 108.91 -176.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -83.16 136.69 34.34 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 124.232 1.013 . . . . 0.0 111.821 -174.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -69.99 -33.09 71.61 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.709 0.804 . . . . 0.0 110.711 172.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.64 98.11 1.65 Allowed Glycine 0 CA--C 1.537 1.421 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.844 176.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.7 t -83.93 58.39 4.67 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.571 0.7 . . . . 0.0 111.346 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -132.3 31.1 4.12 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 124.598 1.159 . . . . 0.0 109.704 171.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.8 t -97.22 132.73 42.69 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.393 1.077 . . . . 0.0 111.935 -178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.556 HG13 ' HB1' ' A' ' 82' ' ' ALA . 42.3 t -139.5 110.6 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 C-N-CA 123.591 0.756 . . . . 0.0 110.618 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.8 m -108.23 106.92 17.31 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.64 ' HB3' HD13 ' A' ' 80' ' ' LEU . . . -142.27 151.31 41.91 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.45 0.7 . . . . 0.0 109.321 -168.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.469 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 29.1 tt0 -112.25 115.81 29.4 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.837 0.351 . . . . 0.0 111.667 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.407 ' HB3' HD13 ' A' ' 50' ' ' LEU . 75.5 mmm -95.19 114.84 26.68 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 170.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.694 ' HB ' ' HB2' ' A' ' 95' ' ' PRO . 92.4 m -83.56 147.73 27.59 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.34 0.656 . . . . 0.0 110.294 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.496 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 35.6 tt0 -47.31 -32.52 4.8 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -164.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -53.1 -41.87 65.39 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -76.08 -32.5 59.27 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.383 0.273 . . . . 0.0 111.595 175.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' A' ' 74' ' ' ALA . 5.3 mp -77.39 -22.54 51.48 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.803 0.441 . . . . 0.0 110.813 -177.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.496 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 70.2 mt -68.79 -46.82 67.72 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.811 1.244 . . . . 0.0 109.626 168.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -55.08 -48.77 73.08 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.427 1.091 . . . . 0.0 110.98 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -68.22 -28.46 67.27 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.117 0.967 . . . . 0.0 111.949 177.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.56 ' HA ' ' O ' ' A' ' 58' ' ' ASN . 50.0 ttt180 -69.23 -58.3 4.22 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.205 0.602 . . . . 0.0 111.833 -178.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -68.53 -11.58 60.08 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -176.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 58.2 ttt-85 -151.93 88.02 1.38 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.034 0.534 . . . . 0.0 109.681 173.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 151.95 -90.75 0.13 Allowed Glycine 0 C--N 1.353 1.485 0 CA-C-N 116.229 -0.441 . . . . 0.0 112.697 -179.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.56 ' O ' ' HA ' ' A' ' 54' ' ' ARG . 0.2 OUTLIER -139.93 156.83 46.48 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.735 0.814 . . . . 0.0 111.599 -177.701 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -63.19 -50.84 68.73 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -177.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.7 tm? 69.82 -70.46 0.14 Allowed 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 125.75 1.62 . . . . 0.0 111.544 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 56.6 mtt -61.38 -52.87 62.83 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.66 1.184 . . . . 0.0 112.898 -171.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.6 m 68.45 122.33 0.03 OUTLIER Pre-proline 0 N--CA 1.49 1.568 0 C-N-CA 124.46 1.104 . . . . 0.0 111.431 -179.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -78.0 41.38 1.0 Allowed 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 123.166 2.577 . . . . 0.0 114.051 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 75.1 mtp180 -120.64 142.57 34.5 Favored Pre-proline 0 N--CA 1.483 1.179 0 C-N-CA 124.517 1.127 . . . . 0.0 109.596 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -81.35 30.51 0.52 Allowed 'Trans proline' 0 C--N 1.376 2.001 0 C-N-CA 122.984 2.456 . . . . 0.0 112.932 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -125.04 126.55 45.57 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.996 1.318 . . . . 0.0 109.715 -170.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -112.26 82.91 1.71 Allowed 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.437 0.695 . . . . 0.0 109.494 -176.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -137.87 84.29 2.03 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.022 175.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -136.88 153.38 75.46 Favored Pre-proline 0 N--CA 1.487 1.425 0 C-N-CA 124.495 1.118 . . . . 0.0 110.338 -174.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -77.69 40.41 0.85 Allowed 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.853 2.369 . . . . 0.0 113.485 173.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -169.26 -144.08 4.11 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-N 116.652 -0.249 . . . . 0.0 113.008 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.458 HD12 ' HB3' ' A' ' 76' ' ' ASP . 2.3 pt? -140.75 -177.47 5.08 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.746 0.818 . . . . 0.0 111.34 -176.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.729 ' HG2' ' HB2' ' A' ' 76' ' ' ASP . 11.2 ptpt -106.5 -176.24 3.02 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.834 0.854 . . . . 0.0 111.973 -172.009 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.602 ' HA ' HD23 ' A' ' 50' ' ' LEU . . . -73.87 120.24 19.19 Favored 'General case' 0 CA--C 1.55 0.942 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.543 171.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 75.65 44.88 19.32 Favored Glycine 0 C--N 1.346 1.12 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.811 -176.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.729 ' HB2' ' HG2' ' A' ' 73' ' ' LYS . 14.5 t70 -119.93 149.14 42.6 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.227 0.611 . . . . 0.0 109.96 173.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.469 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -135.54 91.68 2.75 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.206 0.602 . . . . 0.0 110.787 -174.713 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -179.61 123.8 0.08 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.551 1.141 . . . . 0.0 109.454 173.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.2 t 54.57 30.86 13.89 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.392 1.077 . . . . 0.0 112.706 177.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.64 HD13 ' HB3' ' A' ' 43' ' ' ALA . 2.4 tm? -68.6 131.77 45.78 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.697 0.799 . . . . 0.0 110.538 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 60.8 m -60.26 106.93 0.58 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.133 0.973 . . . . 0.0 110.761 176.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.556 ' HB1' HG13 ' A' ' 41' ' ' VAL . . . -64.5 -24.8 67.73 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.6 t -64.0 -34.01 77.02 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 122.756 0.422 . . . . 0.0 111.741 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -63.07 -37.99 89.38 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.82 0.848 . . . . 0.0 110.978 176.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -75.14 -50.62 15.74 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 124.279 1.032 . . . . 0.0 111.155 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.447 ' HB2' HG12 ' A' ' 110' ' ' VAL . 19.6 tp60 -49.1 -44.29 42.01 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.952 0.901 . . . . 0.0 112.07 173.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -69.61 -30.01 67.65 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.48 -43.13 91.21 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 122.822 0.449 . . . . 0.0 111.911 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.548 ' HA ' ' HB1' ' A' ' 94' ' ' ALA . 80.0 t80 -64.68 -41.37 96.1 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.134 0.574 . . . . 0.0 111.127 176.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -67.07 -29.94 69.85 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.612 0.765 . . . . 0.0 112.647 175.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.48 -14.7 56.7 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.598 0.759 . . . . 0.0 111.914 175.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 78.58 7.51 88.04 Favored Glycine 0 C--N 1.352 1.448 0 CA-C-N 116.25 -0.432 . . . . 0.0 113.318 -174.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 94.6 mmm -104.2 17.82 23.33 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.227 1.011 . . . . 0.0 112.075 -177.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.548 ' HB1' ' HA ' ' A' ' 89' ' ' PHE . . . -52.06 108.56 1.1 Allowed Pre-proline 0 CA--C 1.569 1.701 0 C-N-CA 125.39 1.476 . . . . 0.0 114.439 178.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.694 ' HB2' ' HB ' ' A' ' 46' ' ' THR . 32.3 Cg_endo -86.56 168.06 8.6 Favored 'Trans proline' 0 CA--C 1.571 2.327 0 C-N-CA 123.06 2.507 . . . . 0.0 113.172 175.205 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.79 126.58 21.6 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.853 2.369 . . . . 0.0 114.803 176.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.2 p -115.43 175.61 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 125.381 1.472 . . . . 0.0 109.363 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.0 m -95.67 161.1 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.435 0 O-C-N 121.625 -0.672 . . . . 0.0 110.612 165.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.446 HD13 ' HG2' ' A' ' 116' ' ' GLN . 7.7 mt -113.44 -29.73 7.11 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.214 1.006 . . . . 0.0 108.889 161.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -59.43 -46.06 89.79 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.802 1.241 . . . . 0.0 112.082 -173.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.1 t -96.63 -23.83 16.3 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.008 178.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.7 m -63.49 110.1 1.85 Allowed 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 120.855 0.359 . . . . 0.0 111.482 175.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.0 mp0 -65.59 155.65 35.15 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.947 0.899 . . . . 0.0 112.11 178.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -66.86 -16.61 64.42 Favored 'General case' 0 N--CA 1.5 2.03 0 C-N-CA 123.45 0.7 . . . . 0.0 112.057 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.4 t -61.34 -26.34 67.74 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.095 0.958 . . . . 0.0 112.302 173.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.459 ' O ' HG23 ' A' ' 110' ' ' VAL . . . -54.66 -37.64 65.96 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.117 0.567 . . . . 0.0 112.084 174.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 7.0 mp -65.85 4.04 0.69 Allowed 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 124.956 1.303 . . . . 0.0 113.261 -176.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 65.1 mtp85 -98.69 -10.19 23.56 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.485 1.114 . . . . 0.0 110.848 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -121.06 -49.28 2.2 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.997 1.319 . . . . 0.0 108.611 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.804 HG21 HD23 ' A' ' 115' ' ' LEU . 32.6 m -90.1 -174.32 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 CA-C-O 122.101 0.953 . . . . 0.0 111.09 167.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.9 t -110.02 160.68 16.22 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.219 155.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.58 -36.91 62.42 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.252 0.621 . . . . 0.0 112.39 173.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.36 -30.74 71.4 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -177.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -61.47 -46.36 90.39 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.307 0.575 . . . . 0.0 110.12 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.804 HD23 HG21 ' A' ' 110' ' ' VAL . 5.9 mt -66.55 -56.58 10.17 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.431 -175.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.446 ' HG2' HD13 ' A' ' 99' ' ' LEU . 3.2 mt-30 -65.84 -24.65 66.94 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.479 -170.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -51.17 -40.32 58.37 Favored 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 172.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -140.7 21.52 2.33 Favored 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 123.258 0.623 . . . . 0.0 112.639 -176.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -73.26 -30.34 63.37 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.543 ' H ' HD21 ' A' ' 120' ' ' LEU . 2.3 pt? -110.91 165.67 12.25 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 123.707 0.803 . . . . 0.0 110.795 -175.262 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -49.19 91.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.378 2.082 0 C-N-CA 122.828 2.352 . . . . 0.0 113.135 161.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 4.9 p -115.52 131.07 68.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.986 0.915 . . . . 0.0 110.729 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.7 pp -141.63 157.56 44.93 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.796 0.838 . . . . 0.0 111.07 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -67.23 99.0 0.65 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 122.981 0.512 . . . . 0.0 110.754 176.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -115.17 3.8 14.43 Favored 'General case' 0 CA--C 1.562 1.414 0 C-N-CA 123.981 0.912 . . . . 0.0 111.045 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 68.18 133.83 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 125.06 1.344 . . . . 0.0 111.968 -173.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -85.36 123.37 30.75 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -174.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -153.28 106.6 2.99 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.562 1.145 . . . . 0.0 108.87 171.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 30.7 p80 -124.44 150.69 45.39 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 122.822 0.449 . . . . 0.0 111.672 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 19.6 p80 . . . . . 0 CA--C 1.57 1.727 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.872 174.326 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.8 mtt . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -78.57 69.39 2.83 Favored Glycine 0 CA--C 1.537 1.45 0 O-C-N 122.88 0.112 . . . . 0.0 113.087 177.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -155.57 151.66 27.85 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.998 0.919 . . . . 0.0 110.596 -177.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.97 108.92 0.36 Allowed Glycine 0 N--CA 1.476 1.348 0 C-N-CA 121.988 -0.148 . . . . 0.0 113.304 179.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -110.26 116.72 31.99 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.6 0.76 . . . . 0.0 109.226 176.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.493 ' H ' HD13 ' A' ' 8' ' ' LEU . 2.5 p-10 -158.78 98.99 1.53 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.225 0.61 . . . . 0.0 110.876 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.9 t 43.28 67.5 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.562 1.432 0 C-N-CA 125.639 1.576 . . . . 0.0 113.322 174.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.493 HD13 ' H ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -122.31 -14.06 7.96 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.592 0.757 . . . . 0.0 113.035 -173.974 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -53.0 -28.77 33.51 Favored Glycine 0 N--CA 1.479 1.516 0 N-CA-C 116.568 1.387 . . . . 0.0 116.568 -166.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -160.05 -175.16 4.93 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.935 0.894 . . . . 0.0 109.695 172.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 36.5 t70 63.29 92.35 0.06 Allowed 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 124.589 1.156 . . . . 0.0 112.48 174.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.9 166.74 21.99 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.02 0.928 . . . . 0.0 109.648 171.203 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -76.69 -171.37 1.86 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -171.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.603 ' HA ' ' HB2' ' A' ' 28' ' ' PHE . 3.8 p -52.43 107.69 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.563 1.451 0 C-N-CA 124.377 1.071 . . . . 0.0 113.049 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.453 ' SG ' ' HB3' ' A' ' 70' ' ' PRO . 81.6 m -85.65 -45.84 11.32 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.183 178.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -82.09 88.41 6.44 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.301 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 47.7 t -157.98 -56.63 0.07 Allowed 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.644 0.778 . . . . 0.0 110.936 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.51 ' HB1' ' HD3' ' A' ' 19' ' ' PRO . . . -109.01 -52.4 0.06 OUTLIER Pre-proline 0 CA--C 1.571 1.76 0 CA-C-O 118.65 -0.69 . . . . 0.0 111.329 174.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.51 ' HD3' ' HB1' ' A' ' 18' ' ' ALA . 20.0 Cg_exo -68.95 120.41 7.32 Favored 'Trans proline' 0 C--N 1.398 3.151 0 C-N-CA 121.981 1.787 . . . . 0.0 111.398 168.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.2 mmt -73.92 97.22 2.76 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.178 0.591 . . . . 0.0 111.136 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.5 p -78.3 -3.22 41.86 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.904 0.881 . . . . 0.0 112.035 175.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 168.4 -60.93 0.2 Allowed Glycine 0 C--N 1.342 0.894 0 N-CA-C 110.596 -1.002 . . . . 0.0 110.596 177.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 22.3 t90 -168.75 171.73 8.41 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 124.878 1.271 . . . . 0.0 108.65 176.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -67.29 86.22 0.16 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-O 121.511 0.672 . . . . 0.0 110.377 172.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -95.01 -55.61 3.03 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.535 0.734 . . . . 0.0 110.337 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -172.63 158.63 4.16 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.532 1.133 . . . . 0.0 108.02 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.17 110.42 2.68 Favored Glycine 0 CA--C 1.541 1.674 0 CA-C-O 119.611 -0.55 . . . . 0.0 112.773 173.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.603 ' HB2' ' HA ' ' A' ' 14' ' ' VAL . 56.7 t80 80.27 140.31 0.07 Allowed 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 125.267 1.427 . . . . 0.0 112.567 174.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 57.7 m -88.62 98.1 11.48 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.668 0.787 . . . . 0.0 110.564 178.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -86.48 142.32 28.46 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-O 121.302 0.572 . . . . 0.0 110.921 173.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.578 HG21 ' SG ' ' A' ' 42' ' ' CYS . 9.6 t -108.71 6.03 25.33 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.972 0.909 . . . . 0.0 110.193 175.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -90.2 173.2 8.29 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.571 1.149 . . . . 0.0 111.696 -168.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.2 m 51.87 15.07 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 C-N-CA 126.276 1.83 . . . . 0.0 115.193 177.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -115.34 -82.5 0.62 Allowed 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 175.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 54.98 51.29 13.79 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.495 1.118 . . . . 0.0 113.269 172.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -121.63 -6.99 9.15 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.578 0.751 . . . . 0.0 112.733 -174.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.4 80.83 0.82 Allowed Glycine 0 CA--C 1.537 1.459 0 N-CA-C 112.741 -0.144 . . . . 0.0 112.741 -172.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -130.0 -61.82 0.97 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.995 0.918 . . . . 0.0 111.162 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.9 p80 -161.11 18.08 0.12 Allowed 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 123.86 0.864 . . . . 0.0 111.028 -177.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 45.0 p -96.42 111.18 23.37 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.079 1.352 . . . . 0.0 111.639 -173.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.2 t -129.07 123.51 58.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.781 -0.574 . . . . 0.0 110.525 173.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.578 ' SG ' HG21 ' A' ' 31' ' ' THR . 71.9 m -119.95 108.91 14.9 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 167.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.669 ' HB1' HD12 ' A' ' 80' ' ' LEU . . . -138.96 147.93 42.87 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.851 0.86 . . . . 0.0 108.835 -174.057 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -112.17 118.76 36.22 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 117.796 0.271 . . . . 0.0 111.501 -172.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.505 ' SD ' ' HB2' ' A' ' 85' ' ' TRP . 75.7 mmm -101.88 129.86 48.22 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.501 0.72 . . . . 0.0 110.641 178.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 57.0 m -85.73 150.96 24.22 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.222 1.009 . . . . 0.0 110.412 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -47.92 -30.01 3.84 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.631 1.573 . . . . 0.0 114.432 -172.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -48.19 -55.15 11.13 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.164 0.986 . . . . 0.0 112.179 177.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -74.39 -33.74 63.12 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.277 -176.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.558 ' HB3' ' HE1' ' A' ' 61' ' ' MET . 6.8 mp -73.19 -35.61 66.39 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 117.914 0.324 . . . . 0.0 111.293 -176.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.572 HD22 ' HE2' ' A' ' 61' ' ' MET . 38.8 mt -74.16 -33.67 63.56 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.972 0.509 . . . . 0.0 110.995 173.29 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -58.28 -51.92 67.76 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.908 0.483 . . . . 0.0 110.664 171.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.4 m -63.12 -45.19 93.13 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.662 0.785 . . . . 0.0 111.745 -179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.59 ' HG3' ' HA ' ' A' ' 59' ' ' ASP . 50.8 ttt85 -60.27 -52.36 65.6 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.318 0.647 . . . . 0.0 111.4 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.33 -32.25 73.78 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.212 1.005 . . . . 0.0 111.851 178.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.4 ttp180 -66.7 -34.22 77.38 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.252 1.021 . . . . 0.0 112.037 178.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 130.16 21.62 1.18 Allowed Glycine 0 N--CA 1.479 1.539 0 N-CA-C 114.295 0.478 . . . . 0.0 114.295 177.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -88.48 -51.17 5.86 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.232 0.613 . . . . 0.0 109.919 172.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.59 ' HA ' ' HG3' ' A' ' 54' ' ' ARG . 2.5 m-20 65.42 -11.12 0.18 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 115.836 1.791 . . . . 0.0 115.836 176.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.8 tp -72.49 92.99 1.52 Allowed 'General case' 0 CA--C 1.552 1.023 0 CA-C-O 122.014 0.912 . . . . 0.0 110.892 -175.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.572 ' HE2' HD22 ' A' ' 51' ' ' LEU . 34.1 ttm -157.43 136.25 11.55 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.49 1.516 . . . . 0.0 107.052 177.278 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.4 m -59.81 105.93 0.65 Allowed Pre-proline 0 CA--C 1.563 1.474 0 C-N-CA 123.34 0.656 . . . . 0.0 111.379 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -92.3 -0.71 4.08 Favored 'Trans proline' 0 C--N 1.383 2.373 0 C-N-CA 123.225 2.617 . . . . 0.0 112.782 -178.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -100.08 130.63 25.75 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 124.402 1.081 . . . . 0.0 108.541 179.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.13 -18.72 63.5 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.884 2.389 . . . . 0.0 113.929 -172.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -76.06 116.69 17.01 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-O 121.02 0.438 . . . . 0.0 110.477 175.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -88.83 14.14 11.0 Favored 'General case' 0 CA--C 1.563 1.458 0 C-N-CA 123.682 0.793 . . . . 0.0 111.187 178.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.84 -37.13 73.3 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 125.326 1.451 . . . . 0.0 110.558 170.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -77.7 126.85 83.73 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 124.08 0.952 . . . . 0.0 110.792 -178.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . 0.453 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 40.2 Cg_endo -65.42 107.75 1.07 Allowed 'Trans proline' 0 C--N 1.378 2.112 0 C-N-CA 122.442 2.095 . . . . 0.0 111.946 176.299 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -164.04 133.19 2.94 Favored Glycine 0 C--N 1.34 0.8 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.582 178.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.8 127.09 31.68 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.149 0.58 . . . . 0.0 111.025 179.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.414 ' HD3' ' H ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -126.93 172.94 10.01 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.074 0.95 . . . . 0.0 109.589 178.256 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.41 111.23 2.57 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.304 0.641 . . . . 0.0 112.674 -172.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.85 20.8 25.28 Favored Glycine 0 CA--C 1.537 1.452 0 CA-C-N 115.648 -0.705 . . . . 0.0 113.431 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -95.99 134.02 39.51 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.565 0.746 . . . . 0.0 110.772 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.67 90.56 3.13 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.934 0.873 . . . . 0.0 111.791 172.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -173.96 121.4 0.3 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.485 1.114 . . . . 0.0 108.765 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 36.6 t 58.75 21.51 9.01 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.945 0.898 . . . . 0.0 112.374 177.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.669 HD12 ' HB1' ' A' ' 43' ' ' ALA . 3.2 tm? -68.87 112.92 5.85 Favored 'General case' 0 C--N 1.355 0.82 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 63.0 m -59.46 115.34 3.21 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.997 0.519 . . . . 0.0 109.967 176.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -56.28 -25.12 47.04 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -176.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.5 t -61.45 -33.32 73.54 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.623 0.769 . . . . 0.0 112.52 174.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -71.01 -40.21 71.93 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 123.852 0.861 . . . . 0.0 112.016 177.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.697 ' HE1' HD22 ' A' ' 115' ' ' LEU . 10.7 t-105 -68.84 -51.67 38.04 Favored 'General case' 0 CA--C 1.561 1.385 0 O-C-N 122.249 -0.282 . . . . 0.0 111.009 173.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.509 ' HB2' HG12 ' A' ' 110' ' ' VAL . 6.8 tp60 -48.43 -37.32 16.83 Favored 'General case' 0 CA--C 1.567 1.603 0 C-N-CA 124.167 0.987 . . . . 0.0 111.62 173.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -59.43 -44.04 92.98 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.634 1.174 . . . . 0.0 112.425 174.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.5 -36.6 73.9 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.149 0.58 . . . . 0.0 111.97 -173.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.7 ' HA ' ' HB3' ' A' ' 94' ' ' ALA . 65.5 t80 -66.02 -52.23 51.09 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.057 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -67.78 -22.52 65.19 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.92 -22.14 60.78 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.301 0.641 . . . . 0.0 111.528 171.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 102.26 -4.89 51.98 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 114.136 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 61.5 mtp -81.11 -70.14 0.55 Allowed 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 117.356 0.578 . . . . 0.0 109.909 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.7 ' HB3' ' HA ' ' A' ' 89' ' ' PHE . . . 57.21 92.05 0.07 OUTLIER Pre-proline 0 CA--C 1.557 1.224 0 C-N-CA 125.034 1.333 . . . . 0.0 113.54 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.42 ' HG2' ' HE1' ' A' ' 45' ' ' MET . 93.5 Cg_exo -55.06 159.25 10.02 Favored 'Trans proline' 0 CA--C 1.564 2.004 0 C-N-CA 123.049 2.499 . . . . 0.0 114.496 163.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.65 110.98 2.0 Favored 'Trans proline' 0 CA--C 1.558 1.699 0 C-N-CA 121.776 1.651 . . . . 0.0 110.999 163.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -95.24 157.15 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 123.245 0.618 . . . . 0.0 110.224 178.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.497 HG23 ' HB3' ' A' ' 101' ' ' SER . 28.1 m -73.48 147.28 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.149 0 C-N-CA 123.097 0.559 . . . . 0.0 111.175 171.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.442 HD22 ' HG2' ' A' ' 116' ' ' GLN . 0.6 OUTLIER -105.17 -30.25 9.83 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 167.766 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -80.52 -14.42 58.26 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.629 1.171 . . . . 0.0 113.338 -172.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.497 ' HB3' HG23 ' A' ' 98' ' ' VAL . 33.0 t -119.6 -24.69 6.17 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 122.759 0.424 . . . . 0.0 111.783 -179.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 85.5 m -63.31 106.3 0.87 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.747 0.419 . . . . 0.0 111.113 172.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -76.57 160.31 29.55 Favored 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 124.167 0.987 . . . . 0.0 110.702 -176.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -57.98 -23.36 53.51 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -174.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.6 m -59.23 -32.23 69.78 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 120.765 0.317 . . . . 0.0 111.628 176.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.416 ' O ' HG21 ' A' ' 110' ' ' VAL . . . -59.8 -36.36 76.58 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.556 0.742 . . . . 0.0 112.801 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.7 mp -65.47 5.49 0.41 Allowed 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 124.615 1.166 . . . . 0.0 113.495 -178.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 49.4 mtp180 -98.72 -26.01 14.49 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.044 0.938 . . . . 0.0 110.525 175.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -95.79 -53.15 3.8 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.731 1.212 . . . . 0.0 108.065 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.631 HG22 HD21 ' A' ' 115' ' ' LEU . 33.1 m -91.02 -171.54 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 122.207 1.003 . . . . 0.0 111.569 170.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 47.1 t -114.52 161.1 18.46 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.304 -1.316 . . . . 0.0 108.216 156.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.2 tt -53.88 -40.24 66.42 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.479 0.311 . . . . 0.0 110.97 168.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.89 -30.31 67.68 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.524 0.73 . . . . 0.0 112.43 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.57 -39.09 88.3 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.613 0.765 . . . . 0.0 110.298 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.697 HD22 ' HE1' ' A' ' 85' ' ' TRP . 23.4 mt -71.61 -53.67 12.92 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.738 -177.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.442 ' HG2' HD22 ' A' ' 99' ' ' LEU . 28.6 mt-30 -69.51 -27.16 64.95 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.445 -173.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -50.53 -54.54 21.62 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.878 0.871 . . . . 0.0 113.331 177.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 23.1 t-80 -99.9 -14.36 18.77 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -89.08 -93.82 0.11 Allowed 'General case' 0 CA--C 1.557 1.232 0 O-C-N 122.195 -0.316 . . . . 0.0 111.051 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 17.4 mt -141.24 159.37 61.5 Favored Pre-proline 0 N--CA 1.486 1.348 0 C-N-CA 123.463 0.705 . . . . 0.0 112.345 177.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -58.02 144.62 94.3 Favored 'Trans proline' 0 C--N 1.376 2.003 0 C-N-CA 123.809 3.006 . . . . 0.0 113.261 163.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.6 p -78.3 129.29 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 169.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.7 tt -76.02 104.35 6.51 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 173.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -150.9 143.11 24.15 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.812 0.845 . . . . 0.0 110.92 -177.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -72.65 118.16 15.24 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.045 0.538 . . . . 0.0 109.78 172.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -69.04 -35.41 76.56 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -169.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -83.85 92.95 7.89 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-O 121.287 0.565 . . . . 0.0 111.525 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -89.69 126.55 35.69 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.714 0.806 . . . . 0.0 109.205 171.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 25.8 p80 -139.26 -177.56 4.97 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.644 0.778 . . . . 0.0 111.271 -177.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 85.4 t60 . . . . . 0 CA--C 1.564 1.51 0 C-N-CA 123.453 0.701 . . . . 0.0 111.364 175.375 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 68.1 p . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 121.493 0.663 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.824 HG21 ' HB2' ' A' ' 82' ' ' ALA . 53.2 t -134.44 111.1 14.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.602 1.161 . . . . 0.0 109.516 175.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 78.2 m -107.44 106.69 17.21 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 169.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.555 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -143.76 152.39 41.19 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.679 1.191 . . . . 0.0 108.904 -175.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -117.54 109.57 16.87 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 121.638 -0.663 . . . . 0.0 111.71 -176.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.488 ' HB3' HD11 ' A' ' 50' ' ' LEU . 89.7 mmm -93.02 141.98 27.8 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.983 0.913 . . . . 0.0 110.838 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.4 p -93.78 156.84 16.45 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.025 0.53 . . . . 0.0 111.497 -176.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -68.15 -33.64 74.84 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.124 0.569 . . . . 0.0 111.713 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -53.61 -49.17 68.4 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 124.194 0.998 . . . . 0.0 111.307 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -77.48 -33.45 54.52 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.087 0.955 . . . . 0.0 111.864 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.488 HD11 ' HB3' ' A' ' 45' ' ' MET . 5.2 mp -77.6 -33.71 53.68 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 113.55 0.945 . . . . 0.0 113.55 -176.342 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 61.0 mt -71.97 -34.67 69.15 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.901 0.481 . . . . 0.0 110.713 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.418 ' CD2' ' SD ' ' A' ' 93' ' ' MET . 81.9 t80 -63.44 -52.55 61.01 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.074 0.549 . . . . 0.0 110.688 175.3 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.7 t . . . . . 0 N--CA 1.487 1.383 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.853 -178.57 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.027 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 109.3 -1.17 31.11 Favored Glycine 0 N--CA 1.474 1.208 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 175.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -74.77 93.8 2.65 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 117.55 0.675 . . . . 0.0 110.991 173.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -85.63 85.0 7.43 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 173.145 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.6 t90 163.11 127.7 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 125.27 1.428 . . . . 0.0 108.552 -171.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 51.4 t 52.28 27.3 4.64 Favored 'General case' 0 N--CA 1.505 2.294 0 C-N-CA 124.184 0.994 . . . . 0.0 112.744 174.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.555 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.6 tm? -66.11 130.41 43.14 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.216 -176.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.4 t -57.22 104.44 0.16 Allowed 'General case' 0 N--CA 1.474 0.732 0 O-C-N 123.638 0.586 . . . . 0.0 110.957 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.824 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -51.72 -35.72 44.13 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.652 1.181 . . . . 0.0 112.897 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.8 m -63.97 -32.81 74.48 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.055 0.942 . . . . 0.0 112.286 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -71.6 -47.75 52.72 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.246 0.618 . . . . 0.0 112.041 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.472 ' HE1' HD23 ' A' ' 115' ' ' LEU . 8.3 t-105 -59.21 -47.77 84.11 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.284 0.564 . . . . 0.0 109.966 174.743 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.411 HE21 ' HG3' ' A' ' 90' ' ' GLU . 22.6 tp60 -60.31 -39.15 85.99 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.923 177.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -65.32 -43.28 91.47 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.137 0.575 . . . . 0.0 111.556 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.86 -24.98 60.94 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.244 0.217 . . . . 0.0 111.446 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.597 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 49.1 t80 -66.87 -48.52 68.55 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-O 120.909 0.385 . . . . 0.0 110.331 171.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.411 ' HG3' HE21 ' A' ' 86' ' ' GLN . 39.8 mt-10 -65.5 -27.05 68.2 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.807 0.843 . . . . 0.0 112.109 177.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.73 -2.31 22.83 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.348 0.659 . . . . 0.0 112.465 174.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.39 23.0 63.79 Favored Glycine 0 C--N 1.355 1.631 0 CA-C-N 116.662 -0.245 . . . . 0.0 113.542 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' MET . . . . . 0.418 ' SD ' ' CD2' ' A' ' 52' ' ' PHE . 67.9 mtp -114.6 -86.06 0.6 Allowed 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 123.571 0.749 . . . . 0.0 111.129 -175.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.597 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 63.71 108.47 0.03 OUTLIER Pre-proline 0 CA--C 1.573 1.83 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 175.572 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -67.59 167.68 20.27 Favored 'Trans proline' 0 C--N 1.386 2.52 0 C-N-CA 123.367 2.711 . . . . 0.0 113.809 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.05 105.54 0.85 Allowed 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.396 2.064 . . . . 0.0 111.97 171.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.5 p -95.16 142.58 13.36 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 C-N-CA 123.631 0.773 . . . . 0.0 110.934 -176.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.9 m -75.14 94.55 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.834 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.424 HD11 ' HG2' ' A' ' 116' ' ' GLN . 3.3 mm? -58.9 -27.49 65.28 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 123.585 0.754 . . . . 0.0 112.352 173.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -69.62 -47.01 64.94 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.742 0.817 . . . . 0.0 112.085 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.6 t -92.97 -30.47 15.33 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -171.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.8 p -56.6 121.03 8.76 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 170.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -84.83 172.55 11.34 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.893 0.877 . . . . 0.0 112.106 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -72.55 -28.24 62.71 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 122.972 0.509 . . . . 0.0 111.015 -172.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.2 t -59.64 -25.97 65.13 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.63 0.772 . . . . 0.0 112.367 176.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.52 -37.65 70.73 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.885 0.874 . . . . 0.0 113.299 177.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.0 mp -65.81 2.78 0.93 Allowed 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -173.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 -98.4 -20.24 17.26 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 123.107 0.563 . . . . 0.0 111.618 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -109.07 -32.01 7.4 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.586 HG12 ' H ' ' A' ' 111' ' ' SER . 2.5 t -110.09 -166.06 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 CA-C-N 112.395 -2.184 . . . . 0.0 108.529 -178.318 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' SER . . . . . 0.586 ' H ' HG12 ' A' ' 110' ' ' VAL . 58.2 p -140.73 156.05 46.29 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 121.591 -0.693 . . . . 0.0 109.594 164.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.2 tt -53.5 -45.47 69.7 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.275 0.63 . . . . 0.0 112.114 173.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.17 -39.47 82.6 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.314 0.645 . . . . 0.0 111.997 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -64.52 -36.22 83.49 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.543 0.737 . . . . 0.0 112.02 175.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.472 HD23 ' HE1' ' A' ' 85' ' ' TRP . 39.2 mt -66.82 -55.58 14.2 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-O 121.214 0.53 . . . . 0.0 109.671 177.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLN . . . . . 0.424 ' HG2' HD11 ' A' ' 99' ' ' LEU . 2.8 mt-30 -64.75 -34.88 79.37 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.27 1.028 . . . . 0.0 112.213 -172.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.8 -40.69 69.77 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.901 0.88 . . . . 0.0 112.656 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -123.76 47.61 2.01 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.288 0.635 . . . . 0.0 110.36 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.967 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 175.975 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.425 ' HB ' ' HG2' ' A' ' 103' ' ' GLU . 26.4 m . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.961 0.41 . . . . 0.0 110.704 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.498 HG21 ' HB2' ' A' ' 82' ' ' ALA . 26.2 t -131.37 112.98 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 124.267 1.027 . . . . 0.0 110.426 -177.122 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 81.6 m -107.09 108.04 19.32 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 171.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.414 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -145.12 153.74 41.72 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.28 1.032 . . . . 0.0 109.138 -176.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.668 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 27.8 tt0 -119.12 107.76 13.86 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 118.708 0.685 . . . . 0.0 111.88 177.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.591 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 81.5 mmm -84.8 114.47 22.1 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.102 0.961 . . . . 0.0 109.035 166.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.6 t -80.94 151.61 28.45 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 122.86 0.464 . . . . 0.0 110.301 -176.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.406 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 28.8 tt0 -56.84 -33.62 66.97 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 123.558 0.536 . . . . 0.0 111.706 -175.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -50.76 -55.69 15.56 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 124.165 0.986 . . . . 0.0 110.99 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -79.67 -29.61 40.93 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 124.661 1.185 . . . . 0.0 113.189 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.1 tp -82.69 -24.49 33.65 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.304 0.641 . . . . 0.0 111.894 -173.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 47' ' ' GLU . 63.8 mt -64.92 -34.03 77.42 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 122.885 0.474 . . . . 0.0 110.55 171.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -58.31 -44.46 88.6 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.13 0.572 . . . . 0.0 110.899 169.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.1 m . . . . . 0 N--CA 1.491 1.577 0 C-N-CA 123.201 0.6 . . . . 0.0 111.777 175.495 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.07 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 82.43 56.94 2.71 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.952 -174.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -147.03 107.21 4.02 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 123.683 0.793 . . . . 0.0 110.462 176.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.668 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 4.8 ptp180 -79.78 89.83 5.23 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.245 0.618 . . . . 0.0 111.606 -176.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 31.3 t-105 -178.06 122.07 0.1 Allowed 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.789 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 42.3 t 52.36 53.82 11.72 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.155 0.982 . . . . 0.0 112.226 174.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.414 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.3 tm? -92.99 124.24 36.82 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.626 -175.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 61.5 m -59.39 111.97 1.58 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.023 0.529 . . . . 0.0 109.995 173.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.498 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -57.47 -27.29 62.36 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -171.183 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.8 m -69.59 -28.76 66.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.396 0.679 . . . . 0.0 112.266 176.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -61.89 -45.11 95.18 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.803 0.841 . . . . 0.0 111.325 175.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.591 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 1.3 t-105 -70.85 -47.92 56.73 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.63 174.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.48 HE21 ' HG3' ' A' ' 90' ' ' GLU . 21.2 tp60 -56.15 -42.79 77.56 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.098 0.959 . . . . 0.0 111.665 -177.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -55.31 -45.54 76.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.724 0.81 . . . . 0.0 111.574 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.21 -37.76 86.57 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.457 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.529 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 51.6 t80 -71.9 -34.41 69.11 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 122.439 0.296 . . . . 0.0 111.649 178.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.48 ' HG3' HE21 ' A' ' 86' ' ' GLN . 58.3 mt-10 -69.45 -23.11 63.63 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.206 0.602 . . . . 0.0 111.754 178.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.61 -11.37 59.66 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.558 0.743 . . . . 0.0 111.99 170.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.81 8.8 86.31 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-N 116.496 -0.32 . . . . 0.0 112.995 -174.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 25.9 ttt -88.13 -77.95 0.34 Allowed 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 124.313 1.045 . . . . 0.0 110.135 -174.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.529 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 61.94 114.18 0.02 OUTLIER Pre-proline 0 N--CA 1.497 1.905 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 167.002 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.443 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 92.6 Cg_endo -74.6 171.46 18.12 Favored 'Trans proline' 0 CA--C 1.572 2.39 0 C-N-CA 122.824 2.349 . . . . 0.0 113.152 171.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.38 111.15 2.65 Favored 'Trans proline' 0 C--N 1.383 2.394 0 C-N-CA 122.057 1.838 . . . . 0.0 111.778 171.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -97.35 134.26 35.96 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 123.065 0.546 . . . . 0.0 110.525 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.1 m -67.97 98.78 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 123.954 0.902 . . . . 0.0 113.231 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.553 HD21 ' HB3' ' A' ' 115' ' ' LEU . 3.6 mm? -73.57 -13.4 61.02 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.743 -0.598 . . . . 0.0 112.062 172.188 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -83.18 -12.45 56.89 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 124.273 1.029 . . . . 0.0 112.418 176.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.2 t -130.73 -26.35 2.23 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -174.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.3 p -55.33 106.0 0.21 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.407 0.622 . . . . 0.0 112.098 170.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.455 ' HG3' ' H ' ' A' ' 105' ' ' SER . 15.1 tp10 -61.77 141.28 58.0 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 125.09 1.356 . . . . 0.0 110.968 168.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.465 ' HA ' HD13 ' A' ' 107' ' ' LEU . 21.5 ptmt -61.33 -17.52 54.19 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -177.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.455 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 69.6 m -58.19 -27.33 63.78 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 123.186 0.594 . . . . 0.0 112.594 171.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.05 -28.29 68.96 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.573 0.749 . . . . 0.0 112.712 173.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' A' ' 104' ' ' LYS . 7.9 mp -70.31 1.99 4.31 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 124.29 1.036 . . . . 0.0 113.65 -175.313 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 48.3 mtp180 -88.75 -35.29 16.77 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.143 0.577 . . . . 0.0 111.235 167.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -91.34 -49.47 6.33 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.212 1.005 . . . . 0.0 110.361 -174.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.58 HG21 ' HE1' ' A' ' 85' ' ' TRP . 6.9 p -106.08 176.02 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.367 0 C-N-CA 124.407 1.083 . . . . 0.0 108.496 169.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 47.0 m -116.17 153.26 32.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.975 -1.078 . . . . 0.0 109.992 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.8 tt -57.09 -36.5 70.67 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.511 0.724 . . . . 0.0 112.603 179.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.22 -34.16 73.26 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.5 -36.72 79.31 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.499 0.719 . . . . 0.0 110.526 175.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.553 ' HB3' HD21 ' A' ' 99' ' ' LEU . 85.6 mt -68.35 -52.74 29.91 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.376 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -73.77 -27.86 61.37 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 114.73 -1.123 . . . . 0.0 112.672 -172.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -66.97 -17.16 64.79 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 175.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -130.42 20.01 5.24 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 123.383 0.673 . . . . 0.0 111.955 172.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.959 0 C-N-CA 123.644 0.778 . . . . 0.0 110.475 168.497 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 105' ' ' SER . 60.3 p . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 121.461 0.648 . . . . 0.0 110.35 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.737 HG11 ' HB2' ' A' ' 82' ' ' ALA . 39.3 t -136.26 102.65 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 C-N-CA 123.615 0.766 . . . . 0.0 109.982 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.566 ' SG ' ' HA ' ' A' ' 78' ' ' TRP . 80.2 m -111.18 107.39 16.71 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 174.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.483 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -138.57 150.4 46.28 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -172.209 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 20.7 tt0 -116.96 130.24 56.57 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.775 0.322 . . . . 0.0 111.246 -175.011 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.421 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 37.6 mtm -116.33 154.24 30.56 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.409 173.229 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.498 HG22 ' HB3' ' A' ' 95' ' ' PRO . 9.2 t -92.91 156.22 17.08 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.755 0.822 . . . . 0.0 110.517 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.436 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 37.1 tt0 -54.38 -32.69 57.63 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.198 0.599 . . . . 0.0 112.313 -175.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -48.99 -53.17 21.05 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.622 1.169 . . . . 0.0 112.351 -176.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.463 ' HA ' ' HD2' ' A' ' 52' ' ' PHE . 53.8 t80 -71.05 -40.6 71.58 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 177.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 45' ' ' MET . 8.9 mp -63.78 -24.52 67.79 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.827 0.451 . . . . 0.0 111.36 -178.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.436 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 92.8 mt -71.28 -45.87 62.15 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.924 0.889 . . . . 0.0 110.939 170.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.463 ' HD2' ' HA ' ' A' ' 49' ' ' PHE . 25.9 m-85 -58.35 -31.76 67.9 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 123.121 0.568 . . . . 0.0 111.258 174.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 58.5 m . . . . . 0 CA--C 1.548 0.884 0 CA-C-N 115.542 -0.753 . . . . 0.0 110.979 173.533 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.81 0 CA-C-O 120.648 0.261 . . . . 0.0 111.592 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.75 -2.61 70.03 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 114.41 0.524 . . . . 0.0 114.41 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -97.09 123.06 40.74 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.079 0.551 . . . . 0.0 110.539 173.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.48 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.1 OUTLIER -114.89 91.22 3.55 Favored 'General case' 0 CA--C 1.574 1.88 0 CA-C-O 121.919 0.866 . . . . 0.0 110.437 176.643 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.566 ' HA ' ' SG ' ' A' ' 42' ' ' CYS . 75.0 t90 -172.28 124.49 0.5 Allowed 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.318 0.647 . . . . 0.0 110.098 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 86.9 m 50.59 26.13 2.31 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.483 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -66.31 118.52 10.1 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 6.4 p -61.98 105.92 0.64 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 122.993 0.517 . . . . 0.0 110.564 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.737 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -55.16 -23.61 22.37 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.953 1.301 . . . . 0.0 113.775 -176.134 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.7 m -58.92 -38.77 79.7 Favored 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 123.503 0.721 . . . . 0.0 112.425 173.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.3 mmm-85 -74.97 -36.12 62.05 Favored 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 123.726 0.81 . . . . 0.0 112.433 178.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.567 ' HE1' HD23 ' A' ' 115' ' ' LEU . 7.7 t-105 -64.88 -45.8 84.47 Favored 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 173.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -57.94 -43.89 86.6 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.85 0.86 . . . . 0.0 110.792 173.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -55.28 -38.32 68.44 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.515 1.126 . . . . 0.0 112.024 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.34 94.03 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 174.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -68.26 -40.25 81.95 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 122.586 0.354 . . . . 0.0 111.48 174.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -63.48 -33.34 75.35 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.016 0.926 . . . . 0.0 111.785 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.29 -15.97 25.24 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 123.843 0.857 . . . . 0.0 112.138 175.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.87 -20.93 37.5 Favored Glycine 0 CA--C 1.542 1.779 0 N-CA-C 115.202 0.841 . . . . 0.0 115.202 175.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -89.79 33.08 0.86 Allowed 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 118.054 0.927 . . . . 0.0 113.023 -174.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.22 112.79 4.54 Favored Pre-proline 0 CA--C 1.569 1.679 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.498 ' HB3' HG22 ' A' ' 46' ' ' THR . 57.4 Cg_exo -59.83 171.51 2.8 Favored 'Trans proline' 0 CA--C 1.568 2.182 0 C-N-CA 123.947 3.098 . . . . 0.0 114.825 172.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -80.1 113.15 2.92 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.719 2.279 . . . . 0.0 111.983 168.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 9.7 p -99.25 156.78 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 123.884 0.873 . . . . 0.0 110.642 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.516 HG21 ' HB3' ' A' ' 101' ' ' SER . 33.3 m -81.44 164.32 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.096 0 CA-C-O 121.608 0.718 . . . . 0.0 112.228 173.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 83.5 mt -112.55 -13.78 13.28 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.973 0.909 . . . . 0.0 110.056 163.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -71.6 -70.47 0.32 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.735 0.814 . . . . 0.0 111.208 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.516 ' HB3' HG21 ' A' ' 98' ' ' VAL . 34.6 t -66.26 -31.55 72.43 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.219 0.608 . . . . 0.0 112.061 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 76.2 m -62.67 127.38 31.04 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.61 0.764 . . . . 0.0 111.938 175.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -98.97 164.27 12.25 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.891 0.877 . . . . 0.0 110.842 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.457 ' HD3' HD22 ' A' ' 107' ' ' LEU . 3.0 tppp? -53.5 -32.83 52.01 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 125.422 1.489 . . . . 0.0 113.595 176.398 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 40' ' ' THR . 56.7 m -60.5 -26.06 66.54 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 178.048 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.68 -33.45 72.87 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.393 0.677 . . . . 0.0 112.667 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.457 HD22 ' HD3' ' A' ' 104' ' ' LYS . 8.8 mp -61.65 -24.46 66.75 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.923 0.889 . . . . 0.0 112.264 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -74.34 -11.49 60.27 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.978 0.911 . . . . 0.0 112.81 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -116.3 -48.99 2.69 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.041 0.937 . . . . 0.0 111.708 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.481 HG21 ' CD1' ' A' ' 85' ' ' TRP . 14.8 p -113.25 -24.33 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -169.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 46.2 t 75.2 148.17 0.1 Allowed 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 125.112 1.365 . . . . 0.0 112.607 -173.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.494 ' HA ' HD12 ' A' ' 115' ' ' LEU . 3.8 tt -58.59 -39.05 79.29 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.487 1.115 . . . . 0.0 112.149 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.72 -38.83 70.28 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.278 0.631 . . . . 0.0 112.686 -176.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -67.17 -44.74 78.96 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.589 0.756 . . . . 0.0 110.373 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.567 HD23 ' HE1' ' A' ' 85' ' ' TRP . 63.8 mt -58.99 -46.86 87.09 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.814 0.816 . . . . 0.0 110.114 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -74.98 -29.96 61.05 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 114.131 -1.395 . . . . 0.0 112.828 -176.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.91 -19.31 60.34 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.341 170.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -123.33 6.49 9.05 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.788 0.835 . . . . 0.0 112.489 178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.431 0 C-N-CA 123.374 0.669 . . . . 0.0 111.296 177.101 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.4 p . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 121.313 0.578 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.422 HG11 ' N ' ' A' ' 82' ' ' ALA . 28.6 t -123.8 103.47 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.434 0.694 . . . . 0.0 110.126 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 80.8 m -113.78 108.17 16.72 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 173.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -142.28 152.55 43.12 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.084 0.953 . . . . 0.0 109.384 -167.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.463 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 27.0 tt0 -122.74 126.8 48.21 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.009 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.548 ' HB2' HD11 ' A' ' 50' ' ' LEU . 18.7 mtm -119.89 136.67 54.41 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.617 0.767 . . . . 0.0 109.509 173.127 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 6.2 t -98.68 160.73 14.07 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 123.005 0.522 . . . . 0.0 111.764 -172.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -53.13 -35.38 59.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.345 1.058 . . . . 0.0 113.051 -171.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -55.17 -46.68 75.78 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 122.266 1.031 . . . . 0.0 110.529 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -79.6 -35.82 38.99 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.949 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.548 HD11 ' HB2' ' A' ' 45' ' ' MET . 10.5 mp -68.57 -36.89 79.36 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 117.709 0.231 . . . . 0.0 111.589 178.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.9 mt -64.02 -31.7 72.99 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.312 0.645 . . . . 0.0 111.579 177.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.542 ' HE2' ' HB1' ' A' ' 91' ' ' ALA . 87.2 t80 -61.71 -46.77 88.26 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.621 0.368 . . . . 0.0 110.871 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 45.2 m . . . . . 0 N--CA 1.483 1.221 0 C-N-CA 123.298 0.639 . . . . 0.0 112.386 -178.138 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.977 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.59 38.71 4.9 Favored Glycine 0 N--CA 1.475 1.251 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.998 -177.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -122.73 107.59 12.09 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.385 1.074 . . . . 0.0 110.681 -176.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.463 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 16.4 ptt-85 -84.06 89.98 7.37 Favored 'General case' 0 CA--C 1.555 1.172 0 CA-C-O 122.027 0.918 . . . . 0.0 111.559 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -138.16 -163.77 1.51 Allowed 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 125.251 1.421 . . . . 0.0 108.844 175.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 26.0 p -55.9 81.09 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 122.167 0.984 . . . . 0.0 111.246 169.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -85.28 -25.84 26.99 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.919 1.288 . . . . 0.0 110.118 -175.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 52.4 t 68.02 123.36 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.041 1.336 . . . . 0.0 111.148 -173.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.422 ' N ' HG11 ' A' ' 41' ' ' VAL . . . -55.69 -24.47 34.52 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.79 0.836 . . . . 0.0 112.658 -177.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.4 t -54.12 -47.08 72.21 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.985 0.914 . . . . 0.0 112.693 173.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -41.55 85.42 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 123.531 0.732 . . . . 0.0 112.536 -178.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.47 ' NE1' HG21 ' A' ' 110' ' ' VAL . 9.8 t-105 -71.35 -43.69 66.49 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 124.043 0.937 . . . . 0.0 110.535 -177.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -65.77 -37.66 86.92 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.936 0.895 . . . . 0.0 111.633 175.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.72 -44.16 97.46 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.54 0.736 . . . . 0.0 111.06 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.51 -30.1 71.13 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.46 0.704 . . . . 0.0 111.461 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.481 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 86.8 t80 -68.77 -46.4 68.87 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 123.01 0.524 . . . . 0.0 111.299 174.008 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -71.79 -16.6 62.19 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.459 0.704 . . . . 0.0 112.242 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.542 ' HB1' ' HE2' ' A' ' 52' ' ' PHE . . . -75.21 -2.7 29.14 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 123.7 0.8 . . . . 0.0 111.589 168.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 84.61 15.65 67.83 Favored Glycine 0 C--N 1.355 1.623 0 C-N-CA 123.63 0.634 . . . . 0.0 113.72 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.2 mmm -118.81 -79.04 0.59 Allowed 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.142 0.577 . . . . 0.0 112.057 -171.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.481 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 63.99 102.26 0.04 OUTLIER Pre-proline 0 N--CA 1.493 1.683 0 C-N-CA 125.0 1.32 . . . . 0.0 113.8 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.404 ' HG3' ' HB3' ' A' ' 45' ' ' MET . 59.6 Cg_endo -67.94 168.98 17.32 Favored 'Trans proline' 0 N--CA 1.504 2.131 0 C-N-CA 123.84 3.027 . . . . 0.0 114.954 177.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.99 109.69 1.77 Allowed 'Trans proline' 0 C--N 1.379 2.177 0 C-N-CA 122.658 2.239 . . . . 0.0 112.197 168.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.7 p -95.2 152.31 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.222 0.609 . . . . 0.0 110.592 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.5 p -90.75 105.42 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.422 0 CA-C-O 121.734 0.778 . . . . 0.0 110.937 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.519 HD21 ' HA ' ' A' ' 116' ' ' GLN . 5.8 mp -69.32 -40.54 77.55 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.737 1.215 . . . . 0.0 112.262 -171.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -68.62 -27.54 66.11 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.367 0.667 . . . . 0.0 111.86 -176.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 30.6 t -84.09 -29.64 26.63 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.198 0.599 . . . . 0.0 110.685 174.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 90.6 m -74.63 101.49 4.26 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.17 0.588 . . . . 0.0 110.414 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -67.97 156.6 36.92 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.56 0.744 . . . . 0.0 111.126 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.606 ' HA ' HD13 ' A' ' 107' ' ' LEU . 0.6 OUTLIER -63.12 -14.32 47.18 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.092 0.957 . . . . 0.0 113.129 -174.902 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 40.4 t -57.16 -39.22 74.83 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.226 0.61 . . . . 0.0 111.814 171.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.43 -22.37 61.11 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.916 0.886 . . . . 0.0 112.877 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.606 HD13 ' HA ' ' A' ' 104' ' ' LYS . 7.2 mp -63.97 -22.4 66.91 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 123.93 0.892 . . . . 0.0 112.199 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -78.55 -15.08 58.98 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.251 0.62 . . . . 0.0 111.268 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -110.97 -17.06 13.38 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.621 1.168 . . . . 0.0 113.334 -175.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.47 HG21 ' NE1' ' A' ' 85' ' ' TRP . 7.4 p -144.52 -23.76 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.0 t 80.34 139.74 0.07 Allowed 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 125.461 1.504 . . . . 0.0 112.851 -176.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.82 -38.19 87.26 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.535 1.134 . . . . 0.0 112.298 173.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.87 -32.43 69.46 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.153 0.581 . . . . 0.0 112.303 -175.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.78 -39.34 76.68 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.894 174.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.425 ' HB3' ' HG ' ' A' ' 99' ' ' LEU . 64.5 mt -69.16 -45.39 70.17 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.586 0.754 . . . . 0.0 110.298 -172.165 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLN . . . . . 0.519 ' HA ' HD21 ' A' ' 99' ' ' LEU . 61.1 mm-40 -62.64 -43.74 98.04 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.621 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -61.46 -29.83 70.21 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 115.264 -0.88 . . . . 0.0 113.216 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 48.1 m80 -91.67 -17.37 25.59 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 121.253 0.549 . . . . 0.0 111.002 168.02 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.0 p . . . . . 0 CA--C 1.563 1.447 0 CA-C-O 121.243 0.544 . . . . 0.0 112.16 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.1 t -131.53 137.08 56.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.282 0.633 . . . . 0.0 110.261 174.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 74.7 m -131.03 111.24 11.84 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.775 0.83 . . . . 0.0 110.051 174.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.549 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -141.28 151.92 44.06 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.826 0.851 . . . . 0.0 109.54 -172.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.619 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 23.8 tt0 -119.86 108.35 14.26 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 122.245 -0.284 . . . . 0.0 111.642 -176.152 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.553 ' SD ' ' HG3' ' A' ' 84' ' ' ARG . 56.2 mtp -93.38 130.02 39.32 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.053 0.541 . . . . 0.0 110.228 170.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.8 p -83.3 167.71 17.35 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.568 0.747 . . . . 0.0 109.578 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -62.75 -37.01 84.9 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 118.403 0.547 . . . . 0.0 110.842 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -54.31 -55.53 27.49 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 124.018 0.927 . . . . 0.0 111.544 176.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -78.13 -29.98 49.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.796 -176.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.11 -38.87 60.98 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.471 0.708 . . . . 0.0 110.237 -177.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 28.1 mt -62.91 -47.68 82.21 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.634 0.774 . . . . 0.0 110.778 169.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -65.01 -42.05 94.79 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -174.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 N--CA 1.492 1.665 0 C-N-CA 123.263 0.625 . . . . 0.0 110.773 177.559 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.394 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 67.57 40.9 90.68 Favored Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.627 -0.589 . . . . 0.0 111.627 -168.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -138.27 97.42 3.38 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 124.152 0.981 . . . . 0.0 109.013 -174.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.619 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 39.0 ptt85 -89.14 85.33 6.63 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.709 0.766 . . . . 0.0 112.716 -174.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 -159.26 120.42 3.27 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.474 0.71 . . . . 0.0 110.122 -173.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.0 t 62.47 9.83 3.63 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 170.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.549 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -67.6 110.63 3.78 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 44.1 t -61.44 132.41 53.34 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.372 0.669 . . . . 0.0 111.199 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.42 -22.81 62.0 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.6 m -58.27 -41.58 84.64 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 118.362 0.528 . . . . 0.0 112.04 172.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.553 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 6.9 tpm_? -69.2 -41.49 77.04 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.334 1.054 . . . . 0.0 111.841 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.463 ' NE1' HG11 ' A' ' 110' ' ' VAL . 0.5 OUTLIER -74.25 -54.6 7.38 Favored 'General case' 0 CA--C 1.563 1.457 0 C-N-CA 123.6 0.76 . . . . 0.0 110.841 179.571 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.492 ' HB2' HG12 ' A' ' 110' ' ' VAL . 32.4 tp60 -49.95 -40.68 44.54 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 177.004 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -61.79 -41.1 97.3 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 120.68 0.276 . . . . 0.0 111.049 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.5 70.6 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.927 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.69 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 54.0 t80 -67.03 -43.45 82.74 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.75 0.82 . . . . 0.0 110.782 171.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -69.4 -31.59 70.06 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.167 0.587 . . . . 0.0 112.466 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -78.96 -11.51 60.01 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.654 0.782 . . . . 0.0 111.577 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 107.1 -16.79 38.62 Favored Glycine 0 C--N 1.352 1.439 0 N-CA-C 114.934 0.734 . . . . 0.0 114.934 170.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -73.97 -70.43 0.39 Allowed 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 117.918 0.859 . . . . 0.0 111.021 -177.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.69 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 60.52 97.98 0.04 OUTLIER Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 124.745 1.218 . . . . 0.0 113.291 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.445 ' HB2' ' O ' ' A' ' 44' ' ' GLU . 94.5 Cg_endo -71.28 168.97 21.89 Favored 'Trans proline' 0 CA--C 1.568 2.182 0 C-N-CA 123.391 2.727 . . . . 0.0 113.563 175.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -66.46 118.64 5.69 Favored 'Trans proline' 0 C--N 1.381 2.276 0 C-N-CA 122.421 2.081 . . . . 0.0 112.784 176.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.602 HG13 ' HB2' ' A' ' 119' ' ' ALA . 7.7 p -105.97 158.27 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 123.497 0.719 . . . . 0.0 109.323 173.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.534 HG11 ' HD2' ' A' ' 77' ' ' ARG . 3.4 p -115.65 108.24 24.76 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 O-C-N 121.675 -0.641 . . . . 0.0 112.508 -170.405 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.442 ' HG ' ' HB1' ' A' ' 119' ' ' ALA . 97.0 mt -69.07 -28.91 66.95 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -83.67 40.0 0.71 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.607 0.763 . . . . 0.0 111.748 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.45 ' HB3' HG13 ' A' ' 98' ' ' VAL . 22.4 t -170.12 -24.67 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 124.521 1.129 . . . . 0.0 110.852 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.401 ' OG1' ' HA ' ' A' ' 99' ' ' LEU . 33.6 p -74.77 -176.84 3.0 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.729 0.776 . . . . 0.0 112.186 172.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -148.76 171.85 15.56 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.03 -177.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.525 ' HA ' HD13 ' A' ' 107' ' ' LEU . 0.5 OUTLIER -62.74 -17.72 61.38 Favored 'General case' 0 CA--C 1.564 1.512 0 C-N-CA 124.256 1.022 . . . . 0.0 110.98 167.888 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.2 m -57.56 -36.18 71.33 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.495 1.118 . . . . 0.0 112.255 169.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.456 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -63.49 -36.36 83.51 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.948 0.499 . . . . 0.0 111.236 176.116 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.5 mp -68.05 5.75 0.86 Allowed 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 124.906 1.282 . . . . 0.0 113.584 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -86.86 -23.72 25.16 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.526 0.73 . . . . 0.0 110.182 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -107.71 -50.92 2.98 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.717 1.207 . . . . 0.0 108.758 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.492 HG12 ' HB2' ' A' ' 86' ' ' GLN . 33.8 m -97.06 -172.67 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 CA-C-O 122.289 1.042 . . . . 0.0 111.919 176.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.1 t -113.97 158.52 21.04 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.347 158.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.509 ' HA ' HD12 ' A' ' 115' ' ' LEU . 2.5 tt -55.95 -34.98 66.16 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 122.518 0.327 . . . . 0.0 110.761 170.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.35 73.72 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.185 0.594 . . . . 0.0 112.308 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -73.09 -33.91 65.88 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 120.841 0.353 . . . . 0.0 110.183 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 112' ' ' LEU . 87.7 mt -68.35 -56.88 6.99 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 123.73 0.812 . . . . 0.0 110.634 178.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLN . . . . . 0.429 ' HG2' HD11 ' A' ' 99' ' ' LEU . 7.1 mt-30 -64.62 -30.94 71.96 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.418 1.087 . . . . 0.0 112.315 -170.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -52.3 -30.42 28.1 Favored 'General case' 0 CA--C 1.563 1.443 0 C-N-CA 123.89 0.876 . . . . 0.0 112.87 171.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -135.72 27.7 3.31 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 123.886 0.874 . . . . 0.0 112.488 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.602 ' HB2' HG13 ' A' ' 97' ' ' VAL . . . . . . . . 0 N--CA 1.497 1.89 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -177.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 40.7 p . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 121.325 0.583 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.435 HG11 ' HB2' ' A' ' 82' ' ' ALA . 21.4 t -135.16 102.22 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 C-N-CA 123.974 0.91 . . . . 0.0 109.334 171.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 61.6 m -108.03 104.3 13.72 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 170.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.427 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.73 144.01 32.5 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.325 1.05 . . . . 0.0 109.778 -173.449 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.503 ' HG3' ' HB3' ' A' ' 77' ' ' ARG . 1.7 mp0 -102.63 107.5 18.43 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 122.165 -0.335 . . . . 0.0 110.611 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.596 ' SD ' HD21 ' A' ' 80' ' ' LEU . 63.8 mtp -91.06 137.75 32.13 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 169.527 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.7 p -82.77 159.51 22.49 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 121.339 0.59 . . . . 0.0 111.713 -174.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -60.85 -28.6 68.95 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.54 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -50.98 -54.4 24.78 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.975 0.91 . . . . 0.0 112.096 174.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -74.86 -36.43 62.33 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.46 -26.8 65.67 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -78.59 -34.39 46.83 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.69 0.796 . . . . 0.0 110.877 168.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -62.31 -31.49 72.11 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 122.552 0.341 . . . . 0.0 110.631 170.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.3 m . . . . . 0 N--CA 1.485 1.297 0 C-N-CA 123.412 0.685 . . . . 0.0 110.757 175.932 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.373 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 83.53 -7.82 67.44 Favored Glycine 0 CA--C 1.543 1.809 0 N-CA-C 114.973 0.749 . . . . 0.0 114.973 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -113.02 148.18 35.66 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.33 0.652 . . . . 0.0 111.073 -178.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.503 ' HB3' ' HG3' ' A' ' 44' ' ' GLU . 27.1 ptt180 -111.12 101.76 10.26 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.544 0.738 . . . . 0.0 111.282 -177.194 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -163.41 118.83 1.68 Allowed 'General case' 0 N--CA 1.483 1.203 0 O-C-N 121.712 -0.617 . . . . 0.0 111.599 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.6 t 51.61 27.96 4.36 Favored 'General case' 0 N--CA 1.5 2.033 0 C-N-CA 123.93 0.892 . . . . 0.0 112.391 174.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.596 HD21 ' SD ' ' A' ' 45' ' ' MET . 3.1 tm? -66.3 126.69 29.55 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.939 0.895 . . . . 0.0 110.56 -171.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.418 ' SG ' ' HB2' ' A' ' 83' ' ' SER . 43.4 t -64.16 101.3 0.4 Allowed 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 122.924 0.49 . . . . 0.0 110.863 177.469 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.435 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -56.86 -24.74 53.79 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.86 0.864 . . . . 0.0 113.018 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.418 ' HB2' ' SG ' ' A' ' 81' ' ' CYS . 54.4 m -61.61 -48.88 78.9 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.851 0.46 . . . . 0.0 111.296 171.269 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -59.35 -39.01 81.83 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 122.707 0.403 . . . . 0.0 112.061 179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.748 ' HE1' HD23 ' A' ' 115' ' ' LEU . 13.1 t-105 -66.63 -52.71 42.13 Favored 'General case' 0 CA--C 1.569 1.689 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.132 174.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.467 ' HB2' HG12 ' A' ' 110' ' ' VAL . 34.2 tp60 -49.54 -47.28 49.17 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 176.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -35.44 77.52 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.576 0.75 . . . . 0.0 111.903 177.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.407 ' HB1' ' HA ' ' A' ' 94' ' ' ALA . . . -61.9 -39.12 90.9 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.097 0.559 . . . . 0.0 111.89 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.603 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 68.8 t80 -60.42 -51.73 68.24 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.164 0.507 . . . . 0.0 110.771 175.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -71.6 -19.49 62.12 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.476 -177.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.28 -11.45 46.44 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.692 0.797 . . . . 0.0 112.36 175.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.96 10.4 85.12 Favored Glycine 0 CA--C 1.542 1.757 0 N-CA-C 114.091 0.396 . . . . 0.0 114.091 -176.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 94.2 mmm -112.83 27.98 9.17 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.346 1.058 . . . . 0.0 110.725 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.603 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -67.76 117.45 48.15 Favored Pre-proline 0 CA--C 1.558 1.276 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 -178.581 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 94' ' ' ALA . 52.6 Cg_endo -67.05 174.81 6.35 Favored 'Trans proline' 0 CA--C 1.566 2.093 0 C-N-CA 123.074 2.516 . . . . 0.0 113.079 168.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.1 145.62 55.7 Favored 'Trans proline' 0 C--N 1.376 1.981 0 C-N-CA 121.522 1.481 . . . . 0.0 112.169 166.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.402 HG23 ' HB1' ' A' ' 43' ' ' ALA . 11.8 p -131.62 153.37 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.735 0.814 . . . . 0.0 108.99 174.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.532 HG21 ' HB3' ' A' ' 101' ' ' SER . 30.8 m -85.63 165.84 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-O 121.144 0.497 . . . . 0.0 111.302 173.214 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 86.4 mt -107.13 -26.06 11.28 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.609 0.764 . . . . 0.0 110.676 169.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -74.39 -60.33 2.32 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.503 0.721 . . . . 0.0 111.479 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.532 ' HB3' HG21 ' A' ' 98' ' ' VAL . 40.8 t -77.35 -25.33 50.94 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 179.297 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.492 ' H ' HG23 ' A' ' 98' ' ' VAL . 88.6 m -73.83 105.39 5.09 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 172.223 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -78.26 160.61 27.81 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.454 -175.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.535 ' HA ' HD13 ' A' ' 107' ' ' LEU . 27.9 mmtp -71.66 -12.85 61.54 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -169.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 16.6 t -61.94 -25.54 67.65 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 122.983 0.513 . . . . 0.0 111.369 170.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.446 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -57.02 -33.99 67.73 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.626 0.77 . . . . 0.0 112.888 172.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.535 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.4 mp -65.73 5.64 0.43 Allowed 'General case' 0 N--CA 1.503 2.224 0 C-N-CA 124.813 1.245 . . . . 0.0 113.588 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 46.2 mtp180 -94.57 -19.15 20.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.714 0.805 . . . . 0.0 110.28 175.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 34.7 m-85 -106.94 -51.4 2.93 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.099 1.359 . . . . 0.0 108.673 178.127 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.467 HG12 ' HB2' ' A' ' 86' ' ' GLN . 33.0 m -92.55 -170.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.017 170.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.3 t -120.27 163.46 17.76 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 114.638 -1.164 . . . . 0.0 108.103 155.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.7 tt -56.79 -31.87 65.1 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.571 0.349 . . . . 0.0 111.238 173.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.2 -41.44 79.36 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.702 0.801 . . . . 0.0 112.756 178.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -70.09 -33.54 72.01 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.192 0.597 . . . . 0.0 110.519 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.748 HD23 ' HE1' ' A' ' 85' ' ' TRP . 80.4 mt -67.69 -54.88 15.89 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.639 178.017 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -63.45 -37.07 85.89 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.341 1.056 . . . . 0.0 112.056 -175.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.78 -21.94 12.71 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -130.12 21.5 5.31 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.6 0.76 . . . . 0.0 111.681 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.552 0 C-N-CA 123.837 0.855 . . . . 0.0 111.926 176.742 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.519 ' HB ' ' HB3' ' A' ' 105' ' ' SER . 1.7 m . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.531 HG22 ' HA ' ' A' ' 106' ' ' ALA . 34.5 t -138.41 100.4 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.978 0 C-N-CA 124.662 1.185 . . . . 0.0 110.206 -174.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 62.8 m -101.14 103.63 14.7 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 166.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.429 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -134.55 147.48 50.29 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 -176.028 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.436 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 26.1 tt0 -120.29 109.55 15.52 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.213 0.53 . . . . 0.0 111.258 -169.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.588 ' HB2' HD11 ' A' ' 50' ' ' LEU . 73.6 mmm -93.94 150.93 19.93 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.22 1.008 . . . . 0.0 110.656 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 70.2 p -82.94 155.88 23.79 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 171.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.565 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 24.5 tt0 -58.98 -27.37 65.33 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.837 0.455 . . . . 0.0 112.015 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -49.06 -38.4 24.06 Favored 'General case' 0 CA--C 1.566 1.591 0 C-N-CA 123.923 0.889 . . . . 0.0 111.816 170.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -73.56 -53.03 11.5 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 172.176 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.0 mp -66.76 -25.51 66.53 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -170.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.565 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 92.1 mt -73.57 -40.5 63.87 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.891 0.876 . . . . 0.0 110.76 171.029 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -60.71 -46.73 89.26 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.312 0.645 . . . . 0.0 110.958 174.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.1 t . . . . . 0 N--CA 1.481 1.094 0 C-N-CA 123.627 0.771 . . . . 0.0 111.805 -179.638 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.94 0 CA-C-O 121.18 0.514 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 116.16 31.29 1.9 Allowed Glycine 0 CA--C 1.539 1.556 0 CA-C-N 115.67 -0.695 . . . . 0.0 113.776 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -122.15 113.78 19.97 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-N 117.28 0.54 . . . . 0.0 110.592 169.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.436 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 13.0 ptp180 -69.8 89.82 0.58 Allowed 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 121.935 0.874 . . . . 0.0 111.178 177.109 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 26.4 t90 -177.61 140.81 0.27 Allowed 'General case' 0 N--CA 1.491 1.612 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.976 -171.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 44.9 t 50.79 31.85 6.47 Favored 'General case' 0 N--CA 1.508 2.459 0 C-N-CA 124.773 1.229 . . . . 0.0 113.702 167.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.462 HD22 ' HD2' ' A' ' 84' ' ' ARG . 3.0 tm? -81.62 -33.29 31.54 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 118.847 -0.597 . . . . 0.0 111.889 -171.115 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 37.6 t 65.12 121.8 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 123.463 0.705 . . . . 0.0 111.58 -175.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.513 ' H ' HG21 ' A' ' 41' ' ' VAL . . . -61.23 -29.88 70.1 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -170.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.5 m -57.76 -33.5 68.58 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.668 0.787 . . . . 0.0 112.551 176.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.462 ' HD2' HD22 ' A' ' 80' ' ' LEU . 30.2 ttm180 -73.43 -45.43 54.51 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.791 0.836 . . . . 0.0 111.324 -174.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.552 ' HE1' HD23 ' A' ' 115' ' ' LEU . 1.6 t-105 -74.23 -52.08 13.44 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.55 0.74 . . . . 0.0 111.277 176.183 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.435 ' OE1' HG12 ' A' ' 110' ' ' VAL . 34.2 tp60 -51.67 -37.73 51.86 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.044 0.938 . . . . 0.0 112.948 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -62.72 -42.74 99.81 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.768 0.427 . . . . 0.0 111.395 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.71 -33.8 76.45 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.338 0.655 . . . . 0.0 111.913 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -61.17 -51.4 69.22 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.51 0.724 . . . . 0.0 111.041 174.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.72 -25.56 63.91 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.411 0.685 . . . . 0.0 112.266 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.38 -14.39 58.99 Favored 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 123.54 0.736 . . . . 0.0 111.699 171.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.73 -20.18 29.31 Favored Glycine 0 C--N 1.353 1.48 0 N-CA-C 114.448 0.539 . . . . 0.0 114.448 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 4.5 ppp? -84.56 5.18 28.76 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -171.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.462 ' HB1' ' CZ3' ' A' ' 85' ' ' TRP . . . -54.14 131.99 60.02 Favored Pre-proline 0 CA--C 1.564 1.518 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.9 174.89 10.49 Favored 'Trans proline' 0 CA--C 1.565 2.055 0 C-N-CA 123.484 2.789 . . . . 0.0 113.585 172.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.95 124.46 13.58 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.151 1.901 . . . . 0.0 112.446 166.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.09 137.86 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.581 0.752 . . . . 0.0 110.597 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.49 HG13 ' HB3' ' A' ' 101' ' ' SER . 4.5 p -68.44 103.4 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.572 1.812 0 CA-C-O 121.902 0.858 . . . . 0.0 112.066 179.049 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 86.7 mt -58.41 -40.89 83.67 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 124.845 1.258 . . . . 0.0 112.694 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -78.52 7.04 7.31 Favored 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -175.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.49 ' HB3' HG13 ' A' ' 98' ' ' VAL . 40.9 t -118.42 -25.31 6.55 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 122.952 0.501 . . . . 0.0 111.973 173.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.2 p -69.16 115.21 8.19 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.583 0.353 . . . . 0.0 111.14 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.6 mp0 -64.44 160.8 18.4 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.007 0.523 . . . . 0.0 111.978 175.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.418 ' O ' ' HD3' ' A' ' 104' ' ' LYS . 3.3 tmtp? -66.06 -27.63 68.23 Favored 'General case' 0 CA--C 1.561 1.402 0 CA-C-O 121.191 0.52 . . . . 0.0 109.754 174.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.519 ' HB3' ' HB ' ' A' ' 40' ' ' THR . 45.3 t -60.12 -28.76 68.13 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.248 0.619 . . . . 0.0 111.794 173.284 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.531 ' HA ' HG22 ' A' ' 41' ' ' VAL . . . -65.2 -44.21 89.08 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 122.813 0.445 . . . . 0.0 111.282 171.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.427 ' HA ' HG23 ' A' ' 110' ' ' VAL . 9.5 mp -64.45 6.19 0.22 Allowed 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 125.463 1.505 . . . . 0.0 113.741 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -95.99 -14.71 22.8 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.475 0.71 . . . . 0.0 110.459 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -114.39 -41.21 3.49 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.664 1.186 . . . . 0.0 108.469 178.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.532 HG21 HD21 ' A' ' 115' ' ' LEU . 1.7 m -92.99 -168.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.861 0.839 . . . . 0.0 110.739 164.009 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.3 t -131.01 156.01 45.85 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.949 1.3 . . . . 0.0 107.886 160.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 tt -49.28 -39.21 29.9 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.995 0.518 . . . . 0.0 111.625 170.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.1 77.05 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.206 0.602 . . . . 0.0 112.495 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -68.43 -32.86 73.18 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.792 0.437 . . . . 0.0 111.025 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.552 HD23 ' HE1' ' A' ' 85' ' ' TRP . 29.5 mt -73.26 -55.64 6.16 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.902 -178.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -66.0 -24.31 66.75 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.78 1.232 . . . . 0.0 112.993 -176.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -53.21 -34.27 56.35 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 174.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 69.3 m-70 -115.19 -23.02 9.16 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.365 0.666 . . . . 0.0 112.415 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.256 0 C-N-CA 123.321 0.648 . . . . 0.0 112.157 -179.64 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 103' ' ' GLU . 4.9 t . . . . . 0 N--CA 1.484 1.243 0 CA-C-O 120.983 0.42 . . . . 0.0 110.695 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.6 t -138.34 111.89 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 C-N-CA 123.255 0.622 . . . . 0.0 110.353 -178.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 72.2 m -101.42 106.41 17.55 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 171.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.546 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -139.53 147.92 41.9 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.36 0.664 . . . . 0.0 109.689 -175.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -106.61 112.79 25.94 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.461 0.304 . . . . 0.0 111.375 -172.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.477 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 29.7 mtm -110.0 137.68 47.43 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.044 170.122 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.1 p -83.7 167.98 16.69 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.602 0.761 . . . . 0.0 111.689 -171.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.404 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 28.4 tt0 -61.12 -30.37 70.33 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.506 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -49.56 -55.33 13.85 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.962 0.905 . . . . 0.0 111.509 174.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -76.22 -37.6 57.53 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' A' ' 45' ' ' MET . 10.9 mp -67.41 -33.74 75.8 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 118.351 0.523 . . . . 0.0 111.706 -177.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.404 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 68.6 mt -72.61 -27.88 62.43 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.239 0.616 . . . . 0.0 111.245 170.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -73.83 -34.07 64.41 Favored 'General case' 0 CA--C 1.563 1.47 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 172.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 73.3 m . . . . . 0 N--CA 1.494 1.771 0 C-N-CA 123.312 0.645 . . . . 0.0 112.599 -175.362 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.047 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.79 -1.38 58.09 Favored Glycine 0 N--CA 1.475 1.272 0 CA-C-N 115.704 -0.68 . . . . 0.0 113.883 177.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.03 104.42 6.55 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.184 0.516 . . . . 0.0 111.675 178.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.572 ' HD3' HG11 ' A' ' 98' ' ' VAL . 13.7 ptt180 -81.19 91.65 6.2 Favored 'General case' 0 CA--C 1.557 1.221 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.03 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -168.51 120.88 0.82 Allowed 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.232 0.613 . . . . 0.0 110.271 176.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 48.5 t 51.62 25.23 2.69 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 124.166 0.986 . . . . 0.0 112.648 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.546 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.4 tm? -66.86 123.4 20.05 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.081 0.952 . . . . 0.0 109.536 -177.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.444 ' SG ' ' HB3' ' A' ' 83' ' ' SER . 42.6 t -59.01 102.35 0.12 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.224 0.609 . . . . 0.0 110.924 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.96 -26.89 62.89 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.922 0.889 . . . . 0.0 112.223 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.444 ' HB3' ' SG ' ' A' ' 81' ' ' CYS . 45.7 t -67.25 -41.46 85.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.566 0.746 . . . . 0.0 111.483 172.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 56.4 ttm-85 -73.89 -31.62 63.2 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.004 0.522 . . . . 0.0 111.843 179.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.624 ' HE1' HD23 ' A' ' 115' ' ' LEU . 6.0 t-105 -64.45 -42.1 96.16 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 169.031 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -58.18 -38.08 76.0 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.708 0.403 . . . . 0.0 110.85 174.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 83' ' ' SER . 41.6 mm-40 -62.18 -39.13 91.66 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.893 0.477 . . . . 0.0 111.774 176.364 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.53 -41.23 96.51 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.152 0.501 . . . . 0.0 111.393 174.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.759 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 40.2 t80 -67.41 -42.59 82.99 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.41 -176.489 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -77.03 -32.24 56.9 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.324 0.649 . . . . 0.0 111.988 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.88 -22.93 62.22 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.028 0.531 . . . . 0.0 111.74 176.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 106.33 -11.01 43.44 Favored Glycine 0 N--CA 1.476 1.328 0 CA-C-O 119.717 -0.491 . . . . 0.0 114.275 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' MET . . . . . 0.414 ' SD ' ' N ' ' A' ' 93' ' ' MET . 1.1 mpt? -66.79 -66.91 0.49 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 117.41 0.605 . . . . 0.0 109.947 176.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.759 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 48.14 87.34 0.13 Allowed Pre-proline 0 CA--C 1.558 1.269 0 C-N-CA 125.135 1.374 . . . . 0.0 114.018 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -64.85 158.22 52.23 Favored 'Trans proline' 0 CA--C 1.566 2.076 0 C-N-CA 123.18 2.586 . . . . 0.0 113.409 172.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -68.29 109.44 2.0 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.362 2.042 . . . . 0.0 112.35 173.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.7 p -95.99 137.01 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 123.672 0.789 . . . . 0.0 110.916 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.572 HG11 ' HD3' ' A' ' 77' ' ' ARG . 5.5 p -77.34 107.77 9.4 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.741 0 C-N-CA 123.953 0.901 . . . . 0.0 113.076 -174.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 98.6 mt -67.79 -36.81 81.1 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.823 0.849 . . . . 0.0 112.52 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -78.43 20.51 0.41 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.624 0.77 . . . . 0.0 112.769 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.0 t -142.79 -44.23 0.31 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.688 0.795 . . . . 0.0 111.324 175.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.7 m -56.88 121.49 10.02 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 123.862 0.865 . . . . 0.0 112.737 -173.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 40' ' ' THR . 1.9 mp0 -74.14 166.8 22.79 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.034 0.933 . . . . 0.0 113.071 -173.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.402 ' HA ' HD13 ' A' ' 107' ' ' LEU . 32.9 mmtp -68.59 -13.42 62.33 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.101 0.96 . . . . 0.0 113.034 -177.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.5 t -57.35 -48.68 78.38 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 122.971 0.509 . . . . 0.0 110.613 172.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.58 -32.49 63.09 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.536 0.734 . . . . 0.0 112.82 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.455 ' HG ' ' HB2' ' A' ' 112' ' ' LEU . 8.6 mp -66.16 -22.81 66.38 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.007 0.523 . . . . 0.0 112.371 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.2 mtt85 -89.32 -7.49 55.23 Favored 'General case' 0 CA--C 1.561 1.393 0 C-N-CA 123.686 0.794 . . . . 0.0 112.78 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -117.9 -57.97 2.05 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 123.331 0.652 . . . . 0.0 112.057 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.45 HG21 ' CD1' ' A' ' 85' ' ' TRP . 13.3 p -98.66 -25.75 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 C-N-CA 123.589 0.756 . . . . 0.0 111.767 -176.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 46.8 t 77.58 149.46 0.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 125.689 1.596 . . . . 0.0 112.394 -173.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.555 ' HA ' HD12 ' A' ' 115' ' ' LEU . 4.6 tt -61.31 -37.12 82.08 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.713 1.205 . . . . 0.0 113.021 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.47 -34.8 76.08 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -173.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.35 -34.0 72.12 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.103 0.961 . . . . 0.0 111.481 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.624 HD23 ' HE1' ' A' ' 85' ' ' TRP . 57.4 mt -69.15 -48.01 63.45 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 121.943 0.877 . . . . 0.0 110.434 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -70.26 -37.87 74.99 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.848 -175.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -57.69 -16.74 11.79 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -132.35 39.12 3.42 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.392 0.677 . . . . 0.0 111.56 173.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.193 0 C-N-CA 123.175 0.59 . . . . 0.0 111.294 170.471 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.8 p . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 121.462 0.649 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.646 HG11 ' HB2' ' A' ' 82' ' ' ALA . 18.6 t -127.23 127.81 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.686 0.794 . . . . 0.0 109.954 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.409 ' SG ' ' HA ' ' A' ' 78' ' ' TRP . 93.6 m -136.39 108.86 7.38 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 168.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.577 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -140.43 150.77 44.25 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.123 0.969 . . . . 0.0 109.22 -170.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.448 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 20.2 tt0 -114.76 124.5 51.94 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.984 0.421 . . . . 0.0 111.812 -177.101 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.417 ' HE3' ' HB3' ' A' ' 45' ' ' MET . 67.1 mmm -108.21 138.46 44.45 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.079 0.951 . . . . 0.0 109.775 175.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 7.0 t -85.5 156.44 20.78 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.865 0.466 . . . . 0.0 110.398 174.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.541 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 37.6 tt0 -61.25 -29.29 69.75 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.065 0.546 . . . . 0.0 111.624 -175.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -48.3 -45.92 35.54 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 124.327 1.051 . . . . 0.0 111.845 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -76.93 -39.96 48.85 Favored 'General case' 0 CA--C 1.558 1.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.274 174.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.28 -26.1 68.34 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.541 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 95.9 mt -74.27 -47.47 34.72 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.691 0.796 . . . . 0.0 109.763 172.182 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -58.4 -31.77 68.01 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.642 0.777 . . . . 0.0 111.9 174.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.488 1.465 0 C-N-CA 123.535 0.734 . . . . 0.0 110.857 177.307 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.78 0 CA-C-O 120.332 0.111 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 109.86 -10.46 32.14 Favored Glycine 0 N--CA 1.477 1.429 0 CA-C-N 116.743 -0.208 . . . . 0.0 113.521 -174.548 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -85.61 83.98 7.73 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.306 0.642 . . . . 0.0 111.211 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.448 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -85.04 86.28 7.4 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-O 121.236 0.541 . . . . 0.0 111.57 179.592 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.409 ' HA ' ' SG ' ' A' ' 42' ' ' CYS . 42.3 t90 179.32 122.62 0.05 Allowed 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.916 0.886 . . . . 0.0 109.449 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 84.9 m 57.9 25.81 12.56 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 124.138 0.975 . . . . 0.0 113.209 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.577 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.8 tm? -66.38 124.16 21.97 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.389 0.676 . . . . 0.0 109.423 175.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 59.0 m -61.39 105.68 0.54 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.309 0.644 . . . . 0.0 109.506 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.646 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -59.22 -23.63 62.47 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -169.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.9 m -63.77 -30.19 71.31 Favored 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 123.325 0.65 . . . . 0.0 112.347 175.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -57.3 -47.43 81.5 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 124.304 1.041 . . . . 0.0 110.291 171.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.72 ' HE1' HD23 ' A' ' 115' ' ' LEU . 13.5 t-105 -71.74 -41.26 68.68 Favored 'General case' 0 CA--C 1.565 1.532 0 CA-C-N 114.325 -1.307 . . . . 0.0 111.964 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -63.4 -48.08 79.32 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.959 0.904 . . . . 0.0 111.114 -177.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.73 -28.59 67.77 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.348 0.659 . . . . 0.0 111.57 178.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.55 -41.06 96.57 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.208 0.603 . . . . 0.0 111.67 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.764 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 84.9 t80 -67.09 -48.36 68.41 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.977 176.291 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.28 -25.19 67.94 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.67 0.788 . . . . 0.0 112.354 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.55 -22.62 50.76 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.639 0.775 . . . . 0.0 111.78 175.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.92 -4.74 42.12 Favored Glycine 0 C--N 1.351 1.402 0 N-CA-C 114.259 0.464 . . . . 0.0 114.259 176.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' MET . . . . . 0.443 ' SD ' ' N ' ' A' ' 93' ' ' MET . 1.5 mpt? -84.57 -73.62 0.42 Allowed 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 117.314 0.557 . . . . 0.0 109.963 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.764 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 58.07 95.17 0.05 OUTLIER Pre-proline 0 CA--C 1.565 1.541 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 178.034 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -55.62 161.58 7.6 Favored 'Trans proline' 0 CA--C 1.564 1.981 0 C-N-CA 123.748 2.965 . . . . 0.0 114.972 169.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.01 117.42 5.09 Favored 'Trans proline' 0 C--N 1.372 1.795 0 C-N-CA 122.332 2.021 . . . . 0.0 111.759 169.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.491 HG11 ' HA ' ' A' ' 115' ' ' LEU . 14.2 p -99.68 159.71 3.54 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 123.691 0.796 . . . . 0.0 110.609 -177.563 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 m -92.67 99.98 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 124.215 1.006 . . . . 0.0 112.346 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.608 HD11 ' HG2' ' A' ' 116' ' ' GLN . 4.7 mt -74.23 -16.81 60.95 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.305 -0.872 . . . . 0.0 111.717 170.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -74.42 -12.31 60.47 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 123.817 0.847 . . . . 0.0 112.205 174.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.9 t -128.37 -40.53 1.61 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.016 0.526 . . . . 0.0 112.079 -175.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 55.0 p -55.34 99.3 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 CA-C-O 121.172 0.51 . . . . 0.0 111.838 171.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.544 ' HG3' ' H ' ' A' ' 105' ' ' SER . 12.7 tp10 -66.17 154.6 39.3 Favored 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 123.937 0.895 . . . . 0.0 110.781 172.163 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -56.54 -23.27 38.82 Favored 'General case' 0 CA--C 1.565 1.525 0 C-N-CA 124.237 1.015 . . . . 0.0 112.055 177.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.544 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 25.1 m -58.2 -27.66 64.1 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.99 0.916 . . . . 0.0 112.649 176.013 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.492 ' HA ' HG22 ' A' ' 41' ' ' VAL . . . -61.78 -23.43 66.18 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.229 1.012 . . . . 0.0 113.045 178.064 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.411 HD21 ' HB2' ' A' ' 112' ' ' LEU . 9.6 mp -67.37 -3.7 8.97 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -178.335 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -70.88 -33.38 70.54 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 122.059 -0.401 . . . . 0.0 111.533 167.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.574 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 49.5 m-85 -112.43 -23.43 10.32 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.054 0.942 . . . . 0.0 111.582 -171.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.496 ' HB ' ' HB1' ' A' ' 82' ' ' ALA . 4.9 p -129.69 -178.43 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.456 0 C-N-CA 123.832 0.853 . . . . 0.0 109.613 177.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' SER . . . . . 0.472 ' H ' HG22 ' A' ' 110' ' ' VAL . 27.2 p -109.89 164.2 12.81 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.494 -0.754 . . . . 0.0 110.739 170.051 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.411 ' HB2' HD21 ' A' ' 107' ' ' LEU . 4.6 tt -66.02 -39.45 90.23 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.433 0.693 . . . . 0.0 111.075 171.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.5 -33.83 74.46 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.437 0.695 . . . . 0.0 112.282 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.93 -50.22 73.27 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.269 0.628 . . . . 0.0 111.074 169.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.72 HD23 ' HE1' ' A' ' 85' ' ' TRP . 20.2 mt -65.8 -48.77 70.62 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.077 -172.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLN . . . . . 0.608 ' HG2' HD11 ' A' ' 99' ' ' LEU . 7.0 mt-30 -71.49 -26.81 62.84 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.1 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -61.35 -35.76 78.32 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 173.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -126.47 27.71 6.1 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.338 0.655 . . . . 0.0 112.215 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.232 0 C-N-CA 124.157 0.983 . . . . 0.0 110.643 172.258 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 26.1 p . . . . . 0 N--CA 1.499 1.987 0 CA-C-O 121.533 0.683 . . . . 0.0 111.778 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.6 t -136.8 107.45 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 C-N-CA 124.659 1.184 . . . . 0.0 109.102 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 93.5 m -113.28 110.72 20.84 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.702 -0.624 . . . . 0.0 111.271 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.54 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -139.12 149.9 45.04 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.934 1.294 . . . . 0.0 108.392 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.591 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 22.1 tt0 -121.53 114.88 21.84 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.139 0.495 . . . . 0.0 111.447 -178.297 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.433 ' HB2' HD11 ' A' ' 50' ' ' LEU . 72.2 mmm -89.0 142.82 27.31 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.216 1.006 . . . . 0.0 111.205 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 51.9 p -86.58 151.3 23.57 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.059 0.544 . . . . 0.0 109.641 178.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -54.87 -33.49 61.93 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 123.218 0.607 . . . . 0.0 112.465 -174.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -49.12 -46.95 45.71 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 125.231 1.412 . . . . 0.0 111.911 174.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -77.89 -33.99 51.7 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.433 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.2 mp -71.25 -31.79 67.95 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 120.869 0.366 . . . . 0.0 110.448 174.276 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 48.7 mt -75.54 -29.9 59.56 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.028 0.931 . . . . 0.0 111.52 174.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -65.03 -49.28 70.77 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.3 t . . . . . 0 N--CA 1.492 1.629 0 C-N-CA 123.563 0.745 . . . . 0.0 110.805 175.985 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.924 0 CA-C-O 120.661 0.267 . . . . 0.0 111.558 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.49 22.31 14.73 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 114.164 0.425 . . . . 0.0 114.164 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -114.45 96.22 5.65 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.199 0.599 . . . . 0.0 110.129 169.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.591 ' HB2' ' HB2' ' A' ' 44' ' ' GLU . 56.2 ttp180 -92.26 85.8 5.54 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 174.191 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 6.7 m-90 -167.4 119.48 0.91 Allowed 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 124.195 0.998 . . . . 0.0 109.071 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 31.1 p 44.93 33.76 1.08 Allowed 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.651 1.18 . . . . 0.0 113.143 175.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.54 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.0 tm? -63.28 118.08 7.51 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.161 0.984 . . . . 0.0 110.117 -176.761 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 41.4 t -53.1 119.22 4.45 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.593 0.757 . . . . 0.0 110.552 175.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.66 -31.59 26.17 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.834 0.853 . . . . 0.0 112.848 -174.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 73.1 m -57.27 -36.89 71.57 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 176.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.436 ' HG2' HD21 ' A' ' 80' ' ' LEU . 11.3 tpp180 -59.83 -53.35 58.94 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.194 0.597 . . . . 0.0 111.83 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.533 ' CD1' HG21 ' A' ' 110' ' ' VAL . 2.8 t-105 -75.26 -51.51 13.11 Favored 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 123.597 0.759 . . . . 0.0 111.007 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.588 ' HB2' HG23 ' A' ' 110' ' ' VAL . 47.0 tp60 -61.65 -42.25 98.64 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.603 0.761 . . . . 0.0 112.928 -172.639 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -69.86 -30.37 67.82 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 117.706 0.23 . . . . 0.0 111.594 -178.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.99 -34.85 78.41 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 122.92 0.488 . . . . 0.0 110.755 170.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.608 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 80.6 t80 -72.55 -43.49 63.39 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.998 0.919 . . . . 0.0 111.462 176.17 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 86' ' ' GLN . 49.8 mt-10 -66.52 -38.27 86.84 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.858 0.863 . . . . 0.0 111.404 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.13 -20.41 62.32 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.751 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 122.94 -20.87 7.57 Favored Glycine 0 C--N 1.357 1.738 0 N-CA-C 115.179 0.831 . . . . 0.0 115.179 170.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -81.76 -79.97 0.16 Allowed 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 117.721 0.761 . . . . 0.0 111.751 -171.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.608 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 65.91 124.51 0.03 OUTLIER Pre-proline 0 N--CA 1.499 1.999 0 C-N-CA 125.022 1.329 . . . . 0.0 114.409 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -77.39 172.08 16.55 Favored 'Trans proline' 0 CA--C 1.567 2.14 0 C-N-CA 122.959 2.439 . . . . 0.0 113.011 172.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.35 108.27 2.16 Favored 'Trans proline' 0 CA--C 1.565 2.058 0 C-N-CA 122.106 1.87 . . . . 0.0 112.324 169.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.6 p -96.65 151.14 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 123.576 0.75 . . . . 0.0 110.633 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.6 HG21 ' HB3' ' A' ' 101' ' ' SER . 19.2 m -75.84 162.75 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 CA-C-O 121.559 0.695 . . . . 0.0 111.637 173.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 96.3 mt -118.9 -9.42 10.1 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.782 0.833 . . . . 0.0 110.631 168.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -87.15 -47.57 8.77 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.95 0.9 . . . . 0.0 110.341 -171.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.6 ' HB3' HG21 ' A' ' 98' ' ' VAL . 42.3 t -85.71 -32.48 21.9 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.969 179.31 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 19.4 m -59.61 114.6 2.81 Favored 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 122.657 0.383 . . . . 0.0 111.64 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -79.34 168.24 19.78 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.552 0.741 . . . . 0.0 112.864 -173.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -67.96 -25.23 65.34 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.998 0.919 . . . . 0.0 112.146 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 43.7 t -62.4 -32.98 73.89 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 122.664 0.386 . . . . 0.0 111.633 177.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.16 -34.89 70.79 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.707 0.803 . . . . 0.0 112.057 174.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.6 ' HG ' ' HB2' ' A' ' 112' ' ' LEU . 6.9 mp -64.57 -10.26 24.9 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.937 0.895 . . . . 0.0 113.388 -175.384 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 65.0 mtp85 -94.78 -28.5 15.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.494 0.717 . . . . 0.0 111.927 173.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -96.47 -53.81 3.47 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.145 0.578 . . . . 0.0 111.148 -173.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.588 HG23 ' HB2' ' A' ' 86' ' ' GLN . 14.0 p -100.13 -24.06 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 C-N-CA 123.91 0.884 . . . . 0.0 111.567 -178.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 43.4 t 69.53 147.32 0.06 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.102 1.361 . . . . 0.0 112.636 -173.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.6 ' HB2' ' HG ' ' A' ' 107' ' ' LEU . 5.8 tt -61.23 -40.78 95.28 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.168 178.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.17 -38.81 84.33 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.138 0.575 . . . . 0.0 112.127 -172.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -69.12 -33.19 73.07 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.524 0.729 . . . . 0.0 111.036 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.516 HD23 ' HE1' ' A' ' 85' ' ' TRP . 39.9 mt -66.03 -55.82 14.72 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 121.95 0.881 . . . . 0.0 109.916 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -68.55 -24.77 64.67 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 113.896 -1.502 . . . . 0.0 113.146 -173.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.53 -23.36 64.52 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 113.151 0.796 . . . . 0.0 113.151 175.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 11.1 m80 -116.53 -16.56 10.77 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 123.303 0.641 . . . . 0.0 112.57 174.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.222 0 C-N-CA 122.659 0.384 . . . . 0.0 110.419 170.455 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.497 HG23 ' HG2' ' A' ' 103' ' ' GLU . 3.5 t . . . . . 0 N--CA 1.486 1.34 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.758 HG21 ' HB2' ' A' ' 82' ' ' ALA . 40.1 t -120.89 111.27 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 123.189 0.596 . . . . 0.0 110.329 -175.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 82.5 m -105.97 107.54 18.6 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.58 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.6 151.31 41.38 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.911 0.884 . . . . 0.0 109.272 -176.642 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -126.95 115.3 19.05 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 122.458 0.303 . . . . 0.0 110.244 -173.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 63.9 mmm -98.91 152.77 19.4 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.217 0.607 . . . . 0.0 111.671 -174.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.679 HG22 ' HB3' ' A' ' 95' ' ' PRO . 6.8 t -89.11 157.48 18.29 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.468 0.707 . . . . 0.0 110.635 175.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 61.2 tt0 -53.57 -32.18 49.8 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.897 0.879 . . . . 0.0 112.419 -177.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -51.4 -44.88 62.32 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.143 0.977 . . . . 0.0 111.456 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -74.31 -47.42 34.77 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 177.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -65.28 -32.88 74.76 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.294 0.497 . . . . 0.0 111.543 -174.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.6 mt -76.63 -31.85 57.65 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.118 0.567 . . . . 0.0 112.139 173.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -57.62 -48.77 78.53 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 123.053 0.541 . . . . 0.0 110.666 171.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 CA--C 1.55 0.951 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.601 -179.514 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.201 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 79.23 35.99 28.6 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-N 115.085 -0.961 . . . . 0.0 113.347 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -118.31 98.9 6.52 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.506 0.723 . . . . 0.0 111.216 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -76.74 87.39 3.36 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 166.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -175.39 127.17 0.26 Allowed 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.944 -173.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 39.4 t 59.12 16.09 4.56 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.859 1.264 . . . . 0.0 113.776 171.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.58 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -75.05 108.83 8.04 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -175.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 62.2 m -65.1 135.31 55.37 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.449 0.7 . . . . 0.0 111.14 178.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.758 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -51.32 -49.37 61.48 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.187 0.995 . . . . 0.0 113.31 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.6 m -57.3 -29.52 63.98 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.931 0.892 . . . . 0.0 112.943 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -70.06 -51.55 31.03 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.431 0.692 . . . . 0.0 110.767 -177.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 3.8 t-105 -62.93 -41.32 99.45 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 123.665 0.786 . . . . 0.0 110.802 172.095 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -58.52 -41.77 86.18 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.374 1.069 . . . . 0.0 111.997 -176.357 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -62.43 -37.33 85.43 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.722 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.7 -39.01 89.94 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.285 0.634 . . . . 0.0 111.65 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.565 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 75.4 t80 -68.23 -51.82 41.05 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.1 0.56 . . . . 0.0 111.23 175.005 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.86 -19.15 65.68 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.438 0.695 . . . . 0.0 112.42 -174.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.85 -26.97 21.35 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 123.153 0.581 . . . . 0.0 111.529 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 129.18 -21.76 5.15 Favored Glycine 0 N--CA 1.482 1.751 0 N-CA-C 115.697 1.039 . . . . 0.0 115.697 171.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -72.42 -67.89 0.51 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 118.17 0.985 . . . . 0.0 111.456 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.565 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 54.87 81.07 0.27 Allowed Pre-proline 0 CA--C 1.564 1.496 0 C-N-CA 124.641 1.176 . . . . 0.0 113.139 -177.508 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.679 ' HB3' HG22 ' A' ' 46' ' ' THR . 93.9 Cg_exo -53.4 163.95 2.26 Favored 'Trans proline' 0 N--CA 1.504 2.105 0 C-N-CA 124.352 3.368 . . . . 0.0 115.804 173.418 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -63.86 103.53 0.42 Allowed 'Trans proline' 0 C--N 1.384 2.429 0 C-N-CA 122.927 2.418 . . . . 0.0 112.667 174.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.6 p -94.26 138.01 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 123.299 0.64 . . . . 0.0 109.949 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 7.5 p -79.13 89.11 1.3 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-O 121.852 0.834 . . . . 0.0 112.862 -171.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.461 HD21 ' HB3' ' A' ' 115' ' ' LEU . 2.8 mm? -60.65 -34.37 74.2 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 124.628 1.171 . . . . 0.0 113.544 -177.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -71.33 -12.24 61.33 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 179.077 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 50.4 m -128.54 -7.11 5.18 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.248 0.619 . . . . 0.0 112.576 -176.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 99.5 m -72.62 120.96 18.97 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 122.552 0.341 . . . . 0.0 110.156 175.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.592 ' HG3' ' H ' ' A' ' 105' ' ' SER . 13.8 tp10 -64.55 149.71 48.21 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 123.131 0.572 . . . . 0.0 111.587 178.523 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -68.0 -34.18 76.02 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.369 0.667 . . . . 0.0 110.865 177.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.592 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 84.9 p -61.96 -23.86 66.64 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 122.902 0.481 . . . . 0.0 111.987 175.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.02 -36.06 74.33 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.044 0.538 . . . . 0.0 112.356 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.1 mp -55.73 -13.7 1.85 Allowed 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 124.978 1.311 . . . . 0.0 113.431 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -61.95 -34.48 76.2 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.422 1.089 . . . . 0.0 112.376 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -109.76 -21.82 12.21 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.578 1.151 . . . . 0.0 110.247 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.461 HG11 HD21 ' A' ' 115' ' ' LEU . 48.7 t -109.67 -51.67 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 CA-C-N 114.048 -1.433 . . . . 0.0 112.715 -159.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 26.6 m 71.26 140.86 0.05 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 125.746 1.618 . . . . 0.0 112.79 -168.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.42 -39.8 92.1 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.274 1.03 . . . . 0.0 113.372 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.6 -32.5 70.45 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.86 0.464 . . . . 0.0 111.73 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.89 -36.95 85.01 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 124.382 1.073 . . . . 0.0 111.185 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.461 ' HB3' HD21 ' A' ' 99' ' ' LEU . 71.5 mt -75.0 -51.58 13.24 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.637 1.175 . . . . 0.0 110.874 -177.466 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -70.78 -23.06 62.33 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 114.4 -1.273 . . . . 0.0 112.321 -175.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -50.07 -28.68 7.5 Favored 'General case' 0 CA--C 1.562 1.412 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 171.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -128.73 22.63 5.85 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.507 0.723 . . . . 0.0 112.261 175.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.314 0 C-N-CA 123.239 0.615 . . . . 0.0 110.577 174.0 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.415 ' O ' ' HB3' ' A' ' 105' ' ' SER . 65.8 p . . . . . 0 CA--C 1.559 1.3 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.538 HG11 ' HB2' ' A' ' 82' ' ' ALA . 46.5 t -137.89 117.96 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.746 -0.596 . . . . 0.0 111.126 176.07 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 57.8 m -116.74 108.22 15.62 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 168.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.637 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -137.69 148.23 45.52 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -176.348 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.5 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 28.0 tt0 -115.49 116.56 28.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.843 0.354 . . . . 0.0 111.77 -171.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 52.5 mmm -103.5 123.41 46.85 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.272 175.092 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 79.3 p -81.39 167.04 19.87 Favored 'General case' 0 C--O 1.246 0.895 0 C-N-CA 123.13 0.572 . . . . 0.0 110.549 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -58.03 -29.57 65.45 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.382 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -49.64 -56.13 11.17 Favored 'General case' 0 CA--C 1.567 1.622 0 C-N-CA 124.826 1.25 . . . . 0.0 112.377 177.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -70.55 -38.81 74.21 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 176.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.9 mp -66.34 -25.09 66.66 Favored 'General case' 0 CA--C 1.566 1.569 0 O-C-N 122.129 -0.357 . . . . 0.0 111.481 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 39.3 mt -75.13 -35.44 61.68 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.227 1.011 . . . . 0.0 110.555 172.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -60.64 -51.34 69.81 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.95 0.5 . . . . 0.0 110.286 171.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.9 m . . . . . 0 N--CA 1.483 1.191 0 C-N-CA 124.193 0.997 . . . . 0.0 111.646 177.084 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.827 0 CA-C-O 120.945 0.402 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 108.27 27.66 4.95 Favored Glycine 0 CA--C 1.535 1.333 0 CA-C-N 115.814 -0.63 . . . . 0.0 113.581 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -105.47 111.18 23.79 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.186 0.594 . . . . 0.0 111.237 171.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.5 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 11.9 ptt85 -83.1 88.05 6.9 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 165.292 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.4 t-105 -172.46 121.1 0.42 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.289 -173.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 43.4 t 54.56 19.24 2.32 Favored 'General case' 0 N--CA 1.499 1.978 0 C-N-CA 124.702 1.201 . . . . 0.0 113.708 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.637 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -71.4 124.11 23.85 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.36 0.664 . . . . 0.0 109.772 -175.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 52.0 t -62.14 110.5 1.62 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.177 0.591 . . . . 0.0 110.162 174.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.538 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -57.22 -26.7 61.13 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 113.885 1.069 . . . . 0.0 113.885 -171.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 78.6 p -68.64 -30.47 69.19 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.132 0.573 . . . . 0.0 112.228 176.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -72.85 -31.36 64.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.576 0.75 . . . . 0.0 111.027 175.3 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.528 ' HD1' HG11 ' A' ' 110' ' ' VAL . 8.8 t-105 -67.29 -53.97 24.99 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.259 0.624 . . . . 0.0 110.114 171.278 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.453 HE21 ' HG3' ' A' ' 90' ' ' GLU . 18.2 tp60 -56.88 -34.97 68.39 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.865 0.866 . . . . 0.0 112.263 177.185 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -52.41 -39.02 60.44 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.674 0.79 . . . . 0.0 111.826 175.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.06 -36.31 81.75 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.443 0.697 . . . . 0.0 112.727 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -67.42 -46.46 73.1 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 120.913 0.387 . . . . 0.0 110.391 173.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.453 ' HG3' HE21 ' A' ' 86' ' ' GLN . 42.1 mt-10 -66.2 -19.62 65.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.834 0.854 . . . . 0.0 111.827 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.08 -25.77 31.73 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.208 1.003 . . . . 0.0 111.708 171.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 111.17 -12.88 28.8 Favored Glycine 0 CA--C 1.537 1.465 0 CA-C-N 116.235 -0.439 . . . . 0.0 114.052 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 58.8 mtp -89.17 -81.61 0.27 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.725 0.81 . . . . 0.0 111.659 -174.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 59.86 99.5 0.04 OUTLIER Pre-proline 0 CA--C 1.564 1.505 0 C-N-CA 125.184 1.394 . . . . 0.0 114.226 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -57.18 166.47 4.26 Favored 'Trans proline' 0 CA--C 1.567 2.172 0 C-N-CA 124.098 3.199 . . . . 0.0 114.655 171.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.58 129.27 20.81 Favored 'Trans proline' 0 CA--C 1.567 2.144 0 C-N-CA 122.168 1.912 . . . . 0.0 112.996 171.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.8 p -116.61 151.39 18.42 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.158 0 C-N-CA 123.945 0.898 . . . . 0.0 111.096 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.6 m -88.33 97.61 6.94 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 124.262 1.025 . . . . 0.0 113.5 -171.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 22.8 mt -59.97 -24.33 64.33 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.134 -0.979 . . . . 0.0 112.305 172.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -67.81 -32.38 72.89 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 124.144 0.977 . . . . 0.0 112.738 178.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.8 t -115.4 -45.69 2.91 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -174.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.1 m -48.12 112.75 0.62 Allowed 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 123.571 0.748 . . . . 0.0 112.398 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -83.5 175.42 9.81 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -169.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.636 ' HA ' HD13 ' A' ' 107' ' ' LEU . 14.7 mmmm -67.76 -21.09 65.28 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 124.043 0.937 . . . . 0.0 113.197 -175.013 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.415 ' HB3' ' O ' ' A' ' 40' ' ' THR . 31.3 t -68.54 -29.72 68.36 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 176.326 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.2 -31.19 70.95 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.05 0.54 . . . . 0.0 112.453 176.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.636 HD13 ' HA ' ' A' ' 104' ' ' LYS . 8.1 mp -61.38 -28.03 68.95 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 124.019 0.928 . . . . 0.0 111.935 176.409 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -74.5 -5.78 44.66 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.889 0.876 . . . . 0.0 112.624 -177.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -120.92 -45.67 2.37 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.031 0.932 . . . . 0.0 110.721 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.528 HG11 ' HD1' ' A' ' 85' ' ' TRP . 0.6 OUTLIER -103.6 -35.38 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 C-N-CA 122.917 0.487 . . . . 0.0 111.9 -172.777 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 111' ' ' SER . . . . . 0.406 ' O ' HG23 ' A' ' 110' ' ' VAL . 39.3 t 77.05 134.68 0.06 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.616 1.567 . . . . 0.0 110.849 -166.297 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 tt -44.93 -28.16 0.63 Allowed 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 124.734 1.214 . . . . 0.0 113.827 -177.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.73 -37.26 70.74 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.613 0.765 . . . . 0.0 113.0 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -72.85 -40.98 65.25 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 120.891 0.377 . . . . 0.0 110.813 177.114 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.517 HD23 ' HE1' ' A' ' 85' ' ' TRP . 67.7 mt -57.6 -46.46 84.03 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.601 0.76 . . . . 0.0 111.74 177.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -76.06 -34.35 59.59 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.699 0.8 . . . . 0.0 112.409 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -57.72 -28.05 63.52 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.174 0.589 . . . . 0.0 112.435 173.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -126.48 26.62 6.31 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.789 0.836 . . . . 0.0 111.938 -177.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.025 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.055 172.207 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.87 0.367 . . . . 0.0 111.076 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.452 HG11 ' HB2' ' A' ' 82' ' ' ALA . 48.5 t -129.85 101.4 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 123.65 0.78 . . . . 0.0 109.311 176.061 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 75.5 m -96.96 105.68 17.87 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.674 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -138.58 137.31 36.87 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.82 0.848 . . . . 0.0 108.954 -177.298 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.471 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 14.4 tt0 -117.78 108.83 15.84 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.124 0.487 . . . . 0.0 110.977 -168.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.477 ' HB2' HD11 ' A' ' 50' ' ' LEU . 59.3 mmm -91.55 132.6 36.18 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.817 0.847 . . . . 0.0 109.359 -179.562 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.655 HG22 ' HB3' ' A' ' 95' ' ' PRO . 8.0 t -80.12 155.29 27.56 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 175.509 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.467 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 37.1 tt0 -51.83 -31.23 26.66 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 118.902 -0.571 . . . . 0.0 112.291 -174.172 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -49.86 -43.79 49.3 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.802 0.841 . . . . 0.0 112.427 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -71.57 -38.21 70.96 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.593 0.357 . . . . 0.0 111.804 175.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.477 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.0 mp -71.04 -21.54 62.25 Favored 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 122.491 0.317 . . . . 0.0 111.742 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 47' ' ' GLU . 90.4 mt -72.72 -31.61 65.11 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 124.177 0.991 . . . . 0.0 109.565 169.734 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -74.86 -31.42 61.63 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 123.49 0.716 . . . . 0.0 111.465 168.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.9 m . . . . . 0 N--CA 1.488 1.468 0 C-N-CA 123.387 0.675 . . . . 0.0 111.781 -179.298 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.096 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 77.01 28.59 58.38 Favored Glycine 0 C--N 1.349 1.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 113.971 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -131.51 102.94 6.14 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 123.601 0.761 . . . . 0.0 110.905 178.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.471 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 11.5 ptt180 -85.57 88.88 7.58 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.881 0.848 . . . . 0.0 111.905 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -160.05 119.73 2.86 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.144 0.977 . . . . 0.0 109.353 -177.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 85.9 m 57.98 20.65 6.97 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.157 0.983 . . . . 0.0 113.179 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.674 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.5 tm? -68.02 115.97 8.12 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.65 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 48.4 m -63.32 114.79 4.04 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 123.649 0.593 . . . . 0.0 109.434 177.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.584 ' HB1' HG13 ' A' ' 110' ' ' VAL . . . -51.83 -35.51 44.75 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.822 0.849 . . . . 0.0 112.695 -176.457 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.7 m -57.55 -34.95 69.69 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.855 0.862 . . . . 0.0 112.688 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -74.69 -29.5 61.24 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 177.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -67.83 -51.74 44.93 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 169.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.74 ' HB2' HG12 ' A' ' 110' ' ' VAL . 13.3 tp60 -49.9 -35.6 24.25 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.891 0.876 . . . . 0.0 112.79 171.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -56.02 -44.01 78.32 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.934 0.894 . . . . 0.0 111.974 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.72 83.57 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.917 0.887 . . . . 0.0 113.095 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.37 -47.08 87.5 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.313 0.577 . . . . 0.0 110.69 173.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -69.49 -28.39 66.02 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.123 0.969 . . . . 0.0 112.114 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.7 -25.79 49.66 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.279 0.632 . . . . 0.0 111.308 174.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.76 29.82 25.43 Favored Glycine 0 CA--C 1.537 1.444 0 CA-C-N 116.101 -0.499 . . . . 0.0 113.822 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 23.1 ptm -139.6 25.26 2.4 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.209 0.604 . . . . 0.0 111.83 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -40.13 112.6 0.85 Allowed Pre-proline 0 CA--C 1.572 1.802 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 177.162 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.655 ' HB3' HG22 ' A' ' 46' ' ' THR . 54.3 Cg_exo -60.48 161.61 20.08 Favored 'Trans proline' 0 C--N 1.382 2.296 0 C-N-CA 123.745 2.963 . . . . 0.0 114.157 168.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -73.83 115.1 4.21 Favored 'Trans proline' 0 C--N 1.374 1.9 0 C-N-CA 122.138 1.892 . . . . 0.0 111.237 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 9.0 p -97.17 164.55 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-O 121.394 0.616 . . . . 0.0 109.846 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p -107.86 96.9 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.325 0 C-N-CA 123.882 0.873 . . . . 0.0 110.448 -178.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 25.6 mt -52.27 -41.17 62.63 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 124.248 1.019 . . . . 0.0 113.165 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -74.14 -1.27 19.57 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -176.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.8 t -122.5 -26.18 4.62 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.516 0.726 . . . . 0.0 111.154 172.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 30.4 m -76.3 104.07 6.64 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.19 0.596 . . . . 0.0 109.922 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -65.8 152.32 44.63 Favored 'General case' 0 CA--C 1.564 1.518 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.612 -175.573 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.16 -14.58 56.05 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 125.155 1.382 . . . . 0.0 112.551 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 54.9 m -55.82 -31.14 62.42 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.996 0.918 . . . . 0.0 111.259 169.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.432 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -56.32 -41.24 75.68 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.741 0.817 . . . . 0.0 112.004 175.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.7 -13.81 6.91 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 124.216 1.006 . . . . 0.0 113.502 -177.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -86.62 -8.7 57.25 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.469 0.708 . . . . 0.0 111.483 -179.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.507 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 44.8 m-85 -123.24 -45.41 2.1 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.826 1.251 . . . . 0.0 109.306 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.74 HG12 ' HB2' ' A' ' 86' ' ' GLN . 13.9 m -85.81 -167.81 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 CA-C-O 122.135 0.969 . . . . 0.0 111.608 167.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 43.9 t -115.03 150.85 35.23 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 114.323 -1.308 . . . . 0.0 108.713 156.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.1 tt -48.69 -39.28 23.91 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.079 0.552 . . . . 0.0 111.629 173.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.93 -31.49 65.0 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.15 0.98 . . . . 0.0 113.248 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -64.4 -46.05 85.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.043 0.537 . . . . 0.0 111.058 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.653 HD21 HG21 ' A' ' 110' ' ' VAL . 8.1 mt -66.17 -48.85 69.39 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.815 0.817 . . . . 0.0 109.83 -175.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -74.04 -24.84 59.6 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.26 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.95 -34.05 62.9 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 123.62 0.768 . . . . 0.0 112.704 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.28 33.62 3.06 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.1 0.56 . . . . 0.0 111.546 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.959 0 C-N-CA 123.227 0.611 . . . . 0.0 110.147 171.871 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.044 0.449 . . . . 0.0 111.459 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.585 HG11 ' HB2' ' A' ' 82' ' ' ALA . 40.9 t -128.13 120.51 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 169.559 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 81.5 m -116.61 109.14 16.83 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-O 121.192 0.52 . . . . 0.0 109.86 173.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.622 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -132.06 150.38 52.17 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.332 1.053 . . . . 0.0 108.512 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -117.58 109.18 16.37 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.968 0.413 . . . . 0.0 110.236 -176.083 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.553 ' HE1' ' HE3' ' A' ' 85' ' ' TRP . 60.5 mmm -84.97 131.42 34.48 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.481 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 5.4 t -81.95 153.71 26.13 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 174.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -49.06 -30.04 5.84 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.489 1.116 . . . . 0.0 113.106 -175.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -49.62 -48.41 49.06 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.65 1.18 . . . . 0.0 112.293 175.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.455 ' HB2' ' HG3' ' A' ' 95' ' ' PRO . 59.8 t80 -68.95 -41.35 78.15 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.034 0.533 . . . . 0.0 112.04 176.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.463 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.3 mp -70.94 -29.45 65.47 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 122.592 0.357 . . . . 0.0 111.713 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 67.9 mt -76.38 -32.86 58.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.695 0.798 . . . . 0.0 110.527 171.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -68.27 -32.19 72.18 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.08 0.552 . . . . 0.0 111.08 171.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 70.0 m . . . . . 0 N--CA 1.483 1.215 0 C-N-CA 123.327 0.651 . . . . 0.0 110.658 179.254 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.892 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 102.34 14.73 27.36 Favored Glycine 0 CA--C 1.536 1.347 0 N-CA-C 114.456 0.543 . . . . 0.0 114.456 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -122.55 103.8 8.94 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 117.783 0.791 . . . . 0.0 111.815 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.411 ' HB3' HG11 ' A' ' 98' ' ' VAL . 0.0 OUTLIER -86.75 91.98 8.8 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.365 0.603 . . . . 0.0 111.324 168.712 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -166.71 121.01 1.07 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.278 0.631 . . . . 0.0 109.323 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 73.4 m 52.78 24.81 3.44 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 175.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.622 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.3 tm? -72.29 105.25 3.98 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 175.207 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 49.5 t -55.72 120.66 7.64 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 123.551 0.532 . . . . 0.0 110.567 175.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.585 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -56.84 -22.72 38.7 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.842 0.857 . . . . 0.0 113.131 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 64.6 m -54.1 -39.98 66.88 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.078 0.551 . . . . 0.0 112.348 170.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -66.84 -44.56 80.75 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.92 0.888 . . . . 0.0 111.552 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.652 ' HE1' HD23 ' A' ' 115' ' ' LEU . 5.3 t-105 -70.53 -54.02 13.82 Favored 'General case' 0 CA--C 1.566 1.559 0 C-N-CA 123.215 0.606 . . . . 0.0 110.99 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.699 ' HB2' HG12 ' A' ' 110' ' ' VAL . 6.5 tp60 -49.64 -42.51 45.33 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.31 0.644 . . . . 0.0 112.303 175.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.23 -32.7 62.49 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 123.56 0.744 . . . . 0.0 112.752 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.93 -43.12 91.13 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.111 0.564 . . . . 0.0 111.839 175.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -69.83 -41.24 75.22 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.483 0.713 . . . . 0.0 111.232 176.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 9.4 mm-40 -65.35 -23.71 67.06 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.458 0.703 . . . . 0.0 111.372 178.345 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.05 -25.63 29.7 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.865 0.866 . . . . 0.0 111.523 172.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 117.7 -12.92 13.36 Favored Glycine 0 N--CA 1.48 1.572 0 N-CA-C 114.187 0.435 . . . . 0.0 114.187 177.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 91.1 mmm -83.92 -80.84 0.18 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.336 0.654 . . . . 0.0 111.773 -176.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.46 92.17 0.07 OUTLIER Pre-proline 0 N--CA 1.487 1.422 0 C-N-CA 124.664 1.185 . . . . 0.0 113.043 -174.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.455 ' HG3' ' HB2' ' A' ' 49' ' ' PHE . 67.6 Cg_endo -77.6 179.27 6.67 Favored 'Trans proline' 0 CA--C 1.574 2.492 0 C-N-CA 123.215 2.61 . . . . 0.0 112.734 174.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -62.06 127.8 22.27 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 121.953 1.768 . . . . 0.0 113.971 174.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.7 p -104.01 145.4 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 124.119 0.968 . . . . 0.0 109.884 173.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 77' ' ' ARG . 7.5 p -85.67 89.44 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.842 0 CA-C-O 122.192 0.996 . . . . 0.0 111.873 -176.111 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.469 HD21 ' HB3' ' A' ' 115' ' ' LEU . 7.9 mt -64.36 -24.06 67.51 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -177.774 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -73.27 -6.72 47.86 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 177.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.8 t -123.3 -12.99 7.76 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.679 0.791 . . . . 0.0 112.022 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 91.1 m -85.67 127.09 34.4 Favored 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 123.424 0.689 . . . . 0.0 112.171 -175.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -91.04 165.67 13.4 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.528 0.731 . . . . 0.0 111.518 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -63.32 -17.34 62.46 Favored 'General case' 0 CA--C 1.564 1.519 0 C-N-CA 124.398 1.079 . . . . 0.0 113.867 177.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 64.2 m -61.23 -24.91 66.7 Favored 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 122.696 0.398 . . . . 0.0 111.898 173.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.401 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -55.09 -38.9 68.68 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.418 0.687 . . . . 0.0 111.782 172.241 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.431 HD21 ' HB2' ' A' ' 112' ' ' LEU . 8.8 mp -67.47 3.4 1.33 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 124.647 1.179 . . . . 0.0 113.47 -176.713 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -95.72 -2.85 47.04 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.101 0.56 . . . . 0.0 110.357 174.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 75.6 m-85 -130.39 -53.24 1.1 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.122 1.369 . . . . 0.0 108.542 -177.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.699 HG12 ' HB2' ' A' ' 86' ' ' GLN . 17.0 m -89.07 177.87 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-O 122.256 1.027 . . . . 0.0 112.348 172.281 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.0 t -97.13 148.87 22.6 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 113.924 -1.489 . . . . 0.0 108.888 156.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.431 ' HB2' HD21 ' A' ' 107' ' ' LEU . 1.8 tt -57.99 -34.29 69.82 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 120.98 0.419 . . . . 0.0 109.958 170.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.91 -30.22 65.72 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.694 0.797 . . . . 0.0 112.524 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -71.57 -37.69 71.02 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.346 0.594 . . . . 0.0 110.131 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.652 HD23 ' HE1' ' A' ' 85' ' ' TRP . 75.9 mt -66.62 -50.0 64.44 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.652 0.781 . . . . 0.0 110.98 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -75.04 -37.7 61.65 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.065 -0.971 . . . . 0.0 112.582 -173.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -59.31 -25.65 64.33 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.469 173.249 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -120.05 19.84 12.22 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 123.526 0.731 . . . . 0.0 112.14 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.114 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 170.677 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.7 t . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 121.186 0.517 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.459 HG21 ' HB2' ' A' ' 82' ' ' ALA . 48.2 t -139.75 106.18 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.549 0.74 . . . . 0.0 109.871 -179.132 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 76.2 m -95.8 105.93 18.0 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.527 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -144.97 150.54 37.12 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.232 1.013 . . . . 0.0 108.793 -179.419 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -122.84 119.03 29.35 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 117.938 0.335 . . . . 0.0 110.632 -176.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 56.9 mtp -109.93 158.01 18.66 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.931 0.893 . . . . 0.0 111.274 178.155 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.41 ' OG1' ' HG2' ' A' ' 48' ' ' GLU . 25.6 p -96.86 158.85 15.23 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.971 0.908 . . . . 0.0 111.073 -177.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.594 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 23.7 tt0 -62.75 -29.12 70.45 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.973 -178.173 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.41 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 12.3 pt-20 -52.34 -45.41 65.65 Favored 'General case' 0 CA--C 1.565 1.548 0 C-N-CA 123.45 0.7 . . . . 0.0 112.73 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -79.38 -37.79 36.46 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 173.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.1 -20.16 64.91 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.73 -0.607 . . . . 0.0 111.616 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.594 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 76.4 mt -73.46 -30.74 63.37 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.536 1.134 . . . . 0.0 110.939 168.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.533 ' HE2' ' SD ' ' A' ' 93' ' ' MET . 13.7 m-85 -64.49 -47.65 78.15 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 118.319 0.509 . . . . 0.0 110.783 169.523 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.2 t . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.43 0.633 . . . . 0.0 111.577 176.044 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 68.87 26.33 74.69 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 116.69 -0.232 . . . . 0.0 113.118 -174.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -110.1 115.47 29.81 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.791 0.836 . . . . 0.0 110.065 176.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -99.17 84.89 3.11 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 171.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -158.76 116.63 2.88 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.244 0.618 . . . . 0.0 109.798 -175.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.0 t 43.84 33.86 0.8 Allowed 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 124.462 1.105 . . . . 0.0 113.218 175.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.527 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -62.85 123.42 18.44 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.97 0.908 . . . . 0.0 109.968 -174.421 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 63.0 m -62.6 105.44 0.64 Allowed 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.459 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -55.59 -26.05 41.71 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.208 1.003 . . . . 0.0 112.692 -177.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 65.2 m -58.87 -42.26 89.04 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.687 0.795 . . . . 0.0 112.474 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.7 mmt85 -69.68 -40.56 76.3 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.671 0.788 . . . . 0.0 112.04 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.619 ' HE1' HD23 ' A' ' 115' ' ' LEU . 15.9 t-105 -64.7 -54.14 36.37 Favored 'General case' 0 CA--C 1.559 1.296 0 C-N-CA 122.535 0.334 . . . . 0.0 110.162 175.502 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.744 ' HB2' HG12 ' A' ' 110' ' ' VAL . 29.5 tp60 -48.85 -43.64 38.9 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.906 0.882 . . . . 0.0 112.718 174.185 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -67.46 -33.48 75.21 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.839 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.22 -37.05 82.94 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 122.836 0.454 . . . . 0.0 111.361 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.647 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 81.5 t80 -58.13 -52.13 66.81 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.55 170.215 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -66.13 -23.97 66.59 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.749 0.819 . . . . 0.0 112.392 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.12 -5.89 59.32 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.783 0.833 . . . . 0.0 112.516 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.67 10.68 72.55 Favored Glycine 0 CA--C 1.538 1.496 0 N-CA-C 114.249 0.46 . . . . 0.0 114.249 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' MET . . . . . 0.533 ' SD ' ' HE2' ' A' ' 52' ' ' PHE . 97.2 mmm -97.98 -75.39 0.55 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.649 0.78 . . . . 0.0 110.902 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.647 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 53.95 82.85 0.24 Allowed Pre-proline 0 CA--C 1.565 1.553 0 C-N-CA 125.0 1.32 . . . . 0.0 113.494 -178.251 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -56.89 160.15 12.94 Favored 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.677 2.918 . . . . 0.0 114.557 170.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -63.79 106.32 0.62 Allowed 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 122.776 2.318 . . . . 0.0 113.234 174.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 10.6 p -96.05 154.25 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 C-N-CA 123.481 0.712 . . . . 0.0 110.261 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.562 HG21 ' HB3' ' A' ' 101' ' ' SER . 27.7 m -73.1 141.98 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.446 0 C-N-CA 123.472 0.709 . . . . 0.0 111.864 173.507 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 73.1 mt -105.32 -8.62 18.12 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 123.265 0.626 . . . . 0.0 111.252 167.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.15 2.73 29.53 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.531 1.132 . . . . 0.0 112.312 -170.726 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.562 ' HB3' HG21 ' A' ' 98' ' ' VAL . 21.8 t -132.51 -51.64 0.93 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.884 0.874 . . . . 0.0 110.989 -179.066 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 98.3 m -38.11 123.6 1.13 Allowed 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 125.222 1.409 . . . . 0.0 113.87 -177.432 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -83.54 174.54 10.49 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.314 1.045 . . . . 0.0 113.419 -171.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -61.32 -38.74 87.95 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.402 1.081 . . . . 0.0 112.468 177.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 39.3 t -63.36 -28.12 69.78 Favored 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.805 -176.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.482 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -64.55 -47.14 79.88 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.15 0.58 . . . . 0.0 111.725 173.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.62 -15.78 13.11 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 124.369 1.068 . . . . 0.0 113.117 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -75.93 -39.27 56.5 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.503 0.721 . . . . 0.0 110.189 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -87.38 -36.31 17.85 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.696 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.744 HG12 ' HB2' ' A' ' 86' ' ' GLN . 26.8 m -97.55 -56.42 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 -176.672 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' SER . . . . . 0.408 ' N ' HG23 ' A' ' 110' ' ' VAL . 38.4 t 83.67 134.11 0.05 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 125.924 1.689 . . . . 0.0 110.579 -151.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.655 ' HA ' HD12 ' A' ' 115' ' ' LEU . 1.7 tt -50.07 -30.64 11.31 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.281 1.032 . . . . 0.0 113.628 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.85 -36.11 71.86 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.179 0.592 . . . . 0.0 112.436 -178.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.65 -31.07 57.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.755 0.822 . . . . 0.0 110.637 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.655 HD12 ' HA ' ' A' ' 112' ' ' LEU . 56.9 mt -63.88 -56.18 17.25 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 123.879 0.872 . . . . 0.0 110.013 173.005 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -65.72 -28.72 69.26 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.074 0.95 . . . . 0.0 112.371 -175.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -49.17 -38.53 25.94 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -138.36 39.49 2.27 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-O 121.224 0.535 . . . . 0.0 111.818 178.183 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.139 0 C-N-CA 123.55 0.74 . . . . 0.0 111.094 170.38 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.406 ' O ' ' HB2' ' A' ' 105' ' ' SER . 18.2 p . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 121.558 0.694 . . . . 0.0 110.966 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.766 HG11 ' HB2' ' A' ' 82' ' ' ALA . 39.6 t -127.78 101.14 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.095 0.558 . . . . 0.0 109.831 174.429 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.5 m -111.38 106.59 15.57 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 171.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.427 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -139.32 150.67 45.65 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.36 1.064 . . . . 0.0 108.919 -176.454 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -116.62 108.54 16.07 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 122.065 -0.397 . . . . 0.0 110.584 -172.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.538 ' HB2' HD11 ' A' ' 50' ' ' LEU . 85.3 mmm -95.29 153.91 17.44 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.651 0.78 . . . . 0.0 111.024 177.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.411 ' OG1' ' HG2' ' A' ' 48' ' ' GLU . 73.0 p -90.94 156.47 17.96 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.898 0.879 . . . . 0.0 111.084 177.481 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.42 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 34.8 tt0 -62.7 -28.71 70.13 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.206 0.602 . . . . 0.0 112.146 -177.104 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.411 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 7.8 pt-20 -54.11 -38.05 64.97 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 122.825 0.45 . . . . 0.0 110.875 173.374 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.534 ' HB2' ' HG2' ' A' ' 95' ' ' PRO . 74.8 t80 -77.4 -45.59 25.4 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 123.658 0.783 . . . . 0.0 112.031 173.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' A' ' 45' ' ' MET . 9.0 mp -64.08 -41.12 97.42 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -174.171 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.42 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 88.6 mt -65.12 -31.33 72.48 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.768 0.427 . . . . 0.0 111.353 174.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -67.32 -44.07 80.05 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 123.647 0.779 . . . . 0.0 111.461 172.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 97.7 p . . . . . 0 N--CA 1.498 1.938 0 C-N-CA 123.499 0.72 . . . . 0.0 111.68 -179.253 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.998 0 CA-C-O 120.517 0.199 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 116.54 -11.17 16.27 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 116.193 -0.458 . . . . 0.0 113.668 -175.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -85.21 97.34 9.86 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 117.242 0.521 . . . . 0.0 110.59 175.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.534 ' HD2' HG21 ' A' ' 98' ' ' VAL . 44.8 ttp180 -96.66 84.12 3.58 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -174.95 120.7 0.21 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 125.873 1.669 . . . . 0.0 108.075 -174.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 36.2 m 59.47 27.99 17.26 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.511 0.724 . . . . 0.0 112.888 173.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.427 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -67.78 135.76 53.14 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 123.817 0.847 . . . . 0.0 110.559 -177.4 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.2 m -66.51 95.26 0.32 Allowed 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.845 0.858 . . . . 0.0 111.083 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.766 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -60.23 -29.42 68.74 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.847 0.859 . . . . 0.0 113.163 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.7 m -56.45 -35.21 67.62 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.553 0.741 . . . . 0.0 112.184 175.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -73.62 -41.56 62.64 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.136 0.974 . . . . 0.0 111.472 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 3.0 t-105 -66.54 -48.59 69.22 Favored 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 122.816 0.446 . . . . 0.0 110.366 176.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.56 ' HB2' HG12 ' A' ' 110' ' ' VAL . 11.0 tp60 -49.43 -43.28 44.61 Favored 'General case' 0 CA--C 1.564 1.481 0 C-N-CA 124.052 0.941 . . . . 0.0 111.885 169.168 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.11 -47.27 85.89 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.949 0.5 . . . . 0.0 111.765 175.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.05 -39.34 74.68 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -173.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.497 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 49.7 t80 -72.18 -45.06 61.92 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.354 0.261 . . . . 0.0 111.495 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -71.71 -21.59 61.75 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.253 0.621 . . . . 0.0 112.173 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.29 -24.59 29.81 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.036 0.934 . . . . 0.0 111.216 175.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.62 42.42 7.81 Favored Glycine 0 C--N 1.349 1.281 0 CA-C-N 116.418 -0.355 . . . . 0.0 113.474 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -142.05 12.54 2.02 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.032 0.933 . . . . 0.0 111.33 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.497 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -50.66 114.08 4.29 Favored Pre-proline 0 CA--C 1.566 1.586 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -176.028 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.534 ' HG2' ' HB2' ' A' ' 49' ' ' PHE . 12.0 Cg_exo -74.92 177.04 9.09 Favored 'Trans proline' 0 CA--C 1.57 2.296 0 C-N-CA 123.978 3.119 . . . . 0.0 112.651 170.165 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.479 ' HA ' ' HB3' ' A' ' 118' ' ' HIS . 65.5 Cg_endo -70.55 152.59 65.32 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.178 1.919 . . . . 0.0 113.715 174.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 14.9 p -138.1 167.68 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 124.294 1.038 . . . . 0.0 109.461 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.534 HG21 ' HD2' ' A' ' 77' ' ' ARG . 16.6 m -90.7 135.69 25.96 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 123.159 0.584 . . . . 0.0 111.231 169.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 12.5 mt -90.9 -36.9 13.89 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.598 0.713 . . . . 0.0 109.532 161.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -78.99 13.57 1.71 Allowed 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 125.093 1.357 . . . . 0.0 113.671 -171.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.477 ' HB3' HG21 ' A' ' 98' ' ' VAL . 46.3 t -147.01 -39.82 0.2 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.124 0.569 . . . . 0.0 111.279 179.59 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.7 m -61.78 130.14 44.32 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 122.697 0.399 . . . . 0.0 111.248 174.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -75.81 161.41 29.04 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.061 0.545 . . . . 0.0 111.957 -177.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.409 ' HA ' HD13 ' A' ' 107' ' ' LEU . 13.8 mptt -70.97 -17.5 62.65 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.532 0.733 . . . . 0.0 112.126 178.142 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' A' ' 40' ' ' THR . 49.6 m -60.82 -26.94 67.69 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.269 0.628 . . . . 0.0 111.938 174.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.431 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -61.72 -32.56 72.79 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.729 0.811 . . . . 0.0 112.587 176.14 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.5 mp -62.75 1.86 0.35 Allowed 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 125.027 1.331 . . . . 0.0 114.534 -174.637 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -96.12 -28.81 14.42 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.397 0.679 . . . . 0.0 110.214 177.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -97.64 -43.8 7.05 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.139 1.375 . . . . 0.0 109.139 -177.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.78 HG21 HD21 ' A' ' 115' ' ' LEU . 35.5 m -93.39 -171.25 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 122.087 0.946 . . . . 0.0 110.646 163.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 44.7 t -115.39 154.29 29.48 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 114.549 -1.205 . . . . 0.0 108.566 155.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.0 tt -48.8 -36.02 15.73 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.762 0.825 . . . . 0.0 111.513 170.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.64 74.63 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 123.937 0.895 . . . . 0.0 113.388 -177.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.72 -42.38 91.17 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.373 0.606 . . . . 0.0 110.463 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.78 HD21 HG21 ' A' ' 110' ' ' VAL . 6.4 mt -66.36 -52.43 46.98 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.791 -178.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -70.38 -25.11 63.1 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.173 0.989 . . . . 0.0 112.505 -174.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.78 -26.26 67.13 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 170.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' HIS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 96' ' ' PRO . 78.0 m80 -132.54 26.68 4.41 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.76 0.824 . . . . 0.0 112.16 -177.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.215 0 C-N-CA 124.125 0.97 . . . . 0.0 110.387 176.13 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 121.038 0.447 . . . . 0.0 110.742 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.9 t -125.62 122.8 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.708 0.803 . . . . 0.0 110.448 176.276 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 79.4 m -121.08 107.29 12.44 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 168.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.5 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -136.18 142.89 44.17 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.147 0.979 . . . . 0.0 108.645 179.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.452 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 17.4 tt0 -122.02 110.02 15.3 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.808 0.337 . . . . 0.0 110.548 -171.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.617 ' HB2' HD11 ' A' ' 50' ' ' LEU . 42.7 mmm -89.56 136.02 33.27 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.803 0.841 . . . . 0.0 109.157 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 14.7 t -82.23 159.98 23.1 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 176.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.471 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 31.7 tt0 -54.57 -32.07 57.82 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.364 0.666 . . . . 0.0 112.601 -172.412 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -57.29 -37.55 72.6 Favored 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -175.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -76.01 -39.83 54.91 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.617 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.3 mp -68.41 -25.02 64.83 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 120.97 0.414 . . . . 0.0 110.765 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.471 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 94.1 mt -74.98 -44.75 46.48 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.483 1.113 . . . . 0.0 109.835 170.337 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -55.99 -39.53 71.98 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.915 0.486 . . . . 0.0 111.006 174.074 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.478 0.932 0 C-N-CA 123.741 0.816 . . . . 0.0 111.892 -176.848 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.064 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 99.8 2.28 56.23 Favored Glycine 0 CA--C 1.537 1.465 0 N-CA-C 114.738 0.655 . . . . 0.0 114.738 -177.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -97.14 109.27 22.06 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 117.96 0.88 . . . . 0.0 111.834 173.532 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.452 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 27.6 ptt-85 -90.95 87.84 6.78 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-O 122.079 0.943 . . . . 0.0 109.482 168.287 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -166.75 118.67 0.97 Allowed 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.67 -167.114 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 73.5 m 50.03 22.47 0.91 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 178.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.5 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -59.08 -31.03 68.51 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.823 0.849 . . . . 0.0 112.103 -169.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 42.4 t 67.11 113.53 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.685 1.194 . . . . 0.0 110.613 -172.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.86 -29.42 66.95 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -172.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.7 t -63.69 -33.23 75.18 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.466 0.706 . . . . 0.0 112.417 177.03 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -66.09 -41.83 90.13 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.624 0.769 . . . . 0.0 111.406 177.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.511 ' NE1' HD23 ' A' ' 115' ' ' LEU . 1.5 t-105 -69.26 -49.34 56.99 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 123.107 0.563 . . . . 0.0 110.822 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -52.98 -41.79 64.92 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.783 0.833 . . . . 0.0 111.397 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -64.12 -24.57 67.74 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.596 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.43 82.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.086 0.555 . . . . 0.0 111.477 176.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -65.03 -43.59 91.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.197 0.599 . . . . 0.0 110.552 173.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -68.0 -22.64 64.99 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.95 0.9 . . . . 0.0 111.665 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.6 -3.68 56.49 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.916 0.886 . . . . 0.0 112.206 173.081 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.03 41.2 23.05 Favored Glycine 0 C--N 1.352 1.444 0 C-N-CA 122.937 0.303 . . . . 0.0 113.25 -178.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 1.8 mmt -130.19 -78.02 0.54 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.501 0.721 . . . . 0.0 110.879 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.74 94.39 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.262 0 C-N-CA 124.624 1.169 . . . . 0.0 112.69 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -74.27 158.02 45.3 Favored 'Trans proline' 0 CA--C 1.567 2.13 0 C-N-CA 122.533 2.155 . . . . 0.0 112.663 170.432 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -59.6 111.42 0.94 Allowed 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 122.295 1.997 . . . . 0.0 113.1 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 6.6 p -95.07 149.49 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.41 0 C-N-CA 123.914 0.886 . . . . 0.0 111.318 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.5 p -80.32 91.79 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.865 0 CA-C-O 122.259 1.028 . . . . 0.0 113.036 -173.188 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.455 HD21 ' HB3' ' A' ' 115' ' ' LEU . 3.4 mm? -70.48 -22.08 62.7 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -178.326 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -73.91 -17.61 61.01 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 71.6 m -124.92 -4.78 7.51 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 96.7 m -71.0 126.42 29.53 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.422 0.556 . . . . 0.0 111.388 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -85.38 157.74 20.43 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.549 0.74 . . . . 0.0 111.712 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -58.07 -31.83 67.45 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.804 1.242 . . . . 0.0 113.488 -176.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 73.4 m -60.87 -29.13 69.36 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.2 70.74 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.312 0.645 . . . . 0.0 112.611 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.18 -24.68 65.9 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.834 0.854 . . . . 0.0 111.995 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -68.42 -18.14 64.37 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.928 0.491 . . . . 0.0 111.678 178.512 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -102.81 -53.07 2.93 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.101 0.96 . . . . 0.0 110.803 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.723 HG23 ' HB3' ' A' ' 114' ' ' ASP . 0.9 OUTLIER -99.34 -37.22 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 C-N-CA 122.625 0.37 . . . . 0.0 111.901 -172.481 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.1 t 73.25 134.37 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 125.135 1.522 . . . . 0.0 110.817 -166.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' A' ' 115' ' ' LEU . 5.5 tt -45.88 -29.46 1.39 Allowed 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -175.666 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.62 -34.84 74.83 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.731 0.412 . . . . 0.0 112.07 -179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.723 ' HB3' HG23 ' A' ' 110' ' ' VAL . 27.7 t70 -73.74 -40.44 63.53 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.568 0.747 . . . . 0.0 111.073 177.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.593 HD12 ' HA ' ' A' ' 112' ' ' LEU . 82.1 mt -54.93 -51.84 64.84 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.205 1.002 . . . . 0.0 111.36 173.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.34 -22.79 57.34 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.29 -1.323 . . . . 0.0 112.492 -176.044 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.23 -19.4 5.17 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 172.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -138.76 21.01 2.68 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 174.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.396 0 O-C-N 121.772 -0.58 . . . . 0.0 111.329 173.825 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.483 1.212 0 CA-C-O 121.448 0.642 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.473 HG11 ' HB2' ' A' ' 82' ' ' ALA . 82.2 t -140.38 110.33 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.214 1.006 . . . . 0.0 108.747 174.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 71.9 m -95.99 105.53 17.57 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.543 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -143.38 151.25 40.2 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.084 1.354 . . . . 0.0 108.26 -178.429 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.532 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 24.2 tt0 -125.24 108.52 11.82 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.013 0.824 . . . . 0.0 112.245 -174.606 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 70.6 mtp -87.41 135.22 33.42 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.355 0.662 . . . . 0.0 109.522 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.564 HG23 ' HD1' ' A' ' 49' ' ' PHE . 0.9 OUTLIER -91.63 155.18 18.52 Favored 'General case' 0 N--CA 1.502 2.142 0 CA-C-N 118.154 0.433 . . . . 0.0 110.734 -179.952 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -56.11 -32.1 63.89 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.944 0.898 . . . . 0.0 113.024 -169.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -53.69 -45.04 70.24 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.584 0.707 . . . . 0.0 110.621 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.564 ' HD1' HG23 ' A' ' 46' ' ' THR . 86.7 m-85 -78.58 -35.16 46.23 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.958 1.303 . . . . 0.0 113.899 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.9 mp -68.08 -42.22 80.71 Favored 'General case' 0 N--CA 1.499 2.011 0 CA-C-N 119.365 0.984 . . . . 0.0 110.727 177.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 83.5 mt -67.93 -37.34 81.53 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.072 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.406 ' HD2' ' SD ' ' A' ' 93' ' ' MET . 68.9 t80 -65.9 -39.35 90.52 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.261 0.624 . . . . 0.0 111.425 176.244 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 43.8 t . . . . . 0 N--CA 1.484 1.239 0 C-N-CA 123.612 0.765 . . . . 0.0 110.694 177.72 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.918 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 66.4 40.95 94.65 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.486 -0.779 . . . . 0.0 113.464 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -124.94 104.88 8.83 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 122.854 0.461 . . . . 0.0 110.247 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.532 ' HB2' ' HB2' ' A' ' 44' ' ' GLU . 0.1 OUTLIER -83.5 88.03 7.0 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 122.813 0.445 . . . . 0.0 110.024 174.934 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -168.61 120.79 0.81 Allowed 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 124.261 1.024 . . . . 0.0 110.115 177.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 39.3 t 53.36 26.4 5.32 Favored 'General case' 0 N--CA 1.5 2.066 0 C-N-CA 124.687 1.195 . . . . 0.0 112.937 174.217 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.543 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -62.77 131.39 48.73 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.451 1.1 . . . . 0.0 111.041 -176.695 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 42.6 t -63.06 101.4 0.28 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.644 0.778 . . . . 0.0 111.394 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.473 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -59.08 -25.95 64.23 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.722 0.809 . . . . 0.0 112.297 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.5 m -69.33 -39.88 77.92 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.718 0.807 . . . . 0.0 112.029 174.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -74.99 -32.76 61.74 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.172 0.589 . . . . 0.0 111.338 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.571 ' HE1' HD23 ' A' ' 115' ' ' LEU . 3.4 t-105 -65.1 -46.73 79.87 Favored 'General case' 0 CA--C 1.567 1.598 0 C-N-CA 123.456 0.702 . . . . 0.0 109.377 171.249 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -57.49 -44.45 84.96 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.12 0.968 . . . . 0.0 111.576 174.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -60.25 -34.82 74.24 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.056 0.942 . . . . 0.0 111.42 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.89 -39.12 87.38 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 122.927 0.491 . . . . 0.0 111.739 175.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -66.76 -39.78 88.0 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 121.074 0.464 . . . . 0.0 110.715 176.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -69.22 -28.44 66.35 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 123.728 0.811 . . . . 0.0 111.425 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.18 -5.68 57.99 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.852 0.861 . . . . 0.0 111.978 173.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 92.76 -20.94 41.91 Favored Glycine 0 C--N 1.353 1.497 0 N-CA-C 114.226 0.45 . . . . 0.0 114.226 177.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' MET . . . . . 0.406 ' SD ' ' HD2' ' A' ' 52' ' ' PHE . 6.3 ptm -71.27 -87.92 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.773 0 C-N-CA 124.03 0.932 . . . . 0.0 112.59 -177.08 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 61.58 112.67 0.02 OUTLIER Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -67.69 176.72 4.77 Favored 'Trans proline' 0 N--CA 1.507 2.304 0 C-N-CA 123.498 2.799 . . . . 0.0 113.661 170.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -82.01 134.47 8.23 Favored 'Trans proline' 0 C--N 1.381 2.267 0 C-N-CA 122.402 2.068 . . . . 0.0 111.897 166.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.9 p -122.79 143.74 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.912 0.885 . . . . 0.0 110.179 177.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.3 p -94.65 120.2 43.72 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.652 0 C-N-CA 123.216 0.606 . . . . 0.0 111.852 -178.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.4 mt -61.0 -45.82 93.28 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.161 0.985 . . . . 0.0 113.384 -176.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -75.14 14.75 0.5 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.988 0.915 . . . . 0.0 113.451 -172.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.2 t -137.39 -5.73 1.8 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 123.521 0.728 . . . . 0.0 112.07 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 53.5 m -91.24 124.2 35.26 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.029 0.532 . . . . 0.0 110.888 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.8 mp0 -66.39 154.6 39.71 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.001 0.52 . . . . 0.0 112.194 175.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.437 ' O ' ' HD3' ' A' ' 104' ' ' LYS . 1.4 tmtp? -67.17 -19.32 65.56 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 123.633 0.773 . . . . 0.0 111.545 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 42.9 t -56.43 -26.68 54.35 Favored 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 123.715 0.806 . . . . 0.0 111.918 176.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.37 73.73 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.956 0.902 . . . . 0.0 112.692 174.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 10.6 mp -62.9 -6.82 4.16 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -173.159 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 59.6 mtp180 -83.67 -34.2 25.04 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 121.084 0.469 . . . . 0.0 111.526 172.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -102.21 -22.73 14.12 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.501 1.121 . . . . 0.0 111.524 -173.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.424 HG21 ' NE1' ' A' ' 85' ' ' TRP . 7.6 p -136.24 170.98 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 124.331 1.052 . . . . 0.0 108.756 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' SER . . . . . 0.512 ' HB3' ' HB2' ' A' ' 114' ' ' ASP . 28.7 t -92.97 151.29 20.0 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 121.747 -0.596 . . . . 0.0 111.277 170.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.9 tt -59.9 -44.63 94.16 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.551 0.34 . . . . 0.0 110.196 167.038 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.07 -30.65 69.35 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.298 0.639 . . . . 0.0 111.356 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.512 ' HB2' ' HB3' ' A' ' 111' ' ' SER . 5.5 t70 -67.1 -41.01 86.98 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.588 1.155 . . . . 0.0 110.45 175.706 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.571 HD23 ' HE1' ' A' ' 85' ' ' TRP . 71.3 mt -66.33 -53.48 35.88 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.845 0.858 . . . . 0.0 110.509 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLN . . . . . 0.46 ' HA ' ' HB3' ' A' ' 119' ' ' ALA . 11.3 mt-30 -69.47 -28.03 65.74 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.445 1.098 . . . . 0.0 111.947 -173.385 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -55.2 -37.03 66.56 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.283 0.633 . . . . 0.0 112.43 171.092 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -113.22 30.26 7.34 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.757 0.823 . . . . 0.0 111.455 178.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.46 ' HB3' ' HA ' ' A' ' 116' ' ' GLN . . . . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.494 1.729 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.604 HG11 ' HB2' ' A' ' 82' ' ' ALA . 42.3 t -139.5 110.6 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 C-N-CA 123.591 0.756 . . . . 0.0 110.618 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.8 m -108.23 106.92 17.31 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.631 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.27 151.31 41.91 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.45 0.7 . . . . 0.0 109.321 -168.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.465 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 29.1 tt0 -112.25 115.81 29.4 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.837 0.351 . . . . 0.0 111.667 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.443 ' HB3' HD11 ' A' ' 50' ' ' LEU . 75.5 mmm -95.19 114.84 26.68 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 170.487 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.695 ' HB ' ' HB2' ' A' ' 95' ' ' PRO . 92.4 m -83.56 147.73 27.59 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.34 0.656 . . . . 0.0 110.294 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.48 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 35.6 tt0 -47.31 -32.52 4.8 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -164.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -53.1 -41.87 65.39 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -76.08 -32.5 59.27 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.383 0.273 . . . . 0.0 111.595 175.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.598 HD22 ' HA ' ' A' ' 74' ' ' ALA . 5.3 mp -77.39 -22.54 51.48 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.803 0.441 . . . . 0.0 110.813 -177.665 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.48 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 70.2 mt -68.79 -46.82 67.72 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.811 1.244 . . . . 0.0 109.626 168.244 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -55.08 -48.77 73.08 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.427 1.091 . . . . 0.0 110.98 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 N--CA 1.484 1.261 0 C-N-CA 124.117 0.967 . . . . 0.0 111.949 177.802 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.598 ' HA ' HD22 ' A' ' 50' ' ' LEU . . . . . . . . 0 CA--C 1.55 0.942 0 CA-C-O 120.863 0.363 . . . . 0.0 111.543 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 75.65 44.88 19.32 Favored Glycine 0 C--N 1.346 1.12 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.811 -176.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -119.93 149.14 42.6 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.227 0.611 . . . . 0.0 109.96 173.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.465 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -135.54 91.68 2.75 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.206 0.602 . . . . 0.0 110.787 -174.713 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -179.61 123.8 0.08 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.551 1.141 . . . . 0.0 109.454 173.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.2 t 54.57 30.86 13.89 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.392 1.077 . . . . 0.0 112.706 177.242 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.631 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.4 tm? -68.6 131.77 45.78 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.697 0.799 . . . . 0.0 110.538 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 60.8 m -60.26 106.93 0.58 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.133 0.973 . . . . 0.0 110.761 176.231 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.604 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -64.5 -24.8 67.73 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.261 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.6 t -64.0 -34.01 77.02 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 122.756 0.422 . . . . 0.0 111.741 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -63.07 -37.99 89.38 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.82 0.848 . . . . 0.0 110.978 176.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -75.14 -50.62 15.74 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 124.279 1.032 . . . . 0.0 111.155 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.47 ' HB2' HG12 ' A' ' 110' ' ' VAL . 19.6 tp60 -49.1 -44.29 42.01 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.952 0.901 . . . . 0.0 112.07 173.382 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -69.61 -30.01 67.65 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.48 -43.13 91.21 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 122.822 0.449 . . . . 0.0 111.911 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.524 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 80.0 t80 -64.68 -41.37 96.1 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.134 0.574 . . . . 0.0 111.127 176.489 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -67.07 -29.94 69.85 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.612 0.765 . . . . 0.0 112.647 175.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.48 -14.7 56.7 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.598 0.759 . . . . 0.0 111.914 175.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 78.58 7.51 88.04 Favored Glycine 0 C--N 1.352 1.448 0 CA-C-N 116.25 -0.432 . . . . 0.0 113.318 -174.283 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 94.6 mmm -104.2 17.82 23.33 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.227 1.011 . . . . 0.0 112.075 -177.335 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.524 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -52.06 108.56 1.1 Allowed Pre-proline 0 CA--C 1.569 1.701 0 C-N-CA 125.39 1.476 . . . . 0.0 114.439 178.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.695 ' HB2' ' HB ' ' A' ' 46' ' ' THR . 32.3 Cg_endo -86.56 168.06 8.6 Favored 'Trans proline' 0 CA--C 1.571 2.327 0 C-N-CA 123.06 2.507 . . . . 0.0 113.172 175.205 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.79 126.58 21.6 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.853 2.369 . . . . 0.0 114.803 176.155 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.2 p -115.43 175.61 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 125.381 1.472 . . . . 0.0 109.363 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.414 HG21 ' HB3' ' A' ' 101' ' ' SER . 10.0 m -95.67 161.1 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.435 0 O-C-N 121.625 -0.672 . . . . 0.0 110.612 165.44 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.46 HD11 ' HG2' ' A' ' 116' ' ' GLN . 7.7 mt -113.44 -29.73 7.11 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.214 1.006 . . . . 0.0 108.889 161.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -59.43 -46.06 89.79 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.802 1.241 . . . . 0.0 112.082 -173.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.414 ' HB3' HG21 ' A' ' 98' ' ' VAL . 28.1 t -96.63 -23.83 16.3 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.008 178.101 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.7 m -63.49 110.1 1.85 Allowed 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 120.855 0.359 . . . . 0.0 111.482 175.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.0 mp0 -65.59 155.65 35.15 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.947 0.899 . . . . 0.0 112.11 178.255 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -66.86 -16.61 64.42 Favored 'General case' 0 N--CA 1.5 2.03 0 C-N-CA 123.45 0.7 . . . . 0.0 112.057 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.4 t -61.34 -26.34 67.74 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.095 0.958 . . . . 0.0 112.302 173.016 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.497 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -54.66 -37.64 65.96 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.117 0.567 . . . . 0.0 112.084 174.26 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 7.0 mp -65.85 4.04 0.69 Allowed 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 124.956 1.303 . . . . 0.0 113.261 -176.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 65.1 mtp85 -98.69 -10.19 23.56 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.485 1.114 . . . . 0.0 110.848 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -121.06 -49.28 2.2 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.997 1.319 . . . . 0.0 108.611 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.838 HG21 HD21 ' A' ' 115' ' ' LEU . 32.6 m -90.1 -174.32 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 CA-C-O 122.101 0.953 . . . . 0.0 111.09 167.675 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.9 t -110.02 160.68 16.22 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.219 155.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.58 -36.91 62.42 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.252 0.621 . . . . 0.0 112.39 173.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.36 -30.74 71.4 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -177.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -61.47 -46.36 90.39 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.307 0.575 . . . . 0.0 110.12 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.838 HD21 HG21 ' A' ' 110' ' ' VAL . 5.9 mt -66.55 -56.58 10.17 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.431 -175.05 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLN . . . . . 0.46 ' HG2' HD11 ' A' ' 99' ' ' LEU . 3.2 mt-30 -65.84 -24.65 66.94 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.479 -170.673 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -51.17 -40.32 58.37 Favored 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 172.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -140.7 21.52 2.33 Favored 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 123.258 0.623 . . . . 0.0 112.639 -176.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -178.56 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 45.0 p . . . . . 0 CA--C 1.552 1.029 0 CA-C-O 120.775 0.322 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.42 HG11 ' HB2' ' A' ' 82' ' ' ALA . 39.2 t -129.07 123.51 58.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.781 -0.574 . . . . 0.0 110.525 173.169 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 71.9 m -119.95 108.91 14.9 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 167.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.684 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -138.96 147.93 42.87 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.851 0.86 . . . . 0.0 108.835 -174.057 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -112.17 118.76 36.22 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 117.796 0.271 . . . . 0.0 111.501 -172.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.508 ' SD ' ' HB2' ' A' ' 85' ' ' TRP . 75.7 mmm -101.88 129.86 48.22 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.501 0.72 . . . . 0.0 110.641 178.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.47 ' H ' ' HB3' ' A' ' 95' ' ' PRO . 57.0 m -85.73 150.96 24.22 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.222 1.009 . . . . 0.0 110.412 -178.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -47.92 -30.01 3.84 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.631 1.573 . . . . 0.0 114.432 -172.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -48.19 -55.15 11.13 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.164 0.986 . . . . 0.0 112.179 177.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -74.39 -33.74 63.12 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.277 -176.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.8 mp -73.19 -35.61 66.39 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 117.914 0.324 . . . . 0.0 111.293 -176.411 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 38.8 mt -74.16 -33.67 63.56 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.972 0.509 . . . . 0.0 110.995 173.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -58.28 -51.92 67.76 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.908 0.483 . . . . 0.0 110.664 171.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.477 0.889 0 C-N-CA 123.662 0.785 . . . . 0.0 111.745 -179.691 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.004 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.85 20.8 25.28 Favored Glycine 0 CA--C 1.537 1.452 0 CA-C-N 115.648 -0.705 . . . . 0.0 113.431 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -95.99 134.02 39.51 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.565 0.746 . . . . 0.0 110.772 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.67 90.56 3.13 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.934 0.873 . . . . 0.0 111.791 172.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -173.96 121.4 0.3 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.485 1.114 . . . . 0.0 108.765 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 36.6 t 58.75 21.51 9.01 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.945 0.898 . . . . 0.0 112.374 177.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.684 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -68.87 112.92 5.85 Favored 'General case' 0 C--N 1.355 0.82 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 63.0 m -59.46 115.34 3.21 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.997 0.519 . . . . 0.0 109.967 176.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.42 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -56.28 -25.12 47.04 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -176.15 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.5 t -61.45 -33.32 73.54 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.623 0.769 . . . . 0.0 112.52 174.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -71.01 -40.21 71.93 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 123.852 0.861 . . . . 0.0 112.016 177.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.744 ' HE1' HD23 ' A' ' 115' ' ' LEU . 10.7 t-105 -68.84 -51.67 38.04 Favored 'General case' 0 CA--C 1.561 1.385 0 O-C-N 122.249 -0.282 . . . . 0.0 111.009 173.413 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.494 ' HB2' HG12 ' A' ' 110' ' ' VAL . 6.8 tp60 -48.43 -37.32 16.83 Favored 'General case' 0 CA--C 1.567 1.603 0 C-N-CA 124.167 0.987 . . . . 0.0 111.62 173.546 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -59.43 -44.04 92.98 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.634 1.174 . . . . 0.0 112.425 174.144 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.5 -36.6 73.9 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.149 0.58 . . . . 0.0 111.97 -173.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.726 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 65.5 t80 -66.02 -52.23 51.09 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.057 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -67.78 -22.52 65.19 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.92 -22.14 60.78 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.301 0.641 . . . . 0.0 111.528 171.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 102.26 -4.89 51.98 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 114.136 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 61.5 mtp -81.11 -70.14 0.55 Allowed 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 117.356 0.578 . . . . 0.0 109.909 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.726 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 57.21 92.05 0.07 OUTLIER Pre-proline 0 CA--C 1.557 1.224 0 C-N-CA 125.034 1.333 . . . . 0.0 113.54 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.47 ' HB3' ' H ' ' A' ' 46' ' ' THR . 93.5 Cg_exo -55.06 159.25 10.02 Favored 'Trans proline' 0 CA--C 1.564 2.004 0 C-N-CA 123.049 2.499 . . . . 0.0 114.496 163.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.65 110.98 2.0 Favored 'Trans proline' 0 CA--C 1.558 1.699 0 C-N-CA 121.776 1.651 . . . . 0.0 110.999 163.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -95.24 157.15 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 123.245 0.618 . . . . 0.0 110.224 178.127 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.52 HG21 ' HB3' ' A' ' 101' ' ' SER . 28.1 m -73.48 147.28 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.149 0 C-N-CA 123.097 0.559 . . . . 0.0 111.175 171.703 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.458 HD23 ' HG2' ' A' ' 116' ' ' GLN . 0.6 OUTLIER -105.17 -30.25 9.83 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 167.766 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -80.52 -14.42 58.26 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.629 1.171 . . . . 0.0 113.338 -172.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.52 ' HB3' HG21 ' A' ' 98' ' ' VAL . 33.0 t -119.6 -24.69 6.17 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 122.759 0.424 . . . . 0.0 111.783 -179.115 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 85.5 m -63.31 106.3 0.87 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.747 0.419 . . . . 0.0 111.113 172.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -76.57 160.31 29.55 Favored 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 124.167 0.987 . . . . 0.0 110.702 -176.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -57.98 -23.36 53.51 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -174.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.6 m -59.23 -32.23 69.78 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 120.765 0.317 . . . . 0.0 111.628 176.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.451 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -59.8 -36.36 76.58 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.556 0.742 . . . . 0.0 112.801 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.7 mp -65.47 5.49 0.41 Allowed 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 124.615 1.166 . . . . 0.0 113.495 -178.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 49.4 mtp180 -98.72 -26.01 14.49 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.044 0.938 . . . . 0.0 110.525 175.234 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -95.79 -53.15 3.8 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.731 1.212 . . . . 0.0 108.065 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.626 HG21 HD21 ' A' ' 115' ' ' LEU . 33.1 m -91.02 -171.54 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 122.207 1.003 . . . . 0.0 111.569 170.202 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 47.1 t -114.52 161.1 18.46 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.304 -1.316 . . . . 0.0 108.216 156.227 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.2 tt -53.88 -40.24 66.42 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.479 0.311 . . . . 0.0 110.97 168.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.89 -30.31 67.68 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.524 0.73 . . . . 0.0 112.43 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.57 -39.09 88.3 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.613 0.765 . . . . 0.0 110.298 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.744 HD23 ' HE1' ' A' ' 85' ' ' TRP . 23.4 mt -71.61 -53.67 12.92 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.738 -177.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLN . . . . . 0.458 ' HG2' HD23 ' A' ' 99' ' ' LEU . 28.6 mt-30 -69.51 -27.16 64.95 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.445 -173.757 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -50.53 -54.54 21.62 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.878 0.871 . . . . 0.0 113.331 177.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 23.1 t-80 -99.9 -14.36 18.77 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.4 ' HB1' HD11 ' A' ' 99' ' ' LEU . . . . . . . . 0 CA--C 1.557 1.232 0 O-C-N 122.195 -0.316 . . . . 0.0 111.051 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 120.663 0.268 . . . . 0.0 111.325 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 84.26 -136.04 14.32 Favored Glycine 0 C--N 1.349 1.26 0 N-CA-C 111.858 -0.497 . . . . 0.0 111.858 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -92.97 150.27 20.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-N 117.357 0.578 . . . . 0.0 110.781 176.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -146.77 153.56 25.42 Favored Glycine 0 N--CA 1.478 1.481 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.354 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -90.57 137.72 32.13 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 117.248 0.524 . . . . 0.0 111.045 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -100.12 163.72 12.3 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.79 0.836 . . . . 0.0 111.692 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.2 m -68.32 -24.93 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 CA-C-O 121.72 0.772 . . . . 0.0 111.07 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 62.9 mt -81.38 -21.99 38.64 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.622 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.78 -71.05 0.91 Allowed Glycine 0 C--N 1.353 1.495 0 N-CA-C 114.608 0.603 . . . . 0.0 114.608 -175.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -156.43 150.01 24.67 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 117.128 0.464 . . . . 0.0 111.2 -176.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.3 t0 67.25 151.85 0.07 Allowed 'General case' 0 CA--C 1.567 1.615 0 C-N-CA 125.153 1.381 . . . . 0.0 113.939 164.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.0 tp -168.88 24.13 0.02 OUTLIER 'General case' 0 CA--C 1.566 1.579 0 C-N-CA 123.918 0.887 . . . . 0.0 109.948 175.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -87.13 151.03 23.55 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.492 0.717 . . . . 0.0 111.854 -177.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.527 HG23 ' HG3' ' A' ' 100' ' ' GLN . 8.7 p -91.61 146.29 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.437 0 C-N-CA 123.466 0.707 . . . . 0.0 110.26 177.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 36.0 t -163.94 85.55 0.47 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.865 0.466 . . . . 0.0 111.92 -172.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 35.6 t 55.91 6.36 0.21 Allowed 'General case' 0 N--CA 1.509 2.509 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 169.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 35.2 t 60.51 19.27 9.07 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 124.373 1.069 . . . . 0.0 111.815 -167.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -160.5 146.61 11.58 Favored Pre-proline 0 CA--C 1.56 1.328 0 C-N-CA 124.876 1.271 . . . . 0.0 110.395 -173.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_exo -47.49 -36.73 24.69 Favored 'Trans proline' 0 C--N 1.385 2.469 0 C-N-CA 123.812 3.008 . . . . 0.0 116.064 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.8 mtt -87.88 138.4 31.49 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.03 0.532 . . . . 0.0 110.882 173.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 19.2 p -86.02 85.51 7.37 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.466 0.706 . . . . 0.0 111.836 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -85.37 98.17 2.23 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-N 116.054 -0.521 . . . . 0.0 113.168 177.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -74.49 84.54 2.01 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -124.98 19.15 8.44 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.613 1.165 . . . . 0.0 109.343 163.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 38.9 ttp180 55.8 74.99 0.35 Allowed 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 124.818 1.247 . . . . 0.0 110.971 -170.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -119.41 -100.37 0.43 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 122.953 0.501 . . . . 0.0 110.577 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.432 ' O ' HG22 ' A' ' 14' ' ' VAL . . . -93.35 45.11 2.42 Favored Glycine 0 C--N 1.358 1.76 0 CA-C-N 118.09 0.404 . . . . 0.0 112.903 -177.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -106.41 -34.24 7.48 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.06 0.944 . . . . 0.0 108.787 169.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.7 ' SG ' ' HA ' ' A' ' 101' ' ' SER . 55.5 m 60.27 21.66 11.1 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.174 1.39 . . . . 0.0 113.15 174.464 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -87.2 59.57 5.66 Favored 'General case' 0 CA--C 1.556 1.176 0 CA-C-O 121.921 0.867 . . . . 0.0 110.107 -179.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.448 HG22 ' HG2' ' A' ' 103' ' ' GLU . 9.0 t -91.73 -21.11 20.9 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.357 174.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -68.39 126.44 29.62 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 168.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.48 -25.33 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 C-N-CA 123.59 0.756 . . . . 0.0 112.671 -176.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -169.02 -49.82 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.365 1.066 . . . . 0.0 109.583 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -142.73 -63.0 0.42 Allowed 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.314 -177.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 75.3 mtt85 -85.4 113.48 21.72 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.953 -177.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.4 -100.4 0.31 Allowed Glycine 0 CA--C 1.534 1.227 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 167.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.3 t -170.58 -64.99 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.541 0.736 . . . . 0.0 110.23 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -151.31 38.95 0.65 Allowed 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.454 0.702 . . . . 0.0 110.466 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 68.1 p -95.7 102.76 14.59 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.493 0.663 . . . . 0.0 111.303 -173.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.824 HG21 ' HB2' ' A' ' 82' ' ' ALA . 53.2 t -134.44 111.1 14.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.602 1.161 . . . . 0.0 109.516 175.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 78.2 m -107.44 106.69 17.21 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 169.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.555 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -143.76 152.39 41.19 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.679 1.191 . . . . 0.0 108.904 -175.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -117.54 109.57 16.87 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 121.638 -0.663 . . . . 0.0 111.71 -176.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.488 ' HB3' HD11 ' A' ' 50' ' ' LEU . 89.7 mmm -93.02 141.98 27.8 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.983 0.913 . . . . 0.0 110.838 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.4 p -93.78 156.84 16.45 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.025 0.53 . . . . 0.0 111.497 -176.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -68.15 -33.64 74.84 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.124 0.569 . . . . 0.0 111.713 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -53.61 -49.17 68.4 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 124.194 0.998 . . . . 0.0 111.307 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -77.48 -33.45 54.52 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.087 0.955 . . . . 0.0 111.864 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.488 HD11 ' HB3' ' A' ' 45' ' ' MET . 5.2 mp -77.6 -33.71 53.68 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 113.55 0.945 . . . . 0.0 113.55 -176.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 61.0 mt -71.97 -34.67 69.15 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.901 0.481 . . . . 0.0 110.713 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.418 ' CD2' ' SD ' ' A' ' 93' ' ' MET . 81.9 t80 -63.44 -52.55 61.01 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.074 0.549 . . . . 0.0 110.688 175.3 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.7 t -67.63 -30.42 69.98 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.853 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.583 ' HG3' ' HA ' ' A' ' 59' ' ' ASP . 71.1 ttt-85 -61.08 -58.35 8.75 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.12 0.568 . . . . 0.0 111.416 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -84.09 4.9 28.16 Favored 'General case' 0 CA--C 1.556 1.206 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -176.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -70.36 -43.19 70.67 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 122.899 0.479 . . . . 0.0 110.772 167.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 160.95 38.11 0.02 OUTLIER Glycine 0 N--CA 1.479 1.518 0 N-CA-C 114.668 0.627 . . . . 0.0 114.668 176.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.449 ' O ' ' HA ' ' A' ' 54' ' ' ARG . 44.8 t-20 -174.51 118.21 0.21 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.809 0.843 . . . . 0.0 108.815 176.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.583 ' HA ' ' HG3' ' A' ' 54' ' ' ARG . 17.3 m-20 -69.79 105.83 2.91 Favored 'General case' 0 CA--C 1.555 1.151 0 CA-C-O 120.87 0.367 . . . . 0.0 111.889 178.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.482 HD23 ' HG ' ' A' ' 50' ' ' LEU . 8.2 mp -67.69 -30.59 70.15 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.92 0.888 . . . . 0.0 109.953 170.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.493 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 1.7 mpt? -100.3 -144.99 0.34 Allowed 'General case' 0 CA--C 1.563 1.457 0 C-N-CA 124.401 1.08 . . . . 0.0 108.145 168.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 70.4 p -96.39 165.41 16.25 Favored Pre-proline 0 N--CA 1.492 1.637 0 C-N-CA 123.26 0.624 . . . . 0.0 110.552 169.06 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -72.49 34.69 0.31 Allowed 'Trans proline' 0 C--N 1.39 2.747 0 C-N-CA 123.154 2.57 . . . . 0.0 114.225 174.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -116.51 145.81 36.08 Favored Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 124.2 1.0 . . . . 0.0 109.938 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -71.31 -6.99 20.39 Favored 'Trans proline' 0 C--N 1.382 2.318 0 C-N-CA 122.612 2.208 . . . . 0.0 113.528 175.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -80.5 168.05 19.4 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.049 0.94 . . . . 0.0 110.983 175.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -87.15 37.0 0.75 Allowed 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.454 0.702 . . . . 0.0 111.749 -174.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -84.69 112.06 20.13 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 124.088 0.955 . . . . 0.0 110.33 -179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -119.19 144.25 35.8 Favored Pre-proline 0 N--CA 1.486 1.364 0 C-N-CA 124.203 1.001 . . . . 0.0 110.606 177.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -69.6 -45.73 1.57 Allowed 'Trans proline' 0 C--N 1.374 1.915 0 C-N-CA 122.157 1.905 . . . . 0.0 112.762 173.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -175.79 145.72 7.81 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 55.37 92.37 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.722 1.209 . . . . 0.0 112.339 -175.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -165.96 1.35 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.112 0.965 . . . . 0.0 110.519 177.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.96 111.09 6.08 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.597 0.759 . . . . 0.0 112.686 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 109.3 -1.17 31.11 Favored Glycine 0 N--CA 1.474 1.208 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 175.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -74.77 93.8 2.65 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 117.55 0.675 . . . . 0.0 110.991 173.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -85.63 85.0 7.43 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 173.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.6 t90 163.11 127.7 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 125.27 1.428 . . . . 0.0 108.552 -171.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 51.4 t 52.28 27.3 4.64 Favored 'General case' 0 N--CA 1.505 2.294 0 C-N-CA 124.184 0.994 . . . . 0.0 112.744 174.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.555 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.6 tm? -66.11 130.41 43.14 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.216 -176.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.4 t -57.22 104.44 0.16 Allowed 'General case' 0 N--CA 1.474 0.732 0 O-C-N 123.638 0.586 . . . . 0.0 110.957 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.824 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -51.72 -35.72 44.13 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.652 1.181 . . . . 0.0 112.897 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.8 m -63.97 -32.81 74.48 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.055 0.942 . . . . 0.0 112.286 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.464 ' HD2' HD23 ' A' ' 60' ' ' LEU . 46.3 ttp180 -71.6 -47.75 52.72 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.246 0.618 . . . . 0.0 112.041 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.472 ' HE1' HD23 ' A' ' 115' ' ' LEU . 8.3 t-105 -59.21 -47.77 84.11 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.284 0.564 . . . . 0.0 109.966 174.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.411 HE21 ' HG3' ' A' ' 90' ' ' GLU . 22.6 tp60 -60.31 -39.15 85.99 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.923 177.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -65.32 -43.28 91.47 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.137 0.575 . . . . 0.0 111.556 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.86 -24.98 60.94 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.244 0.217 . . . . 0.0 111.446 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.597 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 49.1 t80 -66.87 -48.52 68.55 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-O 120.909 0.385 . . . . 0.0 110.331 171.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.411 ' HG3' HE21 ' A' ' 86' ' ' GLN . 39.8 mt-10 -65.5 -27.05 68.2 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.807 0.843 . . . . 0.0 112.109 177.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.73 -2.31 22.83 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.348 0.659 . . . . 0.0 112.465 174.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.39 23.0 63.79 Favored Glycine 0 C--N 1.355 1.631 0 CA-C-N 116.662 -0.245 . . . . 0.0 113.542 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' MET . . . . . 0.418 ' SD ' ' CD2' ' A' ' 52' ' ' PHE . 67.9 mtp -114.6 -86.06 0.6 Allowed 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 123.571 0.749 . . . . 0.0 111.129 -175.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.597 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 63.71 108.47 0.03 OUTLIER Pre-proline 0 CA--C 1.573 1.83 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 175.572 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -67.59 167.68 20.27 Favored 'Trans proline' 0 C--N 1.386 2.52 0 C-N-CA 123.367 2.711 . . . . 0.0 113.809 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.05 105.54 0.85 Allowed 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.396 2.064 . . . . 0.0 111.97 171.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.5 p -95.16 142.58 13.36 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 C-N-CA 123.631 0.773 . . . . 0.0 110.934 -176.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.435 HG12 HD13 ' A' ' 120' ' ' LEU . 4.9 m -75.14 94.55 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.834 -178.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.424 HD11 ' HG2' ' A' ' 116' ' ' GLN . 3.3 mm? -58.9 -27.49 65.28 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 123.585 0.754 . . . . 0.0 112.352 173.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.527 ' HG3' HG23 ' A' ' 14' ' ' VAL . 10.5 tt0 -69.62 -47.01 64.94 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.742 0.817 . . . . 0.0 112.085 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.7 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 32.6 t -92.97 -30.47 15.33 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -171.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.8 p -56.6 121.03 8.76 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 170.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.448 ' HG2' HG22 ' A' ' 31' ' ' THR . 3.7 mp0 -84.83 172.55 11.34 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.893 0.877 . . . . 0.0 112.106 -177.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -72.55 -28.24 62.71 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 122.972 0.509 . . . . 0.0 111.015 -172.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.2 t -59.64 -25.97 65.13 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.63 0.772 . . . . 0.0 112.367 176.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.52 -37.65 70.73 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.885 0.874 . . . . 0.0 113.299 177.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.0 mp -65.81 2.78 0.93 Allowed 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -173.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 -98.4 -20.24 17.26 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 123.107 0.563 . . . . 0.0 111.618 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -109.07 -32.01 7.4 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.586 HG12 ' H ' ' A' ' 111' ' ' SER . 2.5 t -110.09 -166.06 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 CA-C-N 112.395 -2.184 . . . . 0.0 108.529 -178.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' SER . . . . . 0.586 ' H ' HG12 ' A' ' 110' ' ' VAL . 58.2 p -140.73 156.05 46.29 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 121.591 -0.693 . . . . 0.0 109.594 164.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.2 tt -53.5 -45.47 69.7 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.275 0.63 . . . . 0.0 112.114 173.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.17 -39.47 82.6 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.314 0.645 . . . . 0.0 111.997 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -64.52 -36.22 83.49 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.543 0.737 . . . . 0.0 112.02 175.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.472 HD23 ' HE1' ' A' ' 85' ' ' TRP . 39.2 mt -66.82 -55.58 14.2 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-O 121.214 0.53 . . . . 0.0 109.671 177.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.424 ' HG2' HD11 ' A' ' 99' ' ' LEU . 2.8 mt-30 -64.75 -34.88 79.37 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.27 1.028 . . . . 0.0 112.213 -172.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.8 -40.69 69.77 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.901 0.88 . . . . 0.0 112.656 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -123.76 47.61 2.01 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.288 0.635 . . . . 0.0 110.36 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -61.45 155.07 22.69 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 175.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.435 HD13 HG12 ' A' ' 98' ' ' VAL . 2.5 pt? -63.62 166.4 9.49 Favored Pre-proline 0 CA--C 1.567 1.621 0 C-N-CA 123.923 0.889 . . . . 0.0 111.753 173.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -54.08 108.17 0.27 Allowed 'Trans proline' 0 C--N 1.381 2.243 0 C-N-CA 122.665 2.243 . . . . 0.0 112.009 165.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 60.7 t -73.66 87.42 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 CA-C-O 121.703 0.763 . . . . 0.0 110.388 -177.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 94.6 mt -80.4 120.4 24.37 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.038 175.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -71.47 112.94 8.0 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.307 0.643 . . . . 0.0 110.327 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -99.5 132.75 44.62 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.819 0.848 . . . . 0.0 109.487 173.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -69.11 104.51 2.17 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.97 0.508 . . . . 0.0 111.122 -177.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 50.7 m80 -71.07 103.55 2.76 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.929 0.892 . . . . 0.0 110.818 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -80.98 8.54 8.18 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.536 0.734 . . . . 0.0 111.992 176.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -64.71 -28.18 69.42 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 123.646 0.778 . . . . 0.0 111.268 173.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 . . . . . 0 CA--C 1.57 1.722 0 CA-C-O 118.964 -0.541 . . . . 0.0 110.292 172.732 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.4 ttm . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 110.442 -0.207 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 77.75 -104.06 1.94 Allowed Glycine 0 CA--C 1.535 1.31 0 CA-C-N 116.377 -0.374 . . . . 0.0 113.912 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -118.28 150.09 40.05 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.757 0.823 . . . . 0.0 110.434 -176.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.52 148.37 48.38 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 114.229 0.451 . . . . 0.0 114.229 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -90.78 165.55 13.59 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.077 0.951 . . . . 0.0 111.463 -175.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.431 HD22 ' N ' ' A' ' 6' ' ' ASN . 0.1 OUTLIER -158.8 -175.02 5.06 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.464 0.706 . . . . 0.0 111.637 -174.375 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.0 m -110.43 -14.27 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 C-N-CA 123.494 0.717 . . . . 0.0 111.456 175.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.9 mp -87.07 -63.62 1.28 Allowed 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.015 0.526 . . . . 0.0 111.125 -162.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -164.22 -62.27 0.02 OUTLIER Glycine 0 CA--C 1.529 0.925 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.111 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.628 ' HG3' ' H ' ' A' ' 11' ' ' ASP . 18.8 pt20 -143.94 -71.79 0.29 Allowed 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.96 0.904 . . . . 0.0 110.175 177.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.628 ' H ' ' HG3' ' A' ' 10' ' ' GLN . 11.0 m-20 55.57 162.97 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 125.711 1.604 . . . . 0.0 114.402 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.1 tp 70.01 157.25 0.16 Allowed 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 124.668 1.187 . . . . 0.0 110.487 -167.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 67.42 -159.97 0.23 Allowed 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 124.351 1.06 . . . . 0.0 111.193 -177.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.642 HG23 ' H ' ' A' ' 28' ' ' PHE . 12.8 p -66.39 152.93 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.434 0 C-N-CA 123.162 0.585 . . . . 0.0 111.441 174.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.402 ' SG ' ' HB3' ' A' ' 28' ' ' PHE . 30.3 p -53.74 -32.5 52.37 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 123.597 0.759 . . . . 0.0 112.151 172.005 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.544 ' H ' HG22 ' A' ' 14' ' ' VAL . 49.5 t 73.06 -65.68 0.35 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 125.737 1.615 . . . . 0.0 112.618 175.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 43.4 t -75.75 76.96 2.7 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 121.598 0.713 . . . . 0.0 111.351 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -168.46 132.52 1.36 Allowed Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.611 1.164 . . . . 0.0 108.979 -178.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -57.04 143.44 92.8 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 123.05 2.5 . . . . 0.0 114.18 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.9 mtt 65.7 8.04 4.93 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 172.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 72.7 p -80.56 -56.46 4.15 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-N 118.517 0.599 . . . . 0.0 109.726 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 57.62 -104.58 0.45 Allowed Glycine 0 C--N 1.35 1.321 0 C-N-CA 124.297 0.951 . . . . 0.0 114.604 170.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 11.7 m-90 -82.94 57.33 3.83 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.861 0.864 . . . . 0.0 111.0 177.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 74.77 -44.16 0.54 Allowed 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 125.962 1.705 . . . . 0.0 114.608 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 53.6 ttt-85 68.02 -73.09 0.09 Allowed 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.849 1.26 . . . . 0.0 110.501 -169.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -141.38 4.01 1.76 Allowed 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.304 1.042 . . . . 0.0 111.111 175.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 78.27 77.46 0.86 Allowed Glycine 0 CA--C 1.534 1.219 0 N-CA-C 110.951 -0.859 . . . . 0.0 110.951 -166.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.642 ' H ' HG23 ' A' ' 14' ' ' VAL . 28.4 t80 -63.52 148.21 49.33 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.355 0.662 . . . . 0.0 111.911 -175.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 75.4 m 72.56 22.36 3.34 Favored 'General case' 0 N--CA 1.5 2.042 0 C-N-CA 125.683 1.593 . . . . 0.0 112.186 -172.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -80.27 107.53 13.14 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.629 0.772 . . . . 0.0 110.46 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.6 t -117.89 102.28 8.96 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.23 0.612 . . . . 0.0 111.22 -177.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -155.85 160.95 40.63 Favored 'General case' 0 CA--C 1.555 1.173 0 CA-C-O 121.077 0.465 . . . . 0.0 111.439 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -69.96 -34.33 59.43 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.426 0 C-N-CA 124.09 0.956 . . . . 0.0 112.894 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -154.12 -60.44 0.13 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.142 0.577 . . . . 0.0 111.638 -174.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -70.97 95.0 1.13 Allowed 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.714 0.805 . . . . 0.0 111.4 -169.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -59.59 100.21 0.08 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 114.698 -1.137 . . . . 0.0 112.606 -178.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.46 -136.69 7.35 Favored Glycine 0 C--N 1.347 1.176 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.787 178.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.2 t -86.83 84.29 7.38 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.418 0.687 . . . . 0.0 111.383 -177.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -144.17 14.08 1.65 Allowed 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 124.032 0.933 . . . . 0.0 110.285 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.425 ' HB ' ' HG2' ' A' ' 103' ' ' GLU . 26.4 m -92.41 108.14 19.74 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.268 0.627 . . . . 0.0 110.704 -167.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.498 HG21 ' HB2' ' A' ' 82' ' ' ALA . 26.2 t -131.37 112.98 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 124.267 1.027 . . . . 0.0 110.426 -177.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 81.6 m -107.09 108.04 19.32 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 171.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.414 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -145.12 153.74 41.72 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.28 1.032 . . . . 0.0 109.138 -176.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.668 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 27.8 tt0 -119.12 107.76 13.86 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 118.708 0.685 . . . . 0.0 111.88 177.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.591 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 81.5 mmm -84.8 114.47 22.1 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.102 0.961 . . . . 0.0 109.035 166.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.6 t -80.94 151.61 28.45 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 122.86 0.464 . . . . 0.0 110.301 -176.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.406 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 28.8 tt0 -56.84 -33.62 66.97 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 123.558 0.536 . . . . 0.0 111.706 -175.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -50.76 -55.69 15.56 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 124.165 0.986 . . . . 0.0 110.99 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -79.67 -29.61 40.93 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 124.661 1.185 . . . . 0.0 113.189 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.1 tp -82.69 -24.49 33.65 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.304 0.641 . . . . 0.0 111.894 -173.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 47' ' ' GLU . 63.8 mt -64.92 -34.03 77.42 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 122.885 0.474 . . . . 0.0 110.55 171.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -58.31 -44.46 88.6 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.13 0.572 . . . . 0.0 110.899 169.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.1 m -68.88 -30.06 68.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.201 0.6 . . . . 0.0 111.777 175.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.69 ' HA ' ' HB3' ' A' ' 59' ' ' ASP . 39.3 ttp180 -67.1 -55.88 12.36 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.989 0.916 . . . . 0.0 111.849 -177.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -69.72 -13.38 62.26 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.661 0.784 . . . . 0.0 112.089 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -76.28 -23.1 54.39 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.056 0.943 . . . . 0.0 111.326 170.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.96 -7.12 57.08 Favored Glycine 0 N--CA 1.477 1.396 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.932 -176.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -97.65 39.05 1.23 Allowed 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 124.244 1.017 . . . . 0.0 111.232 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.69 ' HB3' ' HA ' ' A' ' 54' ' ' ARG . 3.9 p-10 -69.94 120.88 16.33 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-O 121.429 0.633 . . . . 0.0 112.252 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.9 tp -97.33 26.27 4.98 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-O 121.989 0.899 . . . . 0.0 109.316 169.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.48 ' SD ' ' HB2' ' A' ' 74' ' ' ALA . 19.5 mmt -72.28 -60.66 2.12 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.461 1.104 . . . . 0.0 110.835 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.509 HG22 ' HG3' ' A' ' 64' ' ' ARG . 26.8 m 56.86 94.86 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.231 0 C-N-CA 124.979 1.312 . . . . 0.0 110.793 -171.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -52.1 -48.25 22.58 Favored 'Trans proline' 0 C--N 1.383 2.38 0 C-N-CA 123.232 2.621 . . . . 0.0 113.887 -174.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.509 ' HG3' HG22 ' A' ' 62' ' ' THR . 64.1 mtm180 56.18 86.5 0.16 Allowed Pre-proline 0 N--CA 1.488 1.439 0 C-N-CA 123.511 0.724 . . . . 0.0 111.21 -177.047 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -82.71 24.11 0.76 Allowed 'Trans proline' 0 C--N 1.372 1.795 0 C-N-CA 123.189 2.593 . . . . 0.0 113.659 -172.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -88.54 -92.61 0.11 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.066 0.947 . . . . 0.0 110.263 -173.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -142.01 -81.02 0.22 Allowed 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 176.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -158.9 115.44 2.69 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.12 0.968 . . . . 0.0 109.276 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -128.49 153.86 79.33 Favored Pre-proline 0 N--CA 1.489 1.493 0 C-N-CA 124.164 0.986 . . . . 0.0 110.861 -173.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.22 177.11 2.72 Favored 'Trans proline' 0 C--N 1.386 2.543 0 C-N-CA 122.946 2.431 . . . . 0.0 114.6 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 123.11 -132.09 8.46 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.287 -174.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -149.64 175.57 11.43 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.435 0.694 . . . . 0.0 111.204 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.38 -174.78 4.67 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.743 0.817 . . . . 0.0 110.464 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.48 ' HB2' ' SD ' ' A' ' 61' ' ' MET . . . -62.09 106.85 0.77 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.509 0.723 . . . . 0.0 112.844 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 82.43 56.94 2.71 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.952 -174.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -147.03 107.21 4.02 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 123.683 0.793 . . . . 0.0 110.462 176.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.668 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 4.8 ptp180 -79.78 89.83 5.23 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.245 0.618 . . . . 0.0 111.606 -176.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 31.3 t-105 -178.06 122.07 0.1 Allowed 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.789 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 42.3 t 52.36 53.82 11.72 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.155 0.982 . . . . 0.0 112.226 174.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.414 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.3 tm? -92.99 124.24 36.82 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.626 -175.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 61.5 m -59.39 111.97 1.58 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.023 0.529 . . . . 0.0 109.995 173.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.498 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -57.47 -27.29 62.36 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -171.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.8 m -69.59 -28.76 66.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.396 0.679 . . . . 0.0 112.266 176.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -61.89 -45.11 95.18 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.803 0.841 . . . . 0.0 111.325 175.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.591 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 1.3 t-105 -70.85 -47.92 56.73 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.63 174.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.48 HE21 ' HG3' ' A' ' 90' ' ' GLU . 21.2 tp60 -56.15 -42.79 77.56 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.098 0.959 . . . . 0.0 111.665 -177.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -55.31 -45.54 76.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.724 0.81 . . . . 0.0 111.574 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.21 -37.76 86.57 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.457 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.529 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 51.6 t80 -71.9 -34.41 69.11 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 122.439 0.296 . . . . 0.0 111.649 178.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.48 ' HG3' HE21 ' A' ' 86' ' ' GLN . 58.3 mt-10 -69.45 -23.11 63.63 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.206 0.602 . . . . 0.0 111.754 178.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.61 -11.37 59.66 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.558 0.743 . . . . 0.0 111.99 170.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.81 8.8 86.31 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-N 116.496 -0.32 . . . . 0.0 112.995 -174.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 25.9 ttt -88.13 -77.95 0.34 Allowed 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 124.313 1.045 . . . . 0.0 110.135 -174.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.529 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 61.94 114.18 0.02 OUTLIER Pre-proline 0 N--CA 1.497 1.905 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 167.002 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.443 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 92.6 Cg_endo -74.6 171.46 18.12 Favored 'Trans proline' 0 CA--C 1.572 2.39 0 C-N-CA 122.824 2.349 . . . . 0.0 113.152 171.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.38 111.15 2.65 Favored 'Trans proline' 0 C--N 1.383 2.394 0 C-N-CA 122.057 1.838 . . . . 0.0 111.778 171.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -97.35 134.26 35.96 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 123.065 0.546 . . . . 0.0 110.525 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.1 m -67.97 98.78 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 123.954 0.902 . . . . 0.0 113.231 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.553 HD21 ' HB3' ' A' ' 115' ' ' LEU . 3.6 mm? -73.57 -13.4 61.02 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.743 -0.598 . . . . 0.0 112.062 172.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -83.18 -12.45 56.89 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 124.273 1.029 . . . . 0.0 112.418 176.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.2 t -130.73 -26.35 2.23 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -174.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.3 p -55.33 106.0 0.21 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.407 0.622 . . . . 0.0 112.098 170.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.455 ' HG3' ' H ' ' A' ' 105' ' ' SER . 15.1 tp10 -61.77 141.28 58.0 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 125.09 1.356 . . . . 0.0 110.968 168.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.465 ' HA ' HD13 ' A' ' 107' ' ' LEU . 21.5 ptmt -61.33 -17.52 54.19 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -177.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.455 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 69.6 m -58.19 -27.33 63.78 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 123.186 0.594 . . . . 0.0 112.594 171.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.05 -28.29 68.96 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.573 0.749 . . . . 0.0 112.712 173.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' A' ' 104' ' ' LYS . 7.9 mp -70.31 1.99 4.31 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 124.29 1.036 . . . . 0.0 113.65 -175.313 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 48.3 mtp180 -88.75 -35.29 16.77 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.143 0.577 . . . . 0.0 111.235 167.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -91.34 -49.47 6.33 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.212 1.005 . . . . 0.0 110.361 -174.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.58 HG21 ' HE1' ' A' ' 85' ' ' TRP . 6.9 p -106.08 176.02 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.367 0 C-N-CA 124.407 1.083 . . . . 0.0 108.496 169.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 47.0 m -116.17 153.26 32.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.975 -1.078 . . . . 0.0 109.992 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.8 tt -57.09 -36.5 70.67 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.511 0.724 . . . . 0.0 112.603 179.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.22 -34.16 73.26 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.5 -36.72 79.31 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.499 0.719 . . . . 0.0 110.526 175.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.553 ' HB3' HD21 ' A' ' 99' ' ' LEU . 85.6 mt -68.35 -52.74 29.91 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.376 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -73.77 -27.86 61.37 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 114.73 -1.123 . . . . 0.0 112.672 -172.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -66.97 -17.16 64.79 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 175.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -130.42 20.01 5.24 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 123.383 0.673 . . . . 0.0 111.955 172.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -90.6 -162.84 0.94 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.644 0.778 . . . . 0.0 110.475 168.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.39 150.27 65.39 Favored Pre-proline 0 CA--C 1.562 1.407 0 CA-C-O 119.012 -0.518 . . . . 0.0 110.788 167.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.29 82.23 0.05 OUTLIER 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.48 2.786 . . . . 0.0 114.562 -175.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 42.7 t -106.45 92.58 2.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 124.437 1.095 . . . . 0.0 108.446 176.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 123' ' ' LEU . 1.1 pp -80.0 108.03 13.26 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-O 121.465 0.65 . . . . 0.0 111.218 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -105.28 137.04 43.71 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.05 0.54 . . . . 0.0 110.746 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 35.6 p80 -111.01 6.92 21.32 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 124.389 1.075 . . . . 0.0 113.061 -173.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 52.2 m170 -60.13 113.85 2.56 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 47.1 p-80 -163.14 165.68 24.29 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.212 1.005 . . . . 0.0 110.703 174.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 11.0 p-80 -163.94 166.06 22.04 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.049 0.94 . . . . 0.0 110.778 175.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -88.46 140.61 29.29 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.515 0.726 . . . . 0.0 110.314 176.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 29.5 p-80 . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 119.523 -0.275 . . . . 0.0 110.647 172.051 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtt . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 120.478 0.18 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -74.87 91.81 0.8 Allowed Glycine 0 CA--C 1.541 1.658 0 CA-C-N 116.477 -0.329 . . . . 0.0 113.833 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -78.28 111.9 14.72 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.497 0.719 . . . . 0.0 110.566 176.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -148.2 174.91 27.74 Favored Glycine 0 C--N 1.349 1.303 0 N-CA-C 113.994 0.358 . . . . 0.0 113.994 -175.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -90.63 130.32 36.66 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.713 0.805 . . . . 0.0 110.213 -176.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -143.84 158.47 43.66 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.842 0.857 . . . . 0.0 110.811 -178.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 21.7 t 72.71 -48.29 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.398 0 C-N-CA 126.149 1.779 . . . . 0.0 112.783 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.406 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 2.6 pp -65.75 -48.67 71.1 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.659 0.784 . . . . 0.0 111.663 -176.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -89.24 39.87 3.1 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 114.353 0.501 . . . . 0.0 114.353 -173.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -160.38 -47.37 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.89 0.876 . . . . 0.0 110.543 -176.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -86.03 -37.89 18.45 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.843 0.857 . . . . 0.0 110.926 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.544 ' HG ' ' H ' ' A' ' 13' ' ' GLU . 14.1 tp -118.49 -151.56 0.48 Allowed 'General case' 0 CA--C 1.569 1.706 0 C-N-CA 123.83 0.852 . . . . 0.0 109.612 -177.24 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.544 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 26.1 mm-40 66.84 176.64 0.24 Allowed 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.315 1.446 . . . . 0.0 112.716 -175.248 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.7 p -60.74 123.19 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-O 121.289 0.566 . . . . 0.0 111.453 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.594 ' SG ' ' HA ' ' A' ' 21' ' ' THR . 37.0 t -137.48 98.46 3.7 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.507 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 p -121.02 150.33 41.32 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.502 1.121 . . . . 0.0 110.371 173.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 54.0 t 72.95 -59.07 0.58 Allowed 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 125.373 1.469 . . . . 0.0 113.606 176.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.6 150.13 18.86 Favored Pre-proline 0 CA--C 1.564 1.499 0 C-N-CA 124.788 1.235 . . . . 0.0 113.629 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -56.85 129.99 37.49 Favored 'Trans proline' 0 C--N 1.392 2.846 0 C-N-CA 123.247 2.631 . . . . 0.0 112.785 -178.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 10.9 tmm? 65.0 95.26 0.05 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.959 1.303 . . . . 0.0 110.281 -171.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.594 ' HA ' ' SG ' ' A' ' 15' ' ' CYS . 43.2 p -96.2 169.19 10.11 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.288 0.635 . . . . 0.0 111.406 176.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -54.75 -48.95 63.58 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 123.446 0.466 . . . . 0.0 114.115 -178.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 31.5 t90 67.43 163.83 0.2 Allowed 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.745 1.218 . . . . 0.0 112.554 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 44.3 t80 68.37 -87.65 0.03 OUTLIER 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 124.536 1.134 . . . . 0.0 111.751 172.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 65.7 mmt-85 -142.78 22.64 1.95 Allowed 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 124.658 1.183 . . . . 0.0 109.966 178.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -126.92 142.48 51.54 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.042 0.937 . . . . 0.0 110.491 -166.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 88.1 -92.09 1.78 Allowed Glycine 0 CA--C 1.531 1.077 0 CA-C-N 114.766 -1.106 . . . . 0.0 113.922 170.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -90.54 143.13 27.05 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.191 0.596 . . . . 0.0 111.955 -171.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 85.4 m -130.21 -175.55 3.66 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.574 1.15 . . . . 0.0 111.029 -178.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -77.27 70.65 3.69 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.227 0.611 . . . . 0.0 112.493 -178.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.1 t -168.32 157.14 8.94 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.244 0.618 . . . . 0.0 111.322 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -109.19 156.89 19.34 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.295 0.638 . . . . 0.0 109.384 168.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 13.4 p -64.91 -35.92 76.47 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 123.609 0.763 . . . . 0.0 112.832 -174.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -72.78 -21.17 61.03 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.563 0.745 . . . . 0.0 112.573 -171.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -76.92 19.19 0.31 Allowed 'General case' 0 CA--C 1.564 1.483 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -177.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? 61.38 22.4 12.8 Favored 'General case' 0 CA--C 1.567 1.626 0 C-N-CA 124.463 1.105 . . . . 0.0 111.703 175.159 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.12 6.03 67.53 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 114.947 0.739 . . . . 0.0 114.947 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.2 m -92.96 20.26 6.88 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.754 0.822 . . . . 0.0 112.121 -179.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 105' ' ' SER . 68.3 m80 67.58 174.44 0.26 Allowed 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 125.341 1.456 . . . . 0.0 112.277 -178.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 105' ' ' SER . 60.3 p -94.19 100.45 12.52 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.461 0.648 . . . . 0.0 110.35 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.737 HG11 ' HB2' ' A' ' 82' ' ' ALA . 39.3 t -136.26 102.65 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 C-N-CA 123.615 0.766 . . . . 0.0 109.982 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.566 ' SG ' ' HA ' ' A' ' 78' ' ' TRP . 80.2 m -111.18 107.39 16.71 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 174.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.483 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -138.57 150.4 46.28 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -172.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 20.7 tt0 -116.96 130.24 56.57 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.775 0.322 . . . . 0.0 111.246 -175.011 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.421 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 37.6 mtm -116.33 154.24 30.56 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.409 173.229 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.498 HG22 ' HB3' ' A' ' 95' ' ' PRO . 9.2 t -92.91 156.22 17.08 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.755 0.822 . . . . 0.0 110.517 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.436 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 37.1 tt0 -54.38 -32.69 57.63 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.198 0.599 . . . . 0.0 112.313 -175.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -48.99 -53.17 21.05 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.622 1.169 . . . . 0.0 112.351 -176.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.463 ' HA ' ' HD2' ' A' ' 52' ' ' PHE . 53.8 t80 -71.05 -40.6 71.58 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 177.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 45' ' ' MET . 8.9 mp -63.78 -24.52 67.79 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.827 0.451 . . . . 0.0 111.36 -178.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.436 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 92.8 mt -71.28 -45.87 62.15 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.924 0.889 . . . . 0.0 110.939 170.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.463 ' HD2' ' HA ' ' A' ' 49' ' ' PHE . 25.9 m-85 -58.35 -31.76 67.9 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 123.121 0.568 . . . . 0.0 111.258 174.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 58.5 m -71.29 -42.03 69.21 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 115.542 -0.753 . . . . 0.0 110.979 173.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -61.58 -39.32 90.76 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.554 0.742 . . . . 0.0 112.482 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -64.41 -16.12 61.8 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -70.94 -21.13 62.38 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.131 0.573 . . . . 0.0 112.526 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -167.33 37.48 0.23 Allowed Glycine 0 C--N 1.355 1.584 0 CA-C-O 119.977 -0.346 . . . . 0.0 113.857 -178.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 78.42 -40.62 0.29 Allowed 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 125.846 1.658 . . . . 0.0 114.39 170.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -138.08 -78.78 0.36 Allowed 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 123.044 0.538 . . . . 0.0 112.068 -177.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 36.15 24.32 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 116.417 2.006 . . . . 0.0 116.417 -173.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 56.8 mtt -93.36 -41.61 9.74 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.605 0.762 . . . . 0.0 109.607 171.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 91.5 m -146.3 133.31 10.02 Favored Pre-proline 0 CA--C 1.553 1.067 0 C-N-CA 124.585 1.154 . . . . 0.0 108.989 175.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -67.62 133.08 28.72 Favored 'Trans proline' 0 C--N 1.375 1.949 0 C-N-CA 122.138 1.892 . . . . 0.0 111.621 169.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 69.37 153.89 0.14 Allowed Pre-proline 0 N--CA 1.501 2.077 0 C-N-CA 124.894 1.277 . . . . 0.0 112.673 176.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.01 -13.93 23.74 Favored 'Trans proline' 0 C--N 1.386 2.505 0 C-N-CA 122.199 1.932 . . . . 0.0 112.331 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -134.38 118.16 17.14 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.245 -1.021 . . . . 0.0 108.245 174.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -139.28 16.15 2.59 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.594 0.758 . . . . 0.0 111.171 -173.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 24.4 m-80 67.64 -71.29 0.11 Allowed 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 125.46 1.504 . . . . 0.0 111.577 -176.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -113.47 136.72 21.94 Favored Pre-proline 0 CA--C 1.559 1.309 0 C-N-CA 124.312 1.045 . . . . 0.0 110.692 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -80.1 145.9 17.67 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.411 2.074 . . . . 0.0 112.094 169.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -81.77 -162.78 30.54 Favored Glycine 0 CA--C 1.534 1.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 112.925 175.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 78' ' ' TRP . 3.0 mm? -76.53 111.27 11.83 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.137 0.494 . . . . 0.0 111.138 -178.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.0 pttm -104.51 -168.39 1.48 Allowed 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 123.742 0.817 . . . . 0.0 110.226 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.67 125.78 25.43 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.475 0.71 . . . . 0.0 111.592 176.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.75 -2.61 70.03 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 114.41 0.524 . . . . 0.0 114.41 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -97.09 123.06 40.74 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.079 0.551 . . . . 0.0 110.539 173.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.48 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.1 OUTLIER -114.89 91.22 3.55 Favored 'General case' 0 CA--C 1.574 1.88 0 CA-C-O 121.919 0.866 . . . . 0.0 110.437 176.643 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.566 ' HA ' ' SG ' ' A' ' 42' ' ' CYS . 75.0 t90 -172.28 124.49 0.5 Allowed 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.318 0.647 . . . . 0.0 110.098 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 86.9 m 50.59 26.13 2.31 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.483 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -66.31 118.52 10.1 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 6.4 p -61.98 105.92 0.64 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 122.993 0.517 . . . . 0.0 110.564 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.737 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -55.16 -23.61 22.37 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.953 1.301 . . . . 0.0 113.775 -176.134 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.7 m -58.92 -38.77 79.7 Favored 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 123.503 0.721 . . . . 0.0 112.425 173.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.3 mmm-85 -74.97 -36.12 62.05 Favored 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 123.726 0.81 . . . . 0.0 112.433 178.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.567 ' HE1' HD23 ' A' ' 115' ' ' LEU . 7.7 t-105 -64.88 -45.8 84.47 Favored 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 173.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -57.94 -43.89 86.6 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.85 0.86 . . . . 0.0 110.792 173.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -55.28 -38.32 68.44 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.515 1.126 . . . . 0.0 112.024 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.34 94.03 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 174.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -68.26 -40.25 81.95 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 122.586 0.354 . . . . 0.0 111.48 174.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -63.48 -33.34 75.35 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.016 0.926 . . . . 0.0 111.785 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.29 -15.97 25.24 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 123.843 0.857 . . . . 0.0 112.138 175.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.87 -20.93 37.5 Favored Glycine 0 CA--C 1.542 1.779 0 N-CA-C 115.202 0.841 . . . . 0.0 115.202 175.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -89.79 33.08 0.86 Allowed 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 118.054 0.927 . . . . 0.0 113.023 -174.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.22 112.79 4.54 Favored Pre-proline 0 CA--C 1.569 1.679 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.498 ' HB3' HG22 ' A' ' 46' ' ' THR . 57.4 Cg_exo -59.83 171.51 2.8 Favored 'Trans proline' 0 CA--C 1.568 2.182 0 C-N-CA 123.947 3.098 . . . . 0.0 114.825 172.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -80.1 113.15 2.92 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.719 2.279 . . . . 0.0 111.983 168.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 9.7 p -99.25 156.78 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 123.884 0.873 . . . . 0.0 110.642 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.516 HG21 ' HB3' ' A' ' 101' ' ' SER . 33.3 m -81.44 164.32 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.096 0 CA-C-O 121.608 0.718 . . . . 0.0 112.228 173.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 83.5 mt -112.55 -13.78 13.28 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.973 0.909 . . . . 0.0 110.056 163.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -71.6 -70.47 0.32 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.735 0.814 . . . . 0.0 111.208 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.516 ' HB3' HG21 ' A' ' 98' ' ' VAL . 34.6 t -66.26 -31.55 72.43 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.219 0.608 . . . . 0.0 112.061 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 76.2 m -62.67 127.38 31.04 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.61 0.764 . . . . 0.0 111.938 175.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -98.97 164.27 12.25 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.891 0.877 . . . . 0.0 110.842 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.457 ' HD3' HD22 ' A' ' 107' ' ' LEU . 3.0 tppp? -53.5 -32.83 52.01 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 125.422 1.489 . . . . 0.0 113.595 176.398 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.46 ' HB3' ' HB3' ' A' ' 39' ' ' HIS . 56.7 m -60.5 -26.06 66.54 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 178.048 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.68 -33.45 72.87 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.393 0.677 . . . . 0.0 112.667 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.457 HD22 ' HD3' ' A' ' 104' ' ' LYS . 8.8 mp -61.65 -24.46 66.75 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.923 0.889 . . . . 0.0 112.264 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -74.34 -11.49 60.27 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.978 0.911 . . . . 0.0 112.81 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -116.3 -48.99 2.69 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.041 0.937 . . . . 0.0 111.708 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.481 HG21 ' CD1' ' A' ' 85' ' ' TRP . 14.8 p -113.25 -24.33 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -169.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 46.2 t 75.2 148.17 0.1 Allowed 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 125.112 1.365 . . . . 0.0 112.607 -173.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.494 ' HA ' HD12 ' A' ' 115' ' ' LEU . 3.8 tt -58.59 -39.05 79.29 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.487 1.115 . . . . 0.0 112.149 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.72 -38.83 70.28 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.278 0.631 . . . . 0.0 112.686 -176.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -67.17 -44.74 78.96 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.589 0.756 . . . . 0.0 110.373 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.567 HD23 ' HE1' ' A' ' 85' ' ' TRP . 63.8 mt -58.99 -46.86 87.09 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.814 0.816 . . . . 0.0 110.114 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.408 HE22 ' HB ' ' A' ' 122' ' ' VAL . 11.1 mt-30 -74.98 -29.96 61.05 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 114.131 -1.395 . . . . 0.0 112.828 -176.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.91 -19.31 60.34 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.341 170.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -123.33 6.49 9.05 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.788 0.835 . . . . 0.0 112.489 178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -127.72 -88.46 0.55 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.374 0.669 . . . . 0.0 111.296 177.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -161.06 159.69 24.64 Favored Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 123.88 0.872 . . . . 0.0 110.808 179.125 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -60.26 150.83 77.75 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 123.037 2.491 . . . . 0.0 114.202 174.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' VAL . . . . . 0.408 ' HB ' HE22 ' A' ' 116' ' ' GLN . 7.7 p -71.95 122.75 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 122.991 0.517 . . . . 0.0 110.277 173.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tt -79.57 71.55 6.18 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-O 122.12 0.962 . . . . 0.0 109.025 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -142.13 113.0 7.39 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.906 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -169.8 20.28 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 124.217 1.007 . . . . 0.0 110.1 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 53.4 p-80 -76.28 79.47 3.05 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.427 1.108 . . . . 0.0 111.781 -171.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 56.5 m80 -140.21 104.16 4.75 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.51 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -126.56 85.38 2.38 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.759 0.824 . . . . 0.0 109.147 172.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -155.89 130.62 9.11 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.228 0.611 . . . . 0.0 110.228 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 . . . . . 0 CA--C 1.561 1.381 0 C-N-CA 123.491 0.717 . . . . 0.0 109.433 172.881 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.8 mtp . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 120.425 0.155 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -167.18 95.33 0.12 Allowed Glycine 0 C--N 1.349 1.256 0 CA-C-N 116.673 -0.239 . . . . 0.0 112.811 -178.16 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -119.66 114.63 22.49 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.515 0.726 . . . . 0.0 110.252 178.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.37 -145.15 8.54 Favored Glycine 0 N--CA 1.476 1.312 0 N-CA-C 111.905 -0.478 . . . . 0.0 111.905 168.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -130.59 118.3 20.82 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.394 0.678 . . . . 0.0 110.123 173.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -146.47 94.22 2.41 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-O 122.327 1.06 . . . . 0.0 110.229 -168.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.508 HG23 ' HG ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -157.31 -53.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.117 1.367 . . . . 0.0 109.501 -176.449 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 7' ' ' VAL . 82.2 mt -97.6 -28.87 13.74 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 114.745 -1.116 . . . . 0.0 112.629 -168.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 77.55 90.33 0.31 Allowed Glycine 0 C--N 1.349 1.256 0 N-CA-C 112.339 -0.304 . . . . 0.0 112.339 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -137.0 161.14 36.88 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.068 0.947 . . . . 0.0 109.609 -176.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.2 t70 62.14 31.14 17.84 Favored 'General case' 0 CA--C 1.568 1.648 0 C-N-CA 124.385 1.074 . . . . 0.0 110.528 -173.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.9 tt -87.79 131.54 34.48 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.218 1.007 . . . . 0.0 110.052 -174.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -108.93 154.98 21.38 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.632 0.773 . . . . 0.0 110.954 177.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 14.6 p -156.42 139.59 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 123.376 0.67 . . . . 0.0 110.996 173.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.8 m -93.84 -75.43 0.5 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.399 0.68 . . . . 0.0 110.163 175.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.0 t 50.66 101.33 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 125.228 1.411 . . . . 0.0 114.5 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.5 m 70.75 -3.25 2.01 Favored 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 124.854 1.261 . . . . 0.0 113.78 173.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.87 158.06 87.78 Favored Pre-proline 0 CA--C 1.562 1.432 0 C-N-CA 123.939 0.896 . . . . 0.0 111.562 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -60.91 121.43 9.67 Favored 'Trans proline' 0 C--N 1.375 1.958 0 C-N-CA 122.058 1.839 . . . . 0.0 111.882 171.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.414 ' HG2' ' HB2' ' A' ' 23' ' ' TRP . 42.6 ttm 68.29 43.14 1.55 Allowed 'General case' 0 CA--C 1.564 1.519 0 C-N-CA 125.324 1.449 . . . . 0.0 111.412 -177.4 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.3 m -63.22 106.91 0.95 Allowed 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.161 170.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 138.14 -22.05 3.11 Favored Glycine 0 N--CA 1.474 1.232 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.735 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.414 ' HB2' ' HG2' ' A' ' 20' ' ' MET . 81.6 t90 -58.13 -45.68 86.9 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.3 0.64 . . . . 0.0 111.419 177.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -69.71 -28.27 65.68 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.35 0.66 . . . . 0.0 112.08 175.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.42 ' NH1' ' HA ' ' A' ' 33' ' ' VAL . 28.0 ttp85 70.41 -68.5 0.2 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.419 1.488 . . . . 0.0 112.747 177.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -44.23 -48.48 9.37 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 125.389 1.475 . . . . 0.0 114.029 -175.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.21 22.73 5.86 Favored Glycine 0 CA--C 1.542 1.758 0 N-CA-C 115.976 1.15 . . . . 0.0 115.976 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -162.56 -67.32 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 117.949 0.875 . . . . 0.0 109.885 175.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.9 t -82.64 65.23 7.66 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.201 1.0 . . . . 0.0 110.297 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.4 ' H ' ' HG2' ' A' ' 30' ' ' GLN . 2.0 pt20 -87.83 58.53 4.91 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-O 122.708 1.242 . . . . 0.0 110.497 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.1 t -94.13 36.43 1.13 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 125.758 1.623 . . . . 0.0 110.309 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 62.72 -79.34 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 124.971 1.308 . . . . 0.0 110.532 -165.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.42 ' HA ' ' NH1' ' A' ' 25' ' ' ARG . 86.9 t -131.38 -50.2 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 124.117 0.967 . . . . 0.0 108.719 168.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -156.7 -48.96 0.07 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 124.112 0.965 . . . . 0.0 110.937 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.445 ' HB3' ' HB2' ' A' ' 39' ' ' HIS . 34.2 t70 50.27 79.88 0.08 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 125.492 1.517 . . . . 0.0 112.67 -175.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mtm180 69.27 -8.89 0.66 Allowed 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 125.328 1.451 . . . . 0.0 113.622 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 147.68 -48.47 0.64 Allowed Glycine 0 C--N 1.348 1.21 0 N-CA-C 112.034 -0.426 . . . . 0.0 112.034 -175.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 t -160.24 142.28 12.9 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.093 0.557 . . . . 0.0 111.628 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.445 ' HB2' ' HB3' ' A' ' 35' ' ' ASP . 8.9 t-160 -155.14 42.98 0.46 Allowed 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.335 1.054 . . . . 0.0 109.179 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.4 p -93.86 102.35 14.46 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.229 -172.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.422 HG11 ' N ' ' A' ' 82' ' ' ALA . 28.6 t -123.8 103.47 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.434 0.694 . . . . 0.0 110.126 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 80.8 m -113.78 108.17 16.72 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 173.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -142.28 152.55 43.12 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.084 0.953 . . . . 0.0 109.384 -167.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.463 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 27.0 tt0 -122.74 126.8 48.21 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.009 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.548 ' HB2' HD11 ' A' ' 50' ' ' LEU . 18.7 mtm -119.89 136.67 54.41 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.617 0.767 . . . . 0.0 109.509 173.127 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 6.2 t -98.68 160.73 14.07 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 123.005 0.522 . . . . 0.0 111.764 -172.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -53.13 -35.38 59.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.345 1.058 . . . . 0.0 113.051 -171.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -55.17 -46.68 75.78 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 122.266 1.031 . . . . 0.0 110.529 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -79.6 -35.82 38.99 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.949 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.548 HD11 ' HB2' ' A' ' 45' ' ' MET . 10.5 mp -68.57 -36.89 79.36 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 117.709 0.231 . . . . 0.0 111.589 178.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.9 mt -64.02 -31.7 72.99 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.312 0.645 . . . . 0.0 111.579 177.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.542 ' HE2' ' HB1' ' A' ' 91' ' ' ALA . 87.2 t80 -61.71 -46.77 88.26 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.621 0.368 . . . . 0.0 110.871 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 45.2 m -62.34 -49.14 76.77 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.298 0.639 . . . . 0.0 112.386 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -76.52 -56.76 4.33 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -178.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -77.05 -7.31 55.47 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -171.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.87 17.68 3.85 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 118.202 0.455 . . . . 0.0 111.891 177.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -159.52 -104.23 0.2 Allowed Glycine 0 C--N 1.353 1.475 0 O-C-N 122.055 -0.403 . . . . 0.0 113.607 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -129.27 162.98 26.66 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.259 1.024 . . . . 0.0 111.553 -175.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -63.54 134.65 55.92 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.446 0.698 . . . . 0.0 111.717 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.6 tp -143.04 -44.04 0.3 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.441 0.696 . . . . 0.0 110.791 -176.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 39.9 ttm -95.11 80.26 3.6 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.218 0.607 . . . . 0.0 109.803 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 41.3 p -135.28 140.69 35.25 Favored Pre-proline 0 N--CA 1.491 1.602 0 C-N-CA 123.676 0.79 . . . . 0.0 111.298 -177.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -55.5 -47.38 25.99 Favored 'Trans proline' 0 C--N 1.388 2.633 0 C-N-CA 123.452 2.768 . . . . 0.0 113.908 174.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 65.2 mtt85 64.58 80.91 0.23 Allowed Pre-proline 0 N--CA 1.492 1.626 0 C-N-CA 124.872 1.269 . . . . 0.0 112.115 -177.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.78 -12.92 24.39 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.768 2.312 . . . . 0.0 113.001 -178.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -73.8 -27.96 61.4 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.891 0.876 . . . . 0.0 111.529 177.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -139.73 105.68 5.19 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.206 1.003 . . . . 0.0 109.599 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -79.8 43.64 0.6 Allowed 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.297 1.039 . . . . 0.0 112.802 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.489 ' HB2' ' HD3' ' A' ' 70' ' ' PRO . 59.7 m-85 -132.07 -56.09 0.03 OUTLIER Pre-proline 0 CA--C 1.574 1.886 0 C-N-CA 123.541 0.736 . . . . 0.0 111.582 -177.197 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.489 ' HD3' ' HB2' ' A' ' 69' ' ' PHE . 94.5 Cg_endo -89.49 114.63 0.62 Allowed 'Trans proline' 0 C--N 1.395 3.019 0 C-N-CA 121.92 1.747 . . . . 0.0 113.243 178.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -128.32 -86.45 0.51 Allowed Glycine 0 C--N 1.346 1.133 0 N-CA-C 111.854 -0.498 . . . . 0.0 111.854 177.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 64.26 147.68 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 125.492 1.517 . . . . 0.0 113.038 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -124.88 177.61 5.93 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.634 0.774 . . . . 0.0 110.174 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -82.89 105.84 14.22 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.113 0.565 . . . . 0.0 112.362 -173.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.59 38.71 4.9 Favored Glycine 0 N--CA 1.475 1.251 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.998 -177.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -122.73 107.59 12.09 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.385 1.074 . . . . 0.0 110.681 -176.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.463 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 16.4 ptt-85 -84.06 89.98 7.37 Favored 'General case' 0 CA--C 1.555 1.172 0 CA-C-O 122.027 0.918 . . . . 0.0 111.559 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -138.16 -163.77 1.51 Allowed 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 125.251 1.421 . . . . 0.0 108.844 175.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 26.0 p -55.9 81.09 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 122.167 0.984 . . . . 0.0 111.246 169.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -85.28 -25.84 26.99 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.919 1.288 . . . . 0.0 110.118 -175.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 52.4 t 68.02 123.36 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.041 1.336 . . . . 0.0 111.148 -173.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.422 ' N ' HG11 ' A' ' 41' ' ' VAL . . . -55.69 -24.47 34.52 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.79 0.836 . . . . 0.0 112.658 -177.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.4 t -54.12 -47.08 72.21 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.985 0.914 . . . . 0.0 112.693 173.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -41.55 85.42 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 123.531 0.732 . . . . 0.0 112.536 -178.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.47 ' NE1' HG21 ' A' ' 110' ' ' VAL . 9.8 t-105 -71.35 -43.69 66.49 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 124.043 0.937 . . . . 0.0 110.535 -177.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -65.77 -37.66 86.92 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.936 0.895 . . . . 0.0 111.633 175.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.72 -44.16 97.46 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.54 0.736 . . . . 0.0 111.06 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.51 -30.1 71.13 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.46 0.704 . . . . 0.0 111.461 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.481 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 86.8 t80 -68.77 -46.4 68.87 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 123.01 0.524 . . . . 0.0 111.299 174.008 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -71.79 -16.6 62.19 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.459 0.704 . . . . 0.0 112.242 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.542 ' HB1' ' HE2' ' A' ' 52' ' ' PHE . . . -75.21 -2.7 29.14 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 123.7 0.8 . . . . 0.0 111.589 168.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 84.61 15.65 67.83 Favored Glycine 0 C--N 1.355 1.623 0 C-N-CA 123.63 0.634 . . . . 0.0 113.72 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.2 mmm -118.81 -79.04 0.59 Allowed 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.142 0.577 . . . . 0.0 112.057 -171.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.481 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 63.99 102.26 0.04 OUTLIER Pre-proline 0 N--CA 1.493 1.683 0 C-N-CA 125.0 1.32 . . . . 0.0 113.8 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.404 ' HG3' ' HB3' ' A' ' 45' ' ' MET . 59.6 Cg_endo -67.94 168.98 17.32 Favored 'Trans proline' 0 N--CA 1.504 2.131 0 C-N-CA 123.84 3.027 . . . . 0.0 114.954 177.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.99 109.69 1.77 Allowed 'Trans proline' 0 C--N 1.379 2.177 0 C-N-CA 122.658 2.239 . . . . 0.0 112.197 168.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.7 p -95.2 152.31 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.222 0.609 . . . . 0.0 110.592 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.5 p -90.75 105.42 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.422 0 CA-C-O 121.734 0.778 . . . . 0.0 110.937 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.519 HD21 ' HA ' ' A' ' 116' ' ' GLN . 5.8 mp -69.32 -40.54 77.55 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.737 1.215 . . . . 0.0 112.262 -171.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -68.62 -27.54 66.11 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.367 0.667 . . . . 0.0 111.86 -176.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 30.6 t -84.09 -29.64 26.63 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.198 0.599 . . . . 0.0 110.685 174.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 90.6 m -74.63 101.49 4.26 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.17 0.588 . . . . 0.0 110.414 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -67.97 156.6 36.92 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.56 0.744 . . . . 0.0 111.126 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.606 ' HA ' HD13 ' A' ' 107' ' ' LEU . 0.6 OUTLIER -63.12 -14.32 47.18 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.092 0.957 . . . . 0.0 113.129 -174.902 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 40.4 t -57.16 -39.22 74.83 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.226 0.61 . . . . 0.0 111.814 171.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.43 -22.37 61.11 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.916 0.886 . . . . 0.0 112.877 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.606 HD13 ' HA ' ' A' ' 104' ' ' LYS . 7.2 mp -63.97 -22.4 66.91 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 123.93 0.892 . . . . 0.0 112.199 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -78.55 -15.08 58.98 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.251 0.62 . . . . 0.0 111.268 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -110.97 -17.06 13.38 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.621 1.168 . . . . 0.0 113.334 -175.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.47 HG21 ' NE1' ' A' ' 85' ' ' TRP . 7.4 p -144.52 -23.76 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.0 t 80.34 139.74 0.07 Allowed 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 125.461 1.504 . . . . 0.0 112.851 -176.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.82 -38.19 87.26 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.535 1.134 . . . . 0.0 112.298 173.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.87 -32.43 69.46 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.153 0.581 . . . . 0.0 112.303 -175.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.78 -39.34 76.68 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.894 174.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.425 ' HB3' ' HG ' ' A' ' 99' ' ' LEU . 64.5 mt -69.16 -45.39 70.17 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.586 0.754 . . . . 0.0 110.298 -172.165 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.519 ' HA ' HD21 ' A' ' 99' ' ' LEU . 61.1 mm-40 -62.64 -43.74 98.04 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.621 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -61.46 -29.83 70.21 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 115.264 -0.88 . . . . 0.0 113.216 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 48.1 m80 -91.67 -17.37 25.59 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.32 -65.87 0.96 Allowed 'General case' 0 N--CA 1.485 1.304 0 CA-C-O 121.253 0.549 . . . . 0.0 111.002 168.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 4.1 pp -113.59 152.24 45.24 Favored Pre-proline 0 CA--C 1.559 1.296 0 C-N-CA 124.569 1.148 . . . . 0.0 111.04 -178.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 120' ' ' LEU . 16.0 Cg_exo -68.38 96.53 0.48 Allowed 'Trans proline' 0 C--N 1.371 1.753 0 C-N-CA 122.593 2.196 . . . . 0.0 113.125 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.3 p -133.86 132.08 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.248 0.619 . . . . 0.0 110.078 170.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.2 tt -109.81 126.49 53.85 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.608 0.763 . . . . 0.0 110.026 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -145.72 12.54 1.3 Allowed 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.738 0.815 . . . . 0.0 110.295 172.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 63.73 105.87 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 125.422 1.489 . . . . 0.0 111.769 -176.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -66.8 131.56 46.18 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.285 0.634 . . . . 0.0 111.614 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -169.2 -31.39 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.378 0.671 . . . . 0.0 110.439 175.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -69.59 107.86 3.59 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.573 0.749 . . . . 0.0 110.932 172.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 38.3 m-70 -136.82 -44.53 0.58 Allowed 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 122.953 0.501 . . . . 0.0 112.195 -177.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 72.8 m80 . . . . . 0 N--CA 1.496 1.871 0 C-N-CA 124.528 1.131 . . . . 0.0 111.081 -164.691 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 mtt . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.448 0.166 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -72.98 -55.19 6.51 Favored Glycine 0 C--N 1.351 1.363 0 CA-C-N 116.103 -0.499 . . . . 0.0 114.009 -176.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -92.76 132.47 36.93 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.005 0.431 . . . . 0.0 110.952 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -163.43 159.88 32.51 Favored Glycine 0 CA--C 1.532 1.111 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.527 173.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -114.62 121.75 44.38 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 117.667 0.733 . . . . 0.0 109.98 173.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -65.59 157.15 30.58 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.789 0.836 . . . . 0.0 111.96 -175.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 5.1 m -66.53 -23.76 31.97 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-O 121.682 0.753 . . . . 0.0 109.933 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.2 mt -67.56 -34.52 77.23 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 114.167 -1.379 . . . . 0.0 110.494 177.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -88.98 -103.77 1.03 Allowed Glycine 0 C--N 1.35 1.325 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.329 169.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -167.24 137.36 2.93 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.755 0.822 . . . . 0.0 111.411 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -158.51 156.78 30.87 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.161 0.584 . . . . 0.0 110.894 175.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.39 -32.17 72.05 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.447 0.699 . . . . 0.0 110.375 177.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 62.11 26.88 16.19 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.002 1.321 . . . . 0.0 112.64 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.449 HG23 ' HA3' ' A' ' 27' ' ' GLY . 14.4 p -96.87 138.41 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.454 0.702 . . . . 0.0 111.515 -174.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 40.9 t -78.85 -36.05 42.95 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.303 0.641 . . . . 0.0 110.503 172.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.2 t -75.26 88.05 2.51 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.991 176.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.1 p -117.88 -55.29 2.28 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.544 0.738 . . . . 0.0 110.146 177.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.48 -45.87 0.2 Allowed Pre-proline 0 CA--C 1.568 1.668 0 C-N-CA 124.031 0.932 . . . . 0.0 112.053 172.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -81.85 162.15 18.59 Favored 'Trans proline' 0 C--N 1.396 3.066 0 C-N-CA 121.768 1.645 . . . . 0.0 113.401 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.0 mmt -67.07 -37.54 84.2 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.241 0.617 . . . . 0.0 111.324 176.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.3 m 61.18 81.32 0.19 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.756 1.222 . . . . 0.0 111.269 176.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.77 -130.19 14.3 Favored Glycine 0 CA--C 1.536 1.35 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.856 -169.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 93.4 m95 -130.93 -64.31 0.83 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.639 0.775 . . . . 0.0 109.842 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -153.82 111.86 3.56 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 122.928 0.491 . . . . 0.0 110.594 -177.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -136.89 -60.1 0.7 Allowed 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.537 1.135 . . . . 0.0 109.09 173.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -168.58 -49.35 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.762 1.225 . . . . 0.0 108.636 -178.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.449 ' HA3' HG23 ' A' ' 14' ' ' VAL . . . 161.69 23.58 0.02 OUTLIER Glycine 0 CA--C 1.531 1.058 0 CA-C-N 115.108 -0.951 . . . . 0.0 112.958 176.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.6 p90 -152.34 156.41 39.55 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 121.416 0.627 . . . . 0.0 111.641 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 28.4 p -143.22 160.28 40.75 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.811 171.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -76.26 -75.22 0.2 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.972 0.509 . . . . 0.0 111.078 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 t -164.01 -177.48 5.07 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.946 0.498 . . . . 0.0 111.477 -179.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -77.83 150.09 34.27 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.579 0.752 . . . . 0.0 110.236 172.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 14.9 p -61.8 -29.28 45.95 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 C-N-CA 123.13 0.572 . . . . 0.0 111.96 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -74.77 -28.3 60.7 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.863 0.865 . . . . 0.0 112.03 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.69 94.02 5.64 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.525 0.679 . . . . 0.0 111.238 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.0 mmm180 -88.59 83.89 6.76 Favored 'General case' 0 CA--C 1.554 1.11 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.313 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.99 87.38 0.77 Allowed Glycine 0 CA--C 1.539 1.593 0 CA-C-N 115.845 -0.616 . . . . 0.0 113.293 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.6 t -89.44 -157.41 0.45 Allowed 'General case' 0 CA--C 1.568 1.638 0 C-N-CA 123.708 0.803 . . . . 0.0 110.601 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -111.59 24.82 12.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.307 -0.871 . . . . 0.0 111.039 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.0 p -95.05 110.19 22.14 Favored 'General case' 0 CA--C 1.563 1.447 0 O-C-N 121.578 -0.702 . . . . 0.0 112.16 -170.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.1 t -131.53 137.08 56.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.282 0.633 . . . . 0.0 110.261 174.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 74.7 m -131.03 111.24 11.84 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.775 0.83 . . . . 0.0 110.051 174.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.549 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -141.28 151.92 44.06 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.826 0.851 . . . . 0.0 109.54 -172.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.619 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 23.8 tt0 -119.86 108.35 14.26 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 122.245 -0.284 . . . . 0.0 111.642 -176.152 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.553 ' SD ' ' HG3' ' A' ' 84' ' ' ARG . 56.2 mtp -93.38 130.02 39.32 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.053 0.541 . . . . 0.0 110.228 170.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.8 p -83.3 167.71 17.35 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.568 0.747 . . . . 0.0 109.578 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -62.75 -37.01 84.9 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 118.403 0.547 . . . . 0.0 110.842 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -54.31 -55.53 27.49 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 124.018 0.927 . . . . 0.0 111.544 176.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -78.13 -29.98 49.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.796 -176.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.11 -38.87 60.98 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.471 0.708 . . . . 0.0 110.237 -177.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 28.1 mt -62.91 -47.68 82.21 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.634 0.774 . . . . 0.0 110.778 169.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -65.01 -42.05 94.79 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -174.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.6 t -56.43 -39.41 73.03 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 123.263 0.625 . . . . 0.0 110.773 177.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 49.7 mtp85 -78.56 -34.49 47.0 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.4 173.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -61.72 -20.15 63.19 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 123.96 0.904 . . . . 0.0 111.96 -166.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -82.86 90.9 7.0 Favored 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 167.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.96 -62.12 2.23 Favored Glycine 0 CA--C 1.543 1.799 0 N-CA-C 114.367 0.507 . . . . 0.0 114.367 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -95.89 35.89 1.35 Allowed 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 123.997 0.919 . . . . 0.0 111.873 -170.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -48.21 -39.09 20.0 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -168.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -59.71 95.49 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.507 0 CA-C-O 121.76 0.791 . . . . 0.0 110.913 174.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 24.4 ttt -59.79 -60.16 4.28 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 124.756 1.222 . . . . 0.0 111.709 -175.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.1 m -112.28 95.16 29.6 Favored Pre-proline 0 CA--C 1.555 1.155 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 174.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -62.88 -40.75 33.44 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 122.879 2.386 . . . . 0.0 113.158 -173.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 85.9 mtt180 -90.57 158.01 43.48 Favored Pre-proline 0 CA--C 1.556 1.207 0 C-N-CA 124.156 0.982 . . . . 0.0 111.153 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -66.88 -13.55 40.37 Favored 'Trans proline' 0 C--N 1.383 2.352 0 C-N-CA 122.29 1.994 . . . . 0.0 112.831 170.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -77.06 157.52 31.06 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.776 0.83 . . . . 0.0 111.323 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -81.56 2.12 30.62 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.831 0.852 . . . . 0.0 112.85 -177.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -81.85 95.17 7.23 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.305 0.642 . . . . 0.0 111.454 -175.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -134.95 146.65 59.53 Favored Pre-proline 0 N--CA 1.489 1.496 0 C-N-CA 123.617 0.767 . . . . 0.0 110.08 173.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.2 96.63 1.04 Allowed 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 122.095 1.863 . . . . 0.0 112.546 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 158.43 -175.49 35.54 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-N 116.156 -0.474 . . . . 0.0 112.842 178.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.498 HD23 HD23 ' A' ' 80' ' ' LEU . 4.2 mm? -97.0 178.12 5.38 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-O 121.665 0.745 . . . . 0.0 112.023 178.164 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.432 ' N ' ' HD3' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -99.52 22.92 10.09 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.139 -165.642 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 65.88 117.25 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 125.366 1.466 . . . . 0.0 113.022 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 67.57 40.9 90.68 Favored Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.627 -0.589 . . . . 0.0 111.627 -168.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -138.27 97.42 3.38 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 124.152 0.981 . . . . 0.0 109.013 -174.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.619 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 39.0 ptt85 -89.14 85.33 6.63 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.709 0.766 . . . . 0.0 112.716 -174.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 -159.26 120.42 3.27 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.474 0.71 . . . . 0.0 110.122 -173.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.0 t 62.47 9.83 3.63 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 170.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.549 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -67.6 110.63 3.78 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 44.1 t -61.44 132.41 53.34 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.372 0.669 . . . . 0.0 111.199 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.42 -22.81 62.0 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.6 m -58.27 -41.58 84.64 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 118.362 0.528 . . . . 0.0 112.04 172.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.553 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 6.9 tpm_? -69.2 -41.49 77.04 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.334 1.054 . . . . 0.0 111.841 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.463 ' NE1' HG11 ' A' ' 110' ' ' VAL . 0.5 OUTLIER -74.25 -54.6 7.38 Favored 'General case' 0 CA--C 1.563 1.457 0 C-N-CA 123.6 0.76 . . . . 0.0 110.841 179.571 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.492 ' HB2' HG12 ' A' ' 110' ' ' VAL . 32.4 tp60 -49.95 -40.68 44.54 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 177.004 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -61.79 -41.1 97.3 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 120.68 0.276 . . . . 0.0 111.049 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.5 70.6 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.927 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.69 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 54.0 t80 -67.03 -43.45 82.74 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.75 0.82 . . . . 0.0 110.782 171.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -69.4 -31.59 70.06 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.167 0.587 . . . . 0.0 112.466 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -78.96 -11.51 60.01 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.654 0.782 . . . . 0.0 111.577 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 107.1 -16.79 38.62 Favored Glycine 0 C--N 1.352 1.439 0 N-CA-C 114.934 0.734 . . . . 0.0 114.934 170.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -73.97 -70.43 0.39 Allowed 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 117.918 0.859 . . . . 0.0 111.021 -177.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.69 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 60.52 97.98 0.04 OUTLIER Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 124.745 1.218 . . . . 0.0 113.291 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.445 ' HB2' ' O ' ' A' ' 44' ' ' GLU . 94.5 Cg_endo -71.28 168.97 21.89 Favored 'Trans proline' 0 CA--C 1.568 2.182 0 C-N-CA 123.391 2.727 . . . . 0.0 113.563 175.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -66.46 118.64 5.69 Favored 'Trans proline' 0 C--N 1.381 2.276 0 C-N-CA 122.421 2.081 . . . . 0.0 112.784 176.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.602 HG13 ' HB2' ' A' ' 119' ' ' ALA . 7.7 p -105.97 158.27 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 123.497 0.719 . . . . 0.0 109.323 173.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.534 HG11 ' HD2' ' A' ' 77' ' ' ARG . 3.4 p -115.65 108.24 24.76 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 O-C-N 121.675 -0.641 . . . . 0.0 112.508 -170.405 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.442 ' HG ' ' HB1' ' A' ' 119' ' ' ALA . 97.0 mt -69.07 -28.91 66.95 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -83.67 40.0 0.71 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.607 0.763 . . . . 0.0 111.748 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.45 ' HB3' HG13 ' A' ' 98' ' ' VAL . 22.4 t -170.12 -24.67 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 124.521 1.129 . . . . 0.0 110.852 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.401 ' OG1' ' HA ' ' A' ' 99' ' ' LEU . 33.6 p -74.77 -176.84 3.0 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.729 0.776 . . . . 0.0 112.186 172.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -148.76 171.85 15.56 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.03 -177.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.525 ' HA ' HD13 ' A' ' 107' ' ' LEU . 0.5 OUTLIER -62.74 -17.72 61.38 Favored 'General case' 0 CA--C 1.564 1.512 0 C-N-CA 124.256 1.022 . . . . 0.0 110.98 167.888 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.2 m -57.56 -36.18 71.33 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.495 1.118 . . . . 0.0 112.255 169.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.456 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -63.49 -36.36 83.51 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.948 0.499 . . . . 0.0 111.236 176.116 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.5 mp -68.05 5.75 0.86 Allowed 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 124.906 1.282 . . . . 0.0 113.584 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -86.86 -23.72 25.16 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.526 0.73 . . . . 0.0 110.182 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -107.71 -50.92 2.98 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.717 1.207 . . . . 0.0 108.758 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.492 HG12 ' HB2' ' A' ' 86' ' ' GLN . 33.8 m -97.06 -172.67 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 CA-C-O 122.289 1.042 . . . . 0.0 111.919 176.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.1 t -113.97 158.52 21.04 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.347 158.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.509 ' HA ' HD12 ' A' ' 115' ' ' LEU . 2.5 tt -55.95 -34.98 66.16 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 122.518 0.327 . . . . 0.0 110.761 170.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.35 73.72 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.185 0.594 . . . . 0.0 112.308 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -73.09 -33.91 65.88 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 120.841 0.353 . . . . 0.0 110.183 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 112' ' ' LEU . 87.7 mt -68.35 -56.88 6.99 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 123.73 0.812 . . . . 0.0 110.634 178.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.429 ' HG2' HD11 ' A' ' 99' ' ' LEU . 7.1 mt-30 -64.62 -30.94 71.96 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.418 1.087 . . . . 0.0 112.315 -170.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -52.3 -30.42 28.1 Favored 'General case' 0 CA--C 1.563 1.443 0 C-N-CA 123.89 0.876 . . . . 0.0 112.87 171.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -135.72 27.7 3.31 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 123.886 0.874 . . . . 0.0 112.488 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.602 ' HB2' HG13 ' A' ' 97' ' ' VAL . . . -127.57 168.6 14.75 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -177.144 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -109.96 121.02 43.09 Favored Pre-proline 0 CA--C 1.561 1.394 0 CA-C-N 114.801 -1.09 . . . . 0.0 108.659 174.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -57.19 162.98 8.65 Favored 'Trans proline' 0 N--CA 1.506 2.242 0 C-N-CA 124.14 3.227 . . . . 0.0 116.243 -177.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.6 p -103.65 140.84 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.897 0.879 . . . . 0.0 111.167 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.71 72.6 8.76 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 121.992 0.901 . . . . 0.0 110.08 173.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -150.84 13.38 0.71 Allowed 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.791 1.236 . . . . 0.0 109.683 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -78.34 90.55 4.39 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.958 0.903 . . . . 0.0 111.431 -171.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -155.31 136.65 14.03 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.891 0.876 . . . . 0.0 110.572 174.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -89.25 157.2 18.32 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.147 0.579 . . . . 0.0 109.569 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -63.19 -39.03 93.47 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -172.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 66.65 179.63 0.21 Allowed 'General case' 0 N--CA 1.498 1.959 0 C-N-CA 124.289 1.035 . . . . 0.0 112.449 -173.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 40.0 t-80 . . . . . 0 N--CA 1.485 1.305 0 C-N-CA 123.223 0.609 . . . . 0.0 110.122 176.722 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 120.584 0.23 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.67 154.5 10.34 Favored Glycine 0 C--N 1.348 1.217 0 CA-C-N 116.649 -0.25 . . . . 0.0 112.964 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -170.74 149.59 3.14 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.504 0.722 . . . . 0.0 110.54 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.06 -139.79 9.53 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.095 0.378 . . . . 0.0 113.739 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -88.31 137.27 32.47 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.53 0.732 . . . . 0.0 110.344 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -124.68 177.26 6.06 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.705 0.802 . . . . 0.0 111.649 -174.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -82.99 -16.66 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.968 169.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 52.6 mt -72.35 -13.29 61.44 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.982 1.713 . . . . 0.0 113.857 -167.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.37 65.46 2.02 Favored Glycine 0 CA--C 1.539 1.559 0 C-N-CA 123.464 0.554 . . . . 0.0 112.77 176.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -164.91 -40.4 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.597 1.559 . . . . 0.0 109.374 -173.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 65.9 -77.79 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 126.124 1.77 . . . . 0.0 111.102 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.8 mt 55.38 -76.24 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 125.906 1.683 . . . . 0.0 113.776 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -81.78 60.01 4.49 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 124.579 1.152 . . . . 0.0 111.86 -175.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.422 HG22 ' H ' ' A' ' 16' ' ' CYS . 7.6 p -79.45 149.05 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.256 0 C-N-CA 123.738 0.815 . . . . 0.0 110.202 175.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 28' ' ' PHE . 75.0 m -58.5 -37.28 75.25 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 123.072 0.549 . . . . 0.0 111.956 177.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.568 ' SG ' HD13 ' A' ' 112' ' ' LEU . 81.6 m -150.04 149.29 30.11 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.302 0.641 . . . . 0.0 111.641 -178.348 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 71.3 m -93.31 33.04 1.25 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 123.841 0.857 . . . . 0.0 111.113 175.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.401 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . . . -134.67 140.56 35.76 Favored Pre-proline 0 CA--C 1.561 1.367 0 C-N-CA 123.574 0.75 . . . . 0.0 111.15 -172.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 18' ' ' ALA . 52.4 Cg_exo -59.05 7.55 0.07 OUTLIER 'Trans proline' 0 N--CA 1.513 2.652 0 C-N-CA 124.602 3.535 . . . . 0.0 118.231 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -88.08 -33.54 18.25 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 119.284 0.947 . . . . 0.0 111.064 168.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 84.9 m -147.17 93.19 2.21 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.517 1.127 . . . . 0.0 109.123 175.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.405 ' HA2' HG21 ' A' ' 14' ' ' VAL . . . -166.73 117.94 0.77 Allowed Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 -178.456 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 25.5 m-90 65.92 12.59 8.5 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.279 1.031 . . . . 0.0 113.613 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -52.01 -39.48 59.54 Favored 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -173.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.439 ' HG3' ' OD1' ' A' ' 26' ' ' ASN . 17.9 tpt180 -130.13 -74.01 0.55 Allowed 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 124.303 1.041 . . . . 0.0 109.586 176.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.439 ' OD1' ' HG3' ' A' ' 25' ' ' ARG . 1.6 p-10 -148.36 93.35 2.14 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.602 0.715 . . . . 0.0 109.319 173.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 67.11 -104.23 1.07 Allowed Glycine 0 C--N 1.347 1.147 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.957 -170.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.509 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 54.8 p90 -81.47 167.6 19.19 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.435 0.694 . . . . 0.0 112.0 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.421 ' HB2' ' HG3' ' A' ' 104' ' ' LYS . 56.5 m -95.83 95.76 8.49 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.984 0.514 . . . . 0.0 110.252 177.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -73.4 95.65 2.24 Favored 'General case' 0 CA--C 1.555 1.165 0 CA-C-O 121.141 0.496 . . . . 0.0 110.446 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -73.83 -39.31 64.14 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.825 0.85 . . . . 0.0 112.288 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -116.01 119.03 34.57 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.519 0.728 . . . . 0.0 109.712 173.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 29.7 m -66.31 -22.05 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 176.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -91.71 -36.78 13.4 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.072 0.949 . . . . 0.0 111.132 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.0 t70 53.21 85.33 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.717 1.207 . . . . 0.0 111.847 -169.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -176.29 -39.57 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.717 0.807 . . . . 0.0 111.905 175.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.52 79.9 0.01 OUTLIER Glycine 0 C--N 1.361 1.945 0 N-CA-C 115.809 1.084 . . . . 0.0 115.809 -165.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.2 m 60.51 -2.49 0.17 Allowed 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 125.664 1.585 . . . . 0.0 114.163 -175.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 62.34 139.11 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 125.381 1.472 . . . . 0.0 112.389 -169.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 40.7 p -94.22 102.74 14.77 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-O 121.325 0.583 . . . . 0.0 111.231 -176.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.435 HG11 ' HB2' ' A' ' 82' ' ' ALA . 21.4 t -135.16 102.22 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 C-N-CA 123.974 0.91 . . . . 0.0 109.334 171.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 61.6 m -108.03 104.3 13.72 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 170.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.427 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.73 144.01 32.5 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.325 1.05 . . . . 0.0 109.778 -173.449 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.503 ' HG3' ' HB3' ' A' ' 77' ' ' ARG . 1.7 mp0 -102.63 107.5 18.43 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 122.165 -0.335 . . . . 0.0 110.611 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.596 ' SD ' HD21 ' A' ' 80' ' ' LEU . 63.8 mtp -91.06 137.75 32.13 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 169.527 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.7 p -82.77 159.51 22.49 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 121.339 0.59 . . . . 0.0 111.713 -174.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -60.85 -28.6 68.95 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.54 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -50.98 -54.4 24.78 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.975 0.91 . . . . 0.0 112.096 174.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -74.86 -36.43 62.33 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.46 -26.8 65.67 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -78.59 -34.39 46.83 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.69 0.796 . . . . 0.0 110.877 168.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -62.31 -31.49 72.11 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 122.552 0.341 . . . . 0.0 110.631 170.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.3 m -75.7 -42.34 51.17 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.412 0.685 . . . . 0.0 110.757 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.441 ' HG3' ' HA ' ' A' ' 59' ' ' ASP . 43.5 ttt-85 -71.32 -61.11 1.89 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.207 1.003 . . . . 0.0 112.537 -175.193 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -79.97 -15.98 56.16 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -170.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -82.46 -37.29 25.61 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.999 -0.438 . . . . 0.0 110.912 173.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -81.63 -72.61 1.24 Allowed Glycine 0 CA--C 1.537 1.452 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.414 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -172.06 -60.23 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.856 1.262 . . . . 0.0 108.69 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.441 ' HA ' ' HG3' ' A' ' 54' ' ' ARG . 7.1 p-10 -146.31 178.7 8.05 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.338 172.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.4 tp -158.64 -55.48 0.07 Allowed 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 173.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 55.3 mtt -81.24 86.97 6.14 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-N 114.393 -1.276 . . . . 0.0 108.121 167.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 92.0 m -60.6 123.91 76.37 Favored Pre-proline 0 N--CA 1.485 1.3 0 C-N-CA 123.78 0.832 . . . . 0.0 111.92 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -66.96 87.43 0.3 Allowed 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 122.941 2.427 . . . . 0.0 112.449 177.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -88.55 138.89 29.78 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 123.952 0.901 . . . . 0.0 110.992 177.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -77.36 8.04 3.47 Favored 'Trans proline' 0 C--N 1.38 2.215 0 C-N-CA 122.741 2.294 . . . . 0.0 113.816 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -156.04 144.1 19.78 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.877 0.871 . . . . 0.0 108.688 175.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -103.6 87.18 2.77 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.765 0.826 . . . . 0.0 110.593 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -85.01 -56.64 3.46 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.426 0.69 . . . . 0.0 112.543 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -94.2 114.31 62.95 Favored Pre-proline 0 N--CA 1.486 1.353 0 C-N-CA 123.309 0.643 . . . . 0.0 111.329 -175.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -75.7 -71.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.379 2.151 0 C-N-CA 122.566 2.177 . . . . 0.0 111.859 170.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 53.24 -104.84 0.22 Allowed Glycine 0 C--N 1.36 1.899 0 C-N-CA 123.704 0.668 . . . . 0.0 114.342 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.46 ' HB2' ' HB3' ' A' ' 76' ' ' ASP . 2.7 pt? -150.63 139.72 21.1 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.073 0.549 . . . . 0.0 110.717 175.297 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.16 85.84 1.47 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.723 0.809 . . . . 0.0 109.406 169.541 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 70.53 129.38 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.253 1.421 . . . . 0.0 113.68 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 83.53 -7.82 67.44 Favored Glycine 0 CA--C 1.543 1.809 0 N-CA-C 114.973 0.749 . . . . 0.0 114.973 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.46 ' HB3' ' HB2' ' A' ' 72' ' ' LEU . 23.5 t70 -113.02 148.18 35.66 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.33 0.652 . . . . 0.0 111.073 -178.277 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.503 ' HB3' ' HG3' ' A' ' 44' ' ' GLU . 27.1 ptt180 -111.12 101.76 10.26 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.544 0.738 . . . . 0.0 111.282 -177.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -163.41 118.83 1.68 Allowed 'General case' 0 N--CA 1.483 1.203 0 O-C-N 121.712 -0.617 . . . . 0.0 111.599 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.6 t 51.61 27.96 4.36 Favored 'General case' 0 N--CA 1.5 2.033 0 C-N-CA 123.93 0.892 . . . . 0.0 112.391 174.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.596 HD21 ' SD ' ' A' ' 45' ' ' MET . 3.1 tm? -66.3 126.69 29.55 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.939 0.895 . . . . 0.0 110.56 -171.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.418 ' SG ' ' HB2' ' A' ' 83' ' ' SER . 43.4 t -64.16 101.3 0.4 Allowed 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 122.924 0.49 . . . . 0.0 110.863 177.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.435 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -56.86 -24.74 53.79 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.86 0.864 . . . . 0.0 113.018 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.418 ' HB2' ' SG ' ' A' ' 81' ' ' CYS . 54.4 m -61.61 -48.88 78.9 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.851 0.46 . . . . 0.0 111.296 171.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -59.35 -39.01 81.83 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 122.707 0.403 . . . . 0.0 112.061 179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.748 ' HE1' HD23 ' A' ' 115' ' ' LEU . 13.1 t-105 -66.63 -52.71 42.13 Favored 'General case' 0 CA--C 1.569 1.689 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.132 174.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.467 ' HB2' HG12 ' A' ' 110' ' ' VAL . 34.2 tp60 -49.54 -47.28 49.17 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 176.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -35.44 77.52 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.576 0.75 . . . . 0.0 111.903 177.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.407 ' HB1' ' HA ' ' A' ' 94' ' ' ALA . . . -61.9 -39.12 90.9 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.097 0.559 . . . . 0.0 111.89 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.603 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 68.8 t80 -60.42 -51.73 68.24 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.164 0.507 . . . . 0.0 110.771 175.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -71.6 -19.49 62.12 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.476 -177.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.28 -11.45 46.44 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.692 0.797 . . . . 0.0 112.36 175.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.96 10.4 85.12 Favored Glycine 0 CA--C 1.542 1.757 0 N-CA-C 114.091 0.396 . . . . 0.0 114.091 -176.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 94.2 mmm -112.83 27.98 9.17 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.346 1.058 . . . . 0.0 110.725 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.603 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -67.76 117.45 48.15 Favored Pre-proline 0 CA--C 1.558 1.276 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 -178.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 94' ' ' ALA . 52.6 Cg_endo -67.05 174.81 6.35 Favored 'Trans proline' 0 CA--C 1.566 2.093 0 C-N-CA 123.074 2.516 . . . . 0.0 113.079 168.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.1 145.62 55.7 Favored 'Trans proline' 0 C--N 1.376 1.981 0 C-N-CA 121.522 1.481 . . . . 0.0 112.169 166.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.402 HG23 ' HB1' ' A' ' 43' ' ' ALA . 11.8 p -131.62 153.37 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.735 0.814 . . . . 0.0 108.99 174.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.532 HG21 ' HB3' ' A' ' 101' ' ' SER . 30.8 m -85.63 165.84 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-O 121.144 0.497 . . . . 0.0 111.302 173.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 86.4 mt -107.13 -26.06 11.28 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.609 0.764 . . . . 0.0 110.676 169.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -74.39 -60.33 2.32 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.503 0.721 . . . . 0.0 111.479 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.532 ' HB3' HG21 ' A' ' 98' ' ' VAL . 40.8 t -77.35 -25.33 50.94 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 179.297 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.492 ' H ' HG23 ' A' ' 98' ' ' VAL . 88.6 m -73.83 105.39 5.09 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 172.223 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -78.26 160.61 27.81 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.454 -175.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.535 ' HA ' HD13 ' A' ' 107' ' ' LEU . 27.9 mmtp -71.66 -12.85 61.54 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -169.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 16.6 t -61.94 -25.54 67.65 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 122.983 0.513 . . . . 0.0 111.369 170.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.446 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -57.02 -33.99 67.73 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.626 0.77 . . . . 0.0 112.888 172.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.535 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.4 mp -65.73 5.64 0.43 Allowed 'General case' 0 N--CA 1.503 2.224 0 C-N-CA 124.813 1.245 . . . . 0.0 113.588 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 46.2 mtp180 -94.57 -19.15 20.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.714 0.805 . . . . 0.0 110.28 175.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 34.7 m-85 -106.94 -51.4 2.93 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.099 1.359 . . . . 0.0 108.673 178.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.467 HG12 ' HB2' ' A' ' 86' ' ' GLN . 33.0 m -92.55 -170.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.017 170.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.3 t -120.27 163.46 17.76 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 114.638 -1.164 . . . . 0.0 108.103 155.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.568 HD13 ' SG ' ' A' ' 16' ' ' CYS . 2.7 tt -56.79 -31.87 65.1 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.571 0.349 . . . . 0.0 111.238 173.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.2 -41.44 79.36 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.702 0.801 . . . . 0.0 112.756 178.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -70.09 -33.54 72.01 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.192 0.597 . . . . 0.0 110.519 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.748 HD23 ' HE1' ' A' ' 85' ' ' TRP . 80.4 mt -67.69 -54.88 15.89 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.639 178.017 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -63.45 -37.07 85.89 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.341 1.056 . . . . 0.0 112.056 -175.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.78 -21.94 12.71 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -130.12 21.5 5.31 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.6 0.76 . . . . 0.0 111.681 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -128.3 170.95 12.46 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.837 0.855 . . . . 0.0 111.926 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.46 149.89 50.18 Favored Pre-proline 0 N--CA 1.487 1.388 0 C-N-CA 123.101 0.56 . . . . 0.0 110.627 172.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.58 97.98 0.74 Allowed 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 122.29 1.993 . . . . 0.0 111.593 174.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 8.7 p -75.57 134.6 28.86 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.261 0.624 . . . . 0.0 111.316 179.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 16.3 tp -90.5 115.06 27.36 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.127 0.571 . . . . 0.0 109.706 174.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -84.99 178.04 7.72 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 120.987 0.423 . . . . 0.0 110.94 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -95.68 38.3 1.17 Allowed 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -172.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 61.1 t60 60.94 -78.9 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 125.0 1.32 . . . . 0.0 112.306 174.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -150.08 64.87 0.97 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.228 1.011 . . . . 0.0 108.762 176.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 79.9 t60 51.99 46.08 27.2 Favored 'General case' 0 CA--C 1.569 1.695 0 C-N-CA 124.157 0.983 . . . . 0.0 111.089 -177.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 41.8 t60 65.14 97.98 0.04 OUTLIER 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 125.279 1.432 . . . . 0.0 111.789 -174.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 . . . . . 0 CA--C 1.56 1.362 0 C-N-CA 123.716 0.807 . . . . 0.0 110.003 173.046 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.1 mtp . . . . . 0 N--CA 1.494 1.741 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 122.55 133.95 4.34 Favored Glycine 0 N--CA 1.475 1.283 0 CA-C-O 119.836 -0.425 . . . . 0.0 113.188 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 60.88 89.92 0.07 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 125.064 1.345 . . . . 0.0 112.391 176.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.22 106.8 3.27 Favored Glycine 0 CA--C 1.535 1.315 0 N-CA-C 111.97 -0.452 . . . . 0.0 111.97 173.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -90.92 153.72 19.98 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.425 0.69 . . . . 0.0 109.947 177.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -130.4 132.87 45.97 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.935 0.494 . . . . 0.0 110.834 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.4 m -75.13 -17.09 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 124.203 1.001 . . . . 0.0 109.743 175.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 39.1 mt -78.08 -39.89 40.2 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.976 -176.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -88.08 62.44 3.87 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-N 115.402 -0.817 . . . . 0.0 113.777 -177.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -157.98 -48.72 0.06 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.759 0.824 . . . . 0.0 110.29 176.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -86.72 158.77 19.35 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.618 0.767 . . . . 0.0 110.736 175.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -74.15 136.3 42.89 Favored 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 172.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -96.94 -26.15 15.15 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.439 0.696 . . . . 0.0 110.971 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.585 HG23 HG21 ' A' ' 21' ' ' THR . 9.8 p -102.76 173.29 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.566 1.587 0 C-N-CA 124.375 1.07 . . . . 0.0 111.062 -172.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.506 ' H ' HG22 ' A' ' 14' ' ' VAL . 10.4 t -147.07 -73.62 0.21 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.914 -0.491 . . . . 0.0 112.084 -167.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.6 t 69.85 6.01 5.52 Favored 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 125.307 1.443 . . . . 0.0 113.797 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.7 m -62.68 -58.43 7.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.017 0.527 . . . . 0.0 111.857 -178.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -173.86 -55.51 0.0 OUTLIER Pre-proline 0 CA--C 1.568 1.648 0 C-N-CA 124.114 0.966 . . . . 0.0 111.819 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -84.59 -17.18 5.29 Favored 'Trans proline' 0 C--N 1.392 2.855 0 C-N-CA 122.126 1.884 . . . . 0.0 114.453 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 66.3 mtt -125.43 146.53 49.58 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.688 0.795 . . . . 0.0 111.377 -176.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.585 HG21 HG23 ' A' ' 14' ' ' VAL . 66.3 p 51.86 -89.88 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 126.232 1.813 . . . . 0.0 112.865 -173.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 58.12 -83.68 0.01 OUTLIER Glycine 0 CA--C 1.548 2.153 0 N-CA-C 116.052 1.181 . . . . 0.0 116.052 171.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 27.9 m-90 -51.89 -53.17 43.77 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 125.508 1.523 . . . . 0.0 113.03 -177.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -68.39 105.52 2.2 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -79.8 73.06 6.55 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-O 121.979 0.895 . . . . 0.0 110.343 -178.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.423 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 25.4 t-20 -169.59 151.75 4.47 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.528 -1.214 . . . . 0.0 108.715 -173.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.05 -53.29 3.93 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-N 116.54 -0.3 . . . . 0.0 112.925 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.507 ' N ' HG21 ' A' ' 14' ' ' VAL . 52.5 p90 -74.91 -5.69 45.1 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 122.915 0.486 . . . . 0.0 111.969 175.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.423 ' SG ' ' HA ' ' A' ' 26' ' ' ASN . 78.2 m -54.81 92.1 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.846 1.259 . . . . 0.0 112.477 -178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -69.82 88.47 0.55 Allowed 'General case' 0 CA--C 1.551 1.012 0 CA-C-O 121.771 0.796 . . . . 0.0 111.155 179.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.2 t -117.57 -18.24 9.78 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.54 1.136 . . . . 0.0 110.033 172.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -64.93 -39.54 93.66 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.347 1.059 . . . . 0.0 111.252 174.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.2 t 62.63 -80.63 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 C-N-CA 125.497 1.519 . . . . 0.0 112.3 176.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.24 -0.98 32.12 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.446 0.698 . . . . 0.0 111.671 -176.586 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.0 t70 61.84 -164.25 0.25 Allowed 'General case' 0 CA--C 1.572 1.79 0 C-N-CA 124.409 1.084 . . . . 0.0 110.748 178.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 71.34 -67.18 0.27 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 125.496 1.519 . . . . 0.0 112.253 174.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.38 14.28 29.7 Favored Glycine 0 CA--C 1.541 1.71 0 CA-C-O 119.582 -0.565 . . . . 0.0 114.182 173.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.4 m 66.13 -80.26 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 125.23 1.412 . . . . 0.0 112.223 176.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.6 m80 56.78 31.29 19.23 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 124.424 1.089 . . . . 0.0 112.611 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.519 ' HB ' ' HB3' ' A' ' 105' ' ' SER . 1.7 m -92.0 98.5 11.6 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -168.044 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.531 HG22 ' HA ' ' A' ' 106' ' ' ALA . 34.5 t -138.41 100.4 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.978 0 C-N-CA 124.662 1.185 . . . . 0.0 110.206 -174.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 62.8 m -101.14 103.63 14.7 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 166.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.429 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -134.55 147.48 50.29 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 -176.028 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.436 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 26.1 tt0 -120.29 109.55 15.52 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.213 0.53 . . . . 0.0 111.258 -169.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.588 ' HB2' HD11 ' A' ' 50' ' ' LEU . 73.6 mmm -93.94 150.93 19.93 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.22 1.008 . . . . 0.0 110.656 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 70.2 p -82.94 155.88 23.79 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 171.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.565 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 24.5 tt0 -58.98 -27.37 65.33 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.837 0.455 . . . . 0.0 112.015 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -49.06 -38.4 24.06 Favored 'General case' 0 CA--C 1.566 1.591 0 C-N-CA 123.923 0.889 . . . . 0.0 111.816 170.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -73.56 -53.03 11.5 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 172.176 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.0 mp -66.76 -25.51 66.53 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -170.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.565 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 92.1 mt -73.57 -40.5 63.87 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.891 0.876 . . . . 0.0 110.76 171.029 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -60.71 -46.73 89.26 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.312 0.645 . . . . 0.0 110.958 174.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.1 t -63.75 -39.17 93.63 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.627 0.771 . . . . 0.0 111.805 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.489 ' HA ' ' HA ' ' A' ' 59' ' ' ASP . 6.0 ptm180 -78.89 -43.15 25.51 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 -177.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -82.56 -32.51 28.49 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.516 0.727 . . . . 0.0 111.517 -170.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.71 -34.92 10.73 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.835 0.454 . . . . 0.0 110.309 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -89.8 -105.53 1.17 Allowed Glycine 0 C--N 1.35 1.335 0 CA-C-N 116.262 -0.426 . . . . 0.0 113.65 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -161.6 23.69 0.12 Allowed 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 117.236 0.518 . . . . 0.0 111.847 -174.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.489 ' HA ' ' HA ' ' A' ' 54' ' ' ARG . 0.5 OUTLIER 75.36 -178.33 0.16 Allowed 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.616 1.567 . . . . 0.0 112.636 -178.261 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 tm? 176.14 -45.45 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 126.241 1.816 . . . . 0.0 107.761 -175.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 50.7 ttp -69.79 -40.11 76.21 Favored 'General case' 0 CA--C 1.557 1.226 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.53 -172.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.8 p -95.96 153.22 39.27 Favored Pre-proline 0 N--CA 1.491 1.618 0 C-N-CA 122.878 0.471 . . . . 0.0 111.394 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -77.39 39.32 0.73 Allowed 'Trans proline' 0 C--N 1.388 2.649 0 C-N-CA 123.362 2.708 . . . . 0.0 115.236 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 68.9 mtp180 -56.18 150.51 30.95 Favored Pre-proline 0 N--CA 1.487 1.382 0 C-N-CA 123.979 0.912 . . . . 0.0 112.27 174.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -59.99 -13.79 24.84 Favored 'Trans proline' 0 N--CA 1.512 2.582 0 C-N-CA 123.567 2.845 . . . . 0.0 114.337 -172.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -63.25 -45.43 91.6 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 123.877 0.871 . . . . 0.0 111.545 174.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -107.06 -29.42 9.41 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 123.786 0.834 . . . . 0.0 112.133 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 67.48 -67.72 0.17 Allowed 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 125.654 1.582 . . . . 0.0 112.646 -176.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -104.88 110.95 65.14 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.853 0.861 . . . . 0.0 110.609 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -83.41 172.1 10.67 Favored 'Trans proline' 0 CA--C 1.56 1.814 0 C-N-CA 122.881 2.388 . . . . 0.0 113.521 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -99.28 -121.53 4.58 Favored Glycine 0 C--N 1.351 1.407 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.961 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.418 ' HB3' ' O ' ' A' ' 78' ' ' TRP . 2.6 pt? -65.91 159.23 26.03 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.942 0.897 . . . . 0.0 113.17 178.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -87.24 177.98 7.0 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.563 164.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.19 87.69 1.95 Allowed 'General case' 0 CA--C 1.549 0.94 0 CA-C-O 121.18 0.514 . . . . 0.0 110.859 176.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 116.16 31.29 1.9 Allowed Glycine 0 CA--C 1.539 1.556 0 CA-C-N 115.67 -0.695 . . . . 0.0 113.776 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -122.15 113.78 19.97 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-N 117.28 0.54 . . . . 0.0 110.592 169.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.436 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 13.0 ptp180 -69.8 89.82 0.58 Allowed 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 121.935 0.874 . . . . 0.0 111.178 177.109 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.418 ' O ' ' HB3' ' A' ' 72' ' ' LEU . 26.4 t90 -177.61 140.81 0.27 Allowed 'General case' 0 N--CA 1.491 1.612 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.976 -171.063 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 44.9 t 50.79 31.85 6.47 Favored 'General case' 0 N--CA 1.508 2.459 0 C-N-CA 124.773 1.229 . . . . 0.0 113.702 167.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.462 HD22 ' HD2' ' A' ' 84' ' ' ARG . 3.0 tm? -81.62 -33.29 31.54 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 118.847 -0.597 . . . . 0.0 111.889 -171.115 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 37.6 t 65.12 121.8 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 123.463 0.705 . . . . 0.0 111.58 -175.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.513 ' H ' HG21 ' A' ' 41' ' ' VAL . . . -61.23 -29.88 70.1 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -170.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.5 m -57.76 -33.5 68.58 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.668 0.787 . . . . 0.0 112.551 176.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.462 ' HD2' HD22 ' A' ' 80' ' ' LEU . 30.2 ttm180 -73.43 -45.43 54.51 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.791 0.836 . . . . 0.0 111.324 -174.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.552 ' HE1' HD23 ' A' ' 115' ' ' LEU . 1.6 t-105 -74.23 -52.08 13.44 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.55 0.74 . . . . 0.0 111.277 176.183 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.435 ' OE1' HG12 ' A' ' 110' ' ' VAL . 34.2 tp60 -51.67 -37.73 51.86 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.044 0.938 . . . . 0.0 112.948 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -62.72 -42.74 99.81 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.768 0.427 . . . . 0.0 111.395 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.71 -33.8 76.45 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.338 0.655 . . . . 0.0 111.913 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -61.17 -51.4 69.22 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.51 0.724 . . . . 0.0 111.041 174.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.72 -25.56 63.91 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.411 0.685 . . . . 0.0 112.266 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.38 -14.39 58.99 Favored 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 123.54 0.736 . . . . 0.0 111.699 171.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.73 -20.18 29.31 Favored Glycine 0 C--N 1.353 1.48 0 N-CA-C 114.448 0.539 . . . . 0.0 114.448 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 4.5 ppp? -84.56 5.18 28.76 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -171.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.462 ' HB1' ' CZ3' ' A' ' 85' ' ' TRP . . . -54.14 131.99 60.02 Favored Pre-proline 0 CA--C 1.564 1.518 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.9 174.89 10.49 Favored 'Trans proline' 0 CA--C 1.565 2.055 0 C-N-CA 123.484 2.789 . . . . 0.0 113.585 172.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.95 124.46 13.58 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.151 1.901 . . . . 0.0 112.446 166.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.09 137.86 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.581 0.752 . . . . 0.0 110.597 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.49 HG13 ' HB3' ' A' ' 101' ' ' SER . 4.5 p -68.44 103.4 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.572 1.812 0 CA-C-O 121.902 0.858 . . . . 0.0 112.066 179.049 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 86.7 mt -58.41 -40.89 83.67 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 124.845 1.258 . . . . 0.0 112.694 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -78.52 7.04 7.31 Favored 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -175.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.49 ' HB3' HG13 ' A' ' 98' ' ' VAL . 40.9 t -118.42 -25.31 6.55 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 122.952 0.501 . . . . 0.0 111.973 173.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.2 p -69.16 115.21 8.19 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.583 0.353 . . . . 0.0 111.14 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.6 mp0 -64.44 160.8 18.4 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.007 0.523 . . . . 0.0 111.978 175.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.418 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 3.3 tmtp? -66.06 -27.63 68.23 Favored 'General case' 0 CA--C 1.561 1.402 0 CA-C-O 121.191 0.52 . . . . 0.0 109.754 174.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.519 ' HB3' ' HB ' ' A' ' 40' ' ' THR . 45.3 t -60.12 -28.76 68.13 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.248 0.619 . . . . 0.0 111.794 173.284 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.531 ' HA ' HG22 ' A' ' 41' ' ' VAL . . . -65.2 -44.21 89.08 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 122.813 0.445 . . . . 0.0 111.282 171.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.427 ' HA ' HG23 ' A' ' 110' ' ' VAL . 9.5 mp -64.45 6.19 0.22 Allowed 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 125.463 1.505 . . . . 0.0 113.741 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -95.99 -14.71 22.8 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.475 0.71 . . . . 0.0 110.459 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -114.39 -41.21 3.49 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.664 1.186 . . . . 0.0 108.469 178.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.532 HG21 HD21 ' A' ' 115' ' ' LEU . 1.7 m -92.99 -168.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.861 0.839 . . . . 0.0 110.739 164.009 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.3 t -131.01 156.01 45.85 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.949 1.3 . . . . 0.0 107.886 160.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 tt -49.28 -39.21 29.9 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.995 0.518 . . . . 0.0 111.625 170.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.1 77.05 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.206 0.602 . . . . 0.0 112.495 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -68.43 -32.86 73.18 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.792 0.437 . . . . 0.0 111.025 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.552 HD23 ' HE1' ' A' ' 85' ' ' TRP . 29.5 mt -73.26 -55.64 6.16 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.902 -178.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -66.0 -24.31 66.75 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.78 1.232 . . . . 0.0 112.993 -176.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -53.21 -34.27 56.35 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 174.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 69.3 m-70 -115.19 -23.02 9.16 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.365 0.666 . . . . 0.0 112.415 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -83.29 -25.27 31.73 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.321 0.648 . . . . 0.0 112.157 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.412 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 4.2 mm? 68.48 139.6 0.06 OUTLIER Pre-proline 0 CA--C 1.561 1.372 0 C-N-CA 125.494 1.518 . . . . 0.0 112.557 -174.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 120' ' ' LEU . 6.5 Cg_exo -74.24 16.55 0.56 Allowed 'Trans proline' 0 C--N 1.382 2.296 0 C-N-CA 123.568 2.846 . . . . 0.0 115.252 -173.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 59.1 t 62.4 107.68 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.509 0 C-N-CA 125.328 1.451 . . . . 0.0 113.05 173.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.9 tt -65.8 -20.36 66.22 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.998 0.919 . . . . 0.0 112.715 -178.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -61.19 91.98 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.522 0.729 . . . . 0.0 112.654 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 77.3 t60 44.55 106.04 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 126.348 1.859 . . . . 0.0 115.571 170.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -95.25 -58.37 2.16 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.536 0.334 . . . . 0.0 110.616 169.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -143.1 -166.61 2.35 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 124.297 1.039 . . . . 0.0 110.393 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -102.37 -54.76 2.61 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 165.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 20.8 p80 -158.56 138.46 12.1 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.576 1.15 . . . . 0.0 108.862 169.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 . . . . . 0 CA--C 1.571 1.755 0 C-N-CA 124.65 1.18 . . . . 0.0 111.17 -169.371 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.2 -68.31 3.31 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 116.404 -0.362 . . . . 0.0 113.167 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -81.44 115.94 21.01 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.182 0.993 . . . . 0.0 111.292 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -163.46 106.06 0.27 Allowed Glycine 0 C--N 1.351 1.38 0 N-CA-C 112.388 -0.285 . . . . 0.0 112.388 175.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -106.46 157.96 17.26 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.772 0.829 . . . . 0.0 111.41 -176.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -95.96 177.65 5.68 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.383 0.673 . . . . 0.0 111.285 175.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 11.2 m -66.76 -18.45 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -174.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.418 ' H ' HD22 ' A' ' 8' ' ' LEU . 2.4 mm? -68.99 -30.34 68.73 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.876 0.871 . . . . 0.0 111.175 175.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 96.62 -78.1 0.72 Allowed Glycine 0 C--N 1.344 0.976 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.78 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -172.8 167.14 5.26 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.211 1.005 . . . . 0.0 111.588 178.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -158.93 104.82 1.74 Allowed 'General case' 0 CA--C 1.565 1.534 0 C-N-CA 124.125 0.97 . . . . 0.0 110.519 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 89.3 mt -114.39 70.01 0.72 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.153 -0.967 . . . . 0.0 110.898 -178.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -140.24 153.12 46.44 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 124.863 1.265 . . . . 0.0 109.721 175.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.414 HG21 ' H ' ' A' ' 28' ' ' PHE . 8.5 p -169.52 148.07 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -178.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 78.2 m -145.84 0.41 0.85 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.811 0.844 . . . . 0.0 111.979 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.4 t 59.54 129.24 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 124.929 1.291 . . . . 0.0 113.661 -168.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 77.0 m 75.97 -39.27 0.37 Allowed 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 125.62 1.568 . . . . 0.0 114.069 176.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.61 154.49 91.21 Favored Pre-proline 0 CA--C 1.561 1.39 0 C-N-CA 123.918 0.887 . . . . 0.0 112.292 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -68.02 -175.37 0.78 Allowed 'Trans proline' 0 C--N 1.385 2.466 0 C-N-CA 122.71 2.273 . . . . 0.0 112.997 172.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 51.7 mtm 72.92 -7.73 1.41 Allowed 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 124.99 1.316 . . . . 0.0 112.889 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.0 t -131.59 116.46 17.42 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.216 1.006 . . . . 0.0 109.844 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -175.59 -23.69 0.03 OUTLIER Glycine 0 C--N 1.346 1.133 0 CA-C-N 116.374 -0.376 . . . . 0.0 113.721 -175.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -76.51 -70.21 0.46 Allowed 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 122.699 0.4 . . . . 0.0 110.208 176.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -83.12 -57.86 3.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 122.062 -0.399 . . . . 0.0 111.131 172.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 50.3 ttm-85 72.5 -57.61 0.62 Allowed 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 125.64 1.576 . . . . 0.0 112.726 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 72.98 10.79 5.3 Favored 'General case' 0 N--CA 1.505 2.293 0 C-N-CA 125.097 1.359 . . . . 0.0 113.029 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.91 36.47 92.15 Favored Glycine 0 N--CA 1.482 1.762 0 N-CA-C 115.186 0.834 . . . . 0.0 115.186 176.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.414 ' H ' HG21 ' A' ' 14' ' ' VAL . 47.5 t80 62.93 -79.63 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.972 1.309 . . . . 0.0 111.909 -178.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 74.2 m -98.88 -90.13 0.3 Allowed 'General case' 0 CA--C 1.556 1.199 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 172.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.514 ' HG2' ' HB2' ' A' ' 105' ' ' SER . 1.8 mp0 -137.29 -61.34 0.65 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 124.461 1.104 . . . . 0.0 108.338 176.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 t -158.61 -39.39 0.06 Allowed 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 113.945 -1.48 . . . . 0.0 108.696 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 69.41 130.21 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 125.793 1.637 . . . . 0.0 113.366 166.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 21.4 t -96.01 -10.12 9.04 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.673 0 C-N-CA 123.597 0.759 . . . . 0.0 112.088 -174.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 72.37 -36.84 0.37 Allowed 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 126.429 1.892 . . . . 0.0 113.401 -177.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -98.38 40.51 1.18 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.89 0.876 . . . . 0.0 110.609 171.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 69.38 149.61 0.08 Allowed 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 125.678 1.591 . . . . 0.0 113.166 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 152.26 -112.13 0.52 Allowed Glycine 0 CA--C 1.535 1.295 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.151 -178.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.478 ' HB3' ' NE2' ' A' ' 30' ' ' GLN . 67.9 m 63.38 8.57 3.56 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 174.213 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 -86.11 84.97 7.37 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.374 0.67 . . . . 0.0 110.066 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 103' ' ' GLU . 4.9 t -130.76 103.41 6.58 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.364 0.666 . . . . 0.0 110.695 -175.165 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.6 t -138.34 111.89 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 C-N-CA 123.255 0.622 . . . . 0.0 110.353 -178.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 72.2 m -101.42 106.41 17.55 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 171.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.546 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -139.53 147.92 41.9 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.36 0.664 . . . . 0.0 109.689 -175.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -106.61 112.79 25.94 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.461 0.304 . . . . 0.0 111.375 -172.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.477 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 29.7 mtm -110.0 137.68 47.43 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.044 170.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.1 p -83.7 167.98 16.69 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.602 0.761 . . . . 0.0 111.689 -171.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.404 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 28.4 tt0 -61.12 -30.37 70.33 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.506 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -49.56 -55.33 13.85 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.962 0.905 . . . . 0.0 111.509 174.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -76.22 -37.6 57.53 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' A' ' 45' ' ' MET . 10.9 mp -67.41 -33.74 75.8 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 118.351 0.523 . . . . 0.0 111.706 -177.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 68.6 mt -72.61 -27.88 62.43 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.239 0.616 . . . . 0.0 111.245 170.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -73.83 -34.07 64.41 Favored 'General case' 0 CA--C 1.563 1.47 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 172.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 73.3 m -66.76 -31.09 71.51 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.312 0.645 . . . . 0.0 112.599 -175.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.543 ' HB2' ' HA ' ' A' ' 59' ' ' ASP . 36.4 ptt180 -70.44 -27.53 64.32 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.063 0.545 . . . . 0.0 111.472 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -76.15 -34.44 59.39 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 122.618 0.367 . . . . 0.0 110.174 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -81.21 82.71 7.02 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.712 0.805 . . . . 0.0 110.055 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 116.35 -82.14 0.32 Allowed Glycine 0 N--CA 1.478 1.496 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.505 178.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -156.31 149.15 23.97 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 123.358 0.663 . . . . 0.0 111.256 -176.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.543 ' HA ' ' HB2' ' A' ' 54' ' ' ARG . 9.8 p-10 -90.25 41.36 1.05 Allowed 'General case' 0 CA--C 1.565 1.531 0 C-N-CA 123.874 0.869 . . . . 0.0 113.223 -174.256 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -66.05 -40.27 90.82 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 172.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 13.9 tpt 75.13 -58.62 0.57 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 125.757 1.623 . . . . 0.0 112.578 175.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 84.9 m -59.73 123.81 73.21 Favored Pre-proline 0 CA--C 1.556 1.201 0 C-N-CA 124.205 1.002 . . . . 0.0 111.302 175.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.47 176.93 9.45 Favored 'Trans proline' 0 C--N 1.375 1.938 0 C-N-CA 122.22 1.946 . . . . 0.0 112.503 176.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 70.15 157.8 0.16 Allowed Pre-proline 0 N--CA 1.498 1.96 0 C-N-CA 124.592 1.157 . . . . 0.0 112.891 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -77.21 33.02 0.43 Allowed 'Trans proline' 0 C--N 1.381 2.274 0 C-N-CA 122.528 2.152 . . . . 0.0 113.477 170.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -123.02 131.11 53.57 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.316 1.447 . . . . 0.0 108.692 178.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -100.42 -6.45 25.65 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -170.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -76.54 84.28 3.23 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 -177.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 65.41 142.4 0.07 OUTLIER Pre-proline 0 N--CA 1.494 1.766 0 C-N-CA 125.554 1.542 . . . . 0.0 114.26 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -68.16 93.53 0.4 Allowed 'Trans proline' 0 C--N 1.383 2.369 0 C-N-CA 122.381 2.054 . . . . 0.0 111.53 172.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -65.14 -41.33 97.07 Favored Glycine 0 C--N 1.35 1.317 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.7 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -94.88 102.73 14.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.191 0.596 . . . . 0.0 110.118 174.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -97.93 -167.67 1.55 Allowed 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.87 112.27 5.45 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.79 -1.38 58.09 Favored Glycine 0 N--CA 1.475 1.272 0 CA-C-N 115.704 -0.68 . . . . 0.0 113.883 177.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.03 104.42 6.55 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.184 0.516 . . . . 0.0 111.675 178.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.572 ' HD3' HG11 ' A' ' 98' ' ' VAL . 13.7 ptt180 -81.19 91.65 6.2 Favored 'General case' 0 CA--C 1.557 1.221 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.03 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -168.51 120.88 0.82 Allowed 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.232 0.613 . . . . 0.0 110.271 176.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 48.5 t 51.62 25.23 2.69 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 124.166 0.986 . . . . 0.0 112.648 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.546 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.4 tm? -66.86 123.4 20.05 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.081 0.952 . . . . 0.0 109.536 -177.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.444 ' SG ' ' HB3' ' A' ' 83' ' ' SER . 42.6 t -59.01 102.35 0.12 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.224 0.609 . . . . 0.0 110.924 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.96 -26.89 62.89 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.922 0.889 . . . . 0.0 112.223 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.444 ' HB3' ' SG ' ' A' ' 81' ' ' CYS . 45.7 t -67.25 -41.46 85.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.566 0.746 . . . . 0.0 111.483 172.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 56.4 ttm-85 -73.89 -31.62 63.2 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.004 0.522 . . . . 0.0 111.843 179.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.624 ' HE1' HD23 ' A' ' 115' ' ' LEU . 6.0 t-105 -64.45 -42.1 96.16 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 169.031 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -58.18 -38.08 76.0 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.708 0.403 . . . . 0.0 110.85 174.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 83' ' ' SER . 41.6 mm-40 -62.18 -39.13 91.66 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.893 0.477 . . . . 0.0 111.774 176.364 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.53 -41.23 96.51 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.152 0.501 . . . . 0.0 111.393 174.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.759 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 40.2 t80 -67.41 -42.59 82.99 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.41 -176.489 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -77.03 -32.24 56.9 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.324 0.649 . . . . 0.0 111.988 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.88 -22.93 62.22 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.028 0.531 . . . . 0.0 111.74 176.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 106.33 -11.01 43.44 Favored Glycine 0 N--CA 1.476 1.328 0 CA-C-O 119.717 -0.491 . . . . 0.0 114.275 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' MET . . . . . 0.414 ' N ' ' SD ' ' A' ' 93' ' ' MET . 1.1 mpt? -66.79 -66.91 0.49 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 117.41 0.605 . . . . 0.0 109.947 176.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.759 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 48.14 87.34 0.13 Allowed Pre-proline 0 CA--C 1.558 1.269 0 C-N-CA 125.135 1.374 . . . . 0.0 114.018 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -64.85 158.22 52.23 Favored 'Trans proline' 0 CA--C 1.566 2.076 0 C-N-CA 123.18 2.586 . . . . 0.0 113.409 172.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -68.29 109.44 2.0 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.362 2.042 . . . . 0.0 112.35 173.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.7 p -95.99 137.01 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 123.672 0.789 . . . . 0.0 110.916 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.572 HG11 ' HD3' ' A' ' 77' ' ' ARG . 5.5 p -77.34 107.77 9.4 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.741 0 C-N-CA 123.953 0.901 . . . . 0.0 113.076 -174.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 98.6 mt -67.79 -36.81 81.1 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.823 0.849 . . . . 0.0 112.52 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -78.43 20.51 0.41 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.624 0.77 . . . . 0.0 112.769 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.0 t -142.79 -44.23 0.31 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.688 0.795 . . . . 0.0 111.324 175.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.7 m -56.88 121.49 10.02 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 123.862 0.865 . . . . 0.0 112.737 -173.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 40' ' ' THR . 1.9 mp0 -74.14 166.8 22.79 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.034 0.933 . . . . 0.0 113.071 -173.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.402 ' HA ' HD13 ' A' ' 107' ' ' LEU . 32.9 mmtp -68.59 -13.42 62.33 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.101 0.96 . . . . 0.0 113.034 -177.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.514 ' HB2' ' HG2' ' A' ' 30' ' ' GLN . 33.5 t -57.35 -48.68 78.38 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 122.971 0.509 . . . . 0.0 110.613 172.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.58 -32.49 63.09 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.536 0.734 . . . . 0.0 112.82 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.455 ' HG ' ' HB2' ' A' ' 112' ' ' LEU . 8.6 mp -66.16 -22.81 66.38 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.007 0.523 . . . . 0.0 112.371 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.2 mtt85 -89.32 -7.49 55.23 Favored 'General case' 0 CA--C 1.561 1.393 0 C-N-CA 123.686 0.794 . . . . 0.0 112.78 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -117.9 -57.97 2.05 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 123.331 0.652 . . . . 0.0 112.057 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.45 HG21 ' CD1' ' A' ' 85' ' ' TRP . 13.3 p -98.66 -25.75 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 C-N-CA 123.589 0.756 . . . . 0.0 111.767 -176.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 46.8 t 77.58 149.46 0.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 125.689 1.596 . . . . 0.0 112.394 -173.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.555 ' HA ' HD12 ' A' ' 115' ' ' LEU . 4.6 tt -61.31 -37.12 82.08 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.713 1.205 . . . . 0.0 113.021 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.47 -34.8 76.08 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -173.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.35 -34.0 72.12 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.103 0.961 . . . . 0.0 111.481 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.624 HD23 ' HE1' ' A' ' 85' ' ' TRP . 57.4 mt -69.15 -48.01 63.45 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 121.943 0.877 . . . . 0.0 110.434 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -70.26 -37.87 74.99 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.848 -175.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -57.69 -16.74 11.79 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -132.35 39.12 3.42 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.392 0.677 . . . . 0.0 111.56 173.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -153.25 -63.09 0.15 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.175 0.59 . . . . 0.0 111.294 170.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 59.1 tp -142.55 111.13 5.82 Favored Pre-proline 0 N--CA 1.486 1.366 0 C-N-CA 123.81 0.844 . . . . 0.0 109.355 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -77.22 81.56 2.59 Favored 'Trans proline' 0 CA--C 1.56 1.781 0 C-N-CA 122.707 2.271 . . . . 0.0 112.934 -171.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' VAL . . . . . 0.503 HG22 ' H ' ' A' ' 124' ' ' GLU . 14.2 p -64.74 138.53 22.96 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.321 0 C-N-CA 123.909 0.884 . . . . 0.0 111.424 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.0 pp -101.18 -6.13 24.67 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.744 0.418 . . . . 0.0 111.677 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.503 ' H ' HG22 ' A' ' 122' ' ' VAL . 30.7 mp0 -84.2 31.15 0.51 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.654 1.181 . . . . 0.0 111.782 175.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -66.64 114.16 5.36 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.88 0.472 . . . . 0.0 109.767 172.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 69.8 m80 -121.25 145.75 47.52 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.493 0.717 . . . . 0.0 111.29 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 67.8 t60 -78.29 111.12 13.94 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.234 1.014 . . . . 0.0 110.367 -177.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 12.8 m170 62.22 -81.71 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 124.432 1.093 . . . . 0.0 111.725 -173.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 -174.87 -41.61 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.73 1.212 . . . . 0.0 109.901 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 80.1 t60 . . . . . 0 CA--C 1.558 1.282 0 C-N-CA 124.73 1.212 . . . . 0.0 109.664 -177.096 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.3 mtt . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 120.852 0.358 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -150.44 -154.07 6.34 Favored Glycine 0 N--CA 1.473 1.135 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.293 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -150.8 -177.3 5.92 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 117.346 0.573 . . . . 0.0 111.911 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.07 149.71 19.38 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.783 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -89.36 115.17 26.63 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -168.38 113.74 0.64 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.899 0.88 . . . . 0.0 110.236 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.73 ' H ' ' HB2' ' A' ' 11' ' ' ASP . 21.6 t 75.28 -48.21 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.394 0 C-N-CA 126.689 1.995 . . . . 0.0 112.736 175.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 pp -53.46 -25.24 15.41 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.591 1.556 . . . . 0.0 112.825 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -150.3 59.83 0.43 Allowed Glycine 0 C--N 1.343 0.94 0 N-CA-C 110.415 -1.074 . . . . 0.0 110.415 174.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 76.06 160.31 0.22 Allowed 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 125.56 1.544 . . . . 0.0 111.684 -177.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.73 ' HB2' ' H ' ' A' ' 7' ' ' VAL . 27.5 t70 -171.06 94.32 0.18 Allowed 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.02 -177.159 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 72.0 mt 53.5 39.47 30.05 Favored 'General case' 0 CA--C 1.558 1.273 0 C-N-CA 124.711 1.204 . . . . 0.0 113.695 169.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -72.38 152.03 42.28 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.153 0.581 . . . . 0.0 111.211 175.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.609 HG13 ' H ' ' A' ' 29' ' ' CYS . 7.5 p -68.41 98.72 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.389 0 CA-C-O 122.503 1.144 . . . . 0.0 111.133 -176.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 54.0 t -111.42 -3.91 15.06 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.099 0.96 . . . . 0.0 112.128 -172.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.8 t 75.94 -22.84 0.26 Allowed 'General case' 0 N--CA 1.503 2.193 0 C-N-CA 125.58 1.552 . . . . 0.0 113.856 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 83.7 m -59.84 -33.86 72.34 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 124.206 1.002 . . . . 0.0 112.755 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -123.48 129.02 25.03 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 123.322 0.649 . . . . 0.0 110.824 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -65.13 115.49 3.33 Favored 'Trans proline' 0 C--N 1.379 2.143 0 C-N-CA 123.156 2.571 . . . . 0.0 112.224 174.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 59.9 ttp 61.93 89.1 0.08 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.852 1.261 . . . . 0.0 111.655 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.5 p -90.84 136.47 33.05 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.751 0.82 . . . . 0.0 110.898 178.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 71.05 -86.32 0.39 Allowed Glycine 0 C--N 1.354 1.538 0 O-C-N 123.108 0.255 . . . . 0.0 112.595 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -137.66 -44.68 0.54 Allowed 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.632 0.773 . . . . 0.0 109.519 172.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -149.34 -69.18 0.21 Allowed 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.793 0.837 . . . . 0.0 110.876 173.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? 59.68 -79.55 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 124.449 1.1 . . . . 0.0 110.33 -163.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 64.4 t30 67.18 138.42 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 125.763 1.625 . . . . 0.0 113.036 173.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.89 -19.05 10.39 Favored Glycine 0 N--CA 1.48 1.588 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.917 -176.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 64.94 83.3 0.17 Allowed 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 125.369 1.468 . . . . 0.0 111.99 177.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.609 ' H ' HG13 ' A' ' 14' ' ' VAL . 53.2 t -80.65 103.11 10.27 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.793 0.837 . . . . 0.0 110.291 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -118.69 35.62 4.72 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-O 122.142 0.972 . . . . 0.0 109.376 -177.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 13.9 t -128.63 165.55 20.61 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.38 -177.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -68.8 123.24 20.4 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.047 0.539 . . . . 0.0 112.431 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.57 -11.44 14.0 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.316 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.076 166.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -66.31 -14.06 61.46 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 124.787 1.235 . . . . 0.0 111.972 173.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 72.69 11.12 5.52 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.21 1.404 . . . . 0.0 112.504 174.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.427 ' HA ' ' HE ' ' A' ' 36' ' ' ARG . 10.1 mmp_? -85.53 -23.51 27.66 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.458 -0.777 . . . . 0.0 112.472 -178.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.55 -71.15 1.87 Allowed Glycine 0 CA--C 1.537 1.447 0 N-CA-C 114.127 0.411 . . . . 0.0 114.127 172.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.7 m -72.27 80.8 1.0 Allowed 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.545 0.738 . . . . 0.0 111.414 178.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 -171.48 1.13 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 124.562 1.145 . . . . 0.0 110.72 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.8 p -92.26 115.59 28.22 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 121.462 0.649 . . . . 0.0 111.093 -169.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.646 HG11 ' HB2' ' A' ' 82' ' ' ALA . 18.6 t -127.23 127.81 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.686 0.794 . . . . 0.0 109.954 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.409 ' SG ' ' HA ' ' A' ' 78' ' ' TRP . 93.6 m -136.39 108.86 7.38 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 168.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.577 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -140.43 150.77 44.25 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.123 0.969 . . . . 0.0 109.22 -170.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.448 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 20.2 tt0 -114.76 124.5 51.94 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.984 0.421 . . . . 0.0 111.812 -177.101 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.417 ' HE3' ' HB3' ' A' ' 45' ' ' MET . 67.1 mmm -108.21 138.46 44.45 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.079 0.951 . . . . 0.0 109.775 175.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 7.0 t -85.5 156.44 20.78 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.865 0.466 . . . . 0.0 110.398 174.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.541 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 37.6 tt0 -61.25 -29.29 69.75 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.065 0.546 . . . . 0.0 111.624 -175.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -48.3 -45.92 35.54 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 124.327 1.051 . . . . 0.0 111.845 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -76.93 -39.96 48.85 Favored 'General case' 0 CA--C 1.558 1.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.274 174.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.28 -26.1 68.34 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.541 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 95.9 mt -74.27 -47.47 34.72 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.691 0.796 . . . . 0.0 109.763 172.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -58.4 -31.77 68.01 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.642 0.777 . . . . 0.0 111.9 174.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.9 t -60.52 -36.2 77.81 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.535 0.734 . . . . 0.0 110.857 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.548 ' HB2' ' HB3' ' A' ' 59' ' ' ASP . 20.9 ttt180 -75.33 -50.64 15.38 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.946 0.898 . . . . 0.0 111.012 174.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -65.02 -18.07 64.98 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.518 0.727 . . . . 0.0 112.925 -176.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 -94.23 -56.42 2.84 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.298 0.639 . . . . 0.0 110.18 172.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -124.84 -88.62 0.78 Allowed Glycine 0 C--N 1.349 1.28 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.417 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -154.75 152.12 29.51 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.537 0.735 . . . . 0.0 111.162 -178.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.548 ' HB3' ' HB2' ' A' ' 54' ' ' ARG . 4.4 p-10 -105.01 168.41 9.07 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.173 0.589 . . . . 0.0 109.757 171.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 95.6 mt -121.22 7.3 10.22 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.214 0.605 . . . . 0.0 111.138 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.46 14.8 24.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -170.257 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 81.4 m -71.19 118.97 70.69 Favored Pre-proline 0 N--CA 1.492 1.67 0 C-N-CA 122.736 0.415 . . . . 0.0 110.88 170.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.6 108.75 0.56 Allowed 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 123.187 2.592 . . . . 0.0 113.557 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 37.0 mtp180 -92.64 129.6 39.85 Favored Pre-proline 0 N--CA 1.485 1.284 0 C-N-CA 123.301 0.64 . . . . 0.0 110.754 176.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -65.79 -23.19 55.83 Favored 'Trans proline' 0 C--N 1.382 2.29 0 C-N-CA 122.951 2.434 . . . . 0.0 113.351 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -64.64 -33.02 74.96 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.595 1.158 . . . . 0.0 112.133 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -117.08 -17.48 10.3 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.673 0.789 . . . . 0.0 112.16 -176.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 66.62 -67.1 0.16 Allowed 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 125.432 1.493 . . . . 0.0 111.119 -167.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -74.38 122.5 87.66 Favored Pre-proline 0 CA--C 1.563 1.452 0 C-N-CA 124.114 0.966 . . . . 0.0 111.098 178.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -86.53 -152.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.375 1.973 0 C-N-CA 123.197 2.598 . . . . 0.0 112.877 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -80.4 -162.76 27.4 Favored Glycine 0 CA--C 1.537 1.459 0 CA-C-N 116.768 -0.196 . . . . 0.0 113.435 174.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -67.45 138.91 56.98 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.639 0.776 . . . . 0.0 112.299 -174.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -106.01 -179.92 4.08 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.371 1.068 . . . . 0.0 111.865 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -83.14 123.64 29.72 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.236 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 109.86 -10.46 32.14 Favored Glycine 0 N--CA 1.477 1.429 0 CA-C-N 116.743 -0.208 . . . . 0.0 113.521 -174.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -85.61 83.98 7.73 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.306 0.642 . . . . 0.0 111.211 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.448 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -85.04 86.28 7.4 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-O 121.236 0.541 . . . . 0.0 111.57 179.592 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.409 ' HA ' ' SG ' ' A' ' 42' ' ' CYS . 42.3 t90 179.32 122.62 0.05 Allowed 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.916 0.886 . . . . 0.0 109.449 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 84.9 m 57.9 25.81 12.56 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 124.138 0.975 . . . . 0.0 113.209 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.577 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.8 tm? -66.38 124.16 21.97 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.389 0.676 . . . . 0.0 109.423 175.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 59.0 m -61.39 105.68 0.54 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.309 0.644 . . . . 0.0 109.506 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.646 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -59.22 -23.63 62.47 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -169.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.9 m -63.77 -30.19 71.31 Favored 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 123.325 0.65 . . . . 0.0 112.347 175.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -57.3 -47.43 81.5 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 124.304 1.041 . . . . 0.0 110.291 171.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.72 ' HE1' HD23 ' A' ' 115' ' ' LEU . 13.5 t-105 -71.74 -41.26 68.68 Favored 'General case' 0 CA--C 1.565 1.532 0 CA-C-N 114.325 -1.307 . . . . 0.0 111.964 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -63.4 -48.08 79.32 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.959 0.904 . . . . 0.0 111.114 -177.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.73 -28.59 67.77 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.348 0.659 . . . . 0.0 111.57 178.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.55 -41.06 96.57 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.208 0.603 . . . . 0.0 111.67 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.764 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 84.9 t80 -67.09 -48.36 68.41 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.977 176.291 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.28 -25.19 67.94 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.67 0.788 . . . . 0.0 112.354 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.55 -22.62 50.76 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.639 0.775 . . . . 0.0 111.78 175.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.92 -4.74 42.12 Favored Glycine 0 C--N 1.351 1.402 0 N-CA-C 114.259 0.464 . . . . 0.0 114.259 176.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' MET . . . . . 0.443 ' N ' ' SD ' ' A' ' 93' ' ' MET . 1.5 mpt? -84.57 -73.62 0.42 Allowed 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 117.314 0.557 . . . . 0.0 109.963 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.764 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 58.07 95.17 0.05 OUTLIER Pre-proline 0 CA--C 1.565 1.541 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 178.034 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -55.62 161.58 7.6 Favored 'Trans proline' 0 CA--C 1.564 1.981 0 C-N-CA 123.748 2.965 . . . . 0.0 114.972 169.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.01 117.42 5.09 Favored 'Trans proline' 0 C--N 1.372 1.795 0 C-N-CA 122.332 2.021 . . . . 0.0 111.759 169.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.491 HG11 ' HA ' ' A' ' 115' ' ' LEU . 14.2 p -99.68 159.71 3.54 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 123.691 0.796 . . . . 0.0 110.609 -177.563 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 m -92.67 99.98 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 124.215 1.006 . . . . 0.0 112.346 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.608 HD11 ' HG2' ' A' ' 116' ' ' GLN . 4.7 mt -74.23 -16.81 60.95 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.305 -0.872 . . . . 0.0 111.717 170.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -74.42 -12.31 60.47 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 123.817 0.847 . . . . 0.0 112.205 174.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.9 t -128.37 -40.53 1.61 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.016 0.526 . . . . 0.0 112.079 -175.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 55.0 p -55.34 99.3 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 CA-C-O 121.172 0.51 . . . . 0.0 111.838 171.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.544 ' HG3' ' H ' ' A' ' 105' ' ' SER . 12.7 tp10 -66.17 154.6 39.3 Favored 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 123.937 0.895 . . . . 0.0 110.781 172.163 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -56.54 -23.27 38.82 Favored 'General case' 0 CA--C 1.565 1.525 0 C-N-CA 124.237 1.015 . . . . 0.0 112.055 177.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.544 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 25.1 m -58.2 -27.66 64.1 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.99 0.916 . . . . 0.0 112.649 176.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.492 ' HA ' HG22 ' A' ' 41' ' ' VAL . . . -61.78 -23.43 66.18 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.229 1.012 . . . . 0.0 113.045 178.064 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.411 HD21 ' HB2' ' A' ' 112' ' ' LEU . 9.6 mp -67.37 -3.7 8.97 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -178.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -70.88 -33.38 70.54 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 122.059 -0.401 . . . . 0.0 111.533 167.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.574 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 49.5 m-85 -112.43 -23.43 10.32 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.054 0.942 . . . . 0.0 111.582 -171.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.496 ' HB ' ' HB1' ' A' ' 82' ' ' ALA . 4.9 p -129.69 -178.43 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.456 0 C-N-CA 123.832 0.853 . . . . 0.0 109.613 177.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' SER . . . . . 0.472 ' H ' HG22 ' A' ' 110' ' ' VAL . 27.2 p -109.89 164.2 12.81 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.494 -0.754 . . . . 0.0 110.739 170.051 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.411 ' HB2' HD21 ' A' ' 107' ' ' LEU . 4.6 tt -66.02 -39.45 90.23 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.433 0.693 . . . . 0.0 111.075 171.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.5 -33.83 74.46 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.437 0.695 . . . . 0.0 112.282 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.93 -50.22 73.27 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.269 0.628 . . . . 0.0 111.074 169.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.72 HD23 ' HE1' ' A' ' 85' ' ' TRP . 20.2 mt -65.8 -48.77 70.62 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.077 -172.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.608 ' HG2' HD11 ' A' ' 99' ' ' LEU . 7.0 mt-30 -71.49 -26.81 62.84 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.1 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -61.35 -35.76 78.32 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 173.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -126.47 27.71 6.1 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.338 0.655 . . . . 0.0 112.215 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -166.09 172.19 11.61 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.157 0.983 . . . . 0.0 110.643 172.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.1 pp -117.48 142.82 31.0 Favored Pre-proline 0 N--CA 1.484 1.272 0 C-N-CA 123.081 0.553 . . . . 0.0 110.515 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.501 ' HB2' HD13 ' A' ' 123' ' ' LEU . 51.6 Cg_endo -66.4 129.93 22.6 Favored 'Trans proline' 0 C--N 1.376 1.997 0 C-N-CA 122.293 1.995 . . . . 0.0 111.803 177.116 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.5 p -85.93 53.58 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.642 0 CA-C-O 123.478 1.609 . . . . 0.0 111.807 -173.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.501 HD13 ' HB2' ' A' ' 121' ' ' PRO . 10.3 mp -90.1 82.63 6.06 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.05 173.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.21 34.68 4.73 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.839 0.856 . . . . 0.0 112.007 -174.62 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -132.08 90.34 2.8 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 121.719 0.771 . . . . 0.0 111.346 -177.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -91.85 -175.96 4.29 Favored 'General case' 0 CA--C 1.576 1.944 0 C-N-CA 124.141 0.976 . . . . 0.0 110.327 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 27.7 m80 66.53 41.82 3.02 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 124.712 1.205 . . . . 0.0 112.188 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 -132.25 96.46 3.88 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.728 0.811 . . . . 0.0 110.345 173.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 21.1 p-80 -77.28 90.81 3.75 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 170.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 66.4 m80 . . . . . 0 CA--C 1.569 1.678 0 C-N-CA 124.322 1.049 . . . . 0.0 110.872 -171.237 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.402 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 110.858 -0.053 . . . . 0.0 110.858 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.87 118.44 7.55 Favored Glycine 0 CA--C 1.534 1.253 0 N-CA-C 112.146 -0.382 . . . . 0.0 112.146 174.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -96.13 130.9 43.05 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.57 0.748 . . . . 0.0 111.868 -175.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -118.76 -165.25 13.17 Favored Glycine 0 N--CA 1.477 1.391 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.285 173.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -160.17 138.64 10.3 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.861 0.464 . . . . 0.0 111.777 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -81.25 148.97 29.21 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.972 0.509 . . . . 0.0 110.658 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 m -65.89 -18.82 24.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 C-N-CA 123.726 0.81 . . . . 0.0 112.147 -177.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 78.7 mt -73.1 -49.45 28.39 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.759 1.224 . . . . 0.0 112.429 -166.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 175.4 -96.97 0.11 Allowed Glycine 0 N--CA 1.475 1.253 0 CA-C-N 116.836 -0.165 . . . . 0.0 113.039 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.79 143.75 50.96 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.585 0.754 . . . . 0.0 111.735 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -165.29 49.4 0.1 Allowed 'General case' 0 CA--C 1.558 1.278 0 CA-C-O 122.38 1.086 . . . . 0.0 108.515 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.64 ' H ' HD23 ' A' ' 12' ' ' LEU . 2.1 pt? -90.34 32.16 0.96 Allowed 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.59 -171.22 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -79.72 69.37 6.02 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-O 121.708 0.766 . . . . 0.0 110.396 174.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.468 HG23 ' HD2' ' A' ' 28' ' ' PHE . 6.7 p -158.09 120.76 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 124.181 0.992 . . . . 0.0 110.247 -177.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.673 ' H ' ' HB2' ' A' ' 28' ' ' PHE . 61.9 m -67.83 -59.63 3.15 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.388 0.675 . . . . 0.0 110.933 175.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.5 t 61.46 -173.18 0.14 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.39 1.076 . . . . 0.0 112.344 176.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.8 t 71.66 -67.62 0.25 Allowed 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 125.391 1.476 . . . . 0.0 113.973 170.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.61 138.82 76.42 Favored Pre-proline 0 CA--C 1.564 1.507 0 C-N-CA 123.964 0.906 . . . . 0.0 112.764 -178.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.12 -35.24 76.6 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 122.974 2.449 . . . . 0.0 113.875 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 23.6 ttt -73.35 -12.02 60.68 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 122.98 0.512 . . . . 0.0 111.861 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.0 m -63.25 -22.36 66.82 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.035 0.534 . . . . 0.0 111.241 174.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.69 -84.22 1.23 Allowed Glycine 0 C--N 1.352 1.422 0 CA-C-O 119.986 -0.341 . . . . 0.0 112.672 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 36.9 t90 -172.49 -71.73 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.682 0.793 . . . . 0.0 110.664 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -160.82 99.28 1.24 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.976 0.91 . . . . 0.0 108.884 -176.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -91.66 -70.02 0.71 Allowed 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.349 0.66 . . . . 0.0 110.36 -176.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -162.7 44.24 0.13 Allowed 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.479 0.712 . . . . 0.0 109.182 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 70.35 102.11 0.04 OUTLIER Glycine 0 C--N 1.354 1.557 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.81 -173.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.673 ' HB2' ' H ' ' A' ' 15' ' ' CYS . 46.3 m-85 -75.9 81.8 2.8 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.155 0.582 . . . . 0.0 111.226 -172.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 60.2 m -63.92 -71.93 0.16 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 122.614 0.365 . . . . 0.0 110.217 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 72.09 -39.8 0.46 Allowed 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 125.426 1.49 . . . . 0.0 114.438 171.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.669 ' HA ' HG21 ' A' ' 40' ' ' THR . 5.7 t -61.6 104.57 0.44 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.334 1.054 . . . . 0.0 112.658 -176.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.405 ' HB3' ' O ' ' A' ' 35' ' ' ASP . 13.9 m-20 -63.65 -31.44 72.61 Favored 'General case' 0 N--CA 1.478 0.925 0 CA-C-N 115.203 -0.908 . . . . 0.0 112.52 177.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 57.3 t 65.75 -70.13 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.386 0 C-N-CA 125.364 1.466 . . . . 0.0 110.88 -173.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -146.76 -2.64 0.63 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.405 ' O ' ' HB3' ' A' ' 32' ' ' ASP . 27.8 m-20 -109.63 160.93 15.86 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -174.108 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 53.81 -87.76 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 125.306 1.442 . . . . 0.0 113.42 178.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.651 ' HA3' ' HD3' ' A' ' 108' ' ' ARG . . . 112.33 92.22 2.03 Favored Glycine 0 C--N 1.351 1.38 0 N-CA-C 110.686 -0.965 . . . . 0.0 110.686 -165.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.8 t -118.72 -60.72 1.74 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.878 0.871 . . . . 0.0 111.929 -170.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.1 t60 -170.46 60.25 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 120.832 0.348 . . . . 0.0 111.684 -176.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.669 HG21 ' HA ' ' A' ' 31' ' ' THR . 26.1 p -140.48 103.07 4.47 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.261 -0.899 . . . . 0.0 111.778 177.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.6 t -136.8 107.45 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 C-N-CA 124.659 1.184 . . . . 0.0 109.102 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 93.5 m -113.28 110.72 20.84 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.702 -0.624 . . . . 0.0 111.271 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.54 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -139.12 149.9 45.04 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.934 1.294 . . . . 0.0 108.392 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.591 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 22.1 tt0 -121.53 114.88 21.84 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.139 0.495 . . . . 0.0 111.447 -178.297 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.433 ' HB2' HD11 ' A' ' 50' ' ' LEU . 72.2 mmm -89.0 142.82 27.31 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.216 1.006 . . . . 0.0 111.205 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 51.9 p -86.58 151.3 23.57 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.059 0.544 . . . . 0.0 109.641 178.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -54.87 -33.49 61.93 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 123.218 0.607 . . . . 0.0 112.465 -174.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -49.12 -46.95 45.71 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 125.231 1.412 . . . . 0.0 111.911 174.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -77.89 -33.99 51.7 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.433 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.2 mp -71.25 -31.79 67.95 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 120.869 0.366 . . . . 0.0 110.448 174.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 48.7 mt -75.54 -29.9 59.56 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.028 0.931 . . . . 0.0 111.52 174.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -65.03 -49.28 70.77 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.3 t -57.6 -42.9 84.14 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.563 0.745 . . . . 0.0 110.805 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -60.75 -46.67 89.54 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.063 0.945 . . . . 0.0 111.349 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -68.94 -32.67 72.45 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.553 0.741 . . . . 0.0 111.71 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -64.06 -34.01 77.05 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.726 0.81 . . . . 0.0 111.295 -177.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 150.61 51.81 0.02 OUTLIER Glycine 0 N--CA 1.478 1.493 0 CA-C-N 116.343 -0.39 . . . . 0.0 112.676 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -154.37 169.28 24.08 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.403 0.681 . . . . 0.0 110.402 -173.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -162.42 142.95 9.99 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.878 0.471 . . . . 0.0 110.629 171.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.2 tp -175.98 -54.99 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.506 1.122 . . . . 0.0 109.812 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 8.1 tmm? -76.7 91.71 3.48 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.913 -177.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.7 p -135.69 137.4 25.6 Favored Pre-proline 0 N--CA 1.487 1.394 0 C-N-CA 124.32 1.048 . . . . 0.0 110.488 178.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -71.02 92.08 0.64 Allowed 'Trans proline' 0 C--N 1.381 2.261 0 C-N-CA 122.809 2.339 . . . . 0.0 112.56 175.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -117.07 87.91 24.74 Favored Pre-proline 0 N--CA 1.482 1.164 0 C-N-CA 124.105 0.962 . . . . 0.0 109.78 176.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -68.06 -27.42 35.97 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.725 2.283 . . . . 0.0 114.073 -172.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -70.31 -34.76 73.09 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.181 0.592 . . . . 0.0 111.69 -177.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -107.01 -56.41 2.2 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.395 0.678 . . . . 0.0 111.006 -177.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 60.1 84.53 0.12 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.909 1.284 . . . . 0.0 111.998 174.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -92.25 114.25 61.66 Favored Pre-proline 0 N--CA 1.482 1.16 0 C-N-CA 122.931 0.492 . . . . 0.0 111.201 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.54 81.96 2.61 Favored 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 122.795 2.33 . . . . 0.0 112.939 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -106.8 30.38 9.51 Favored Glycine 0 N--CA 1.481 1.661 0 CA-C-N 116.085 -0.507 . . . . 0.0 113.16 176.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.8 tt 60.67 104.56 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 125.176 1.39 . . . . 0.0 110.91 -174.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.0 ptpp? -112.83 -171.84 1.94 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 122.972 0.509 . . . . 0.0 110.835 -177.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.39 116.34 3.87 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.345 0.658 . . . . 0.0 111.558 176.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.49 22.31 14.73 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 114.164 0.425 . . . . 0.0 114.164 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -114.45 96.22 5.65 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.199 0.599 . . . . 0.0 110.129 169.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.591 ' HB2' ' HB2' ' A' ' 44' ' ' GLU . 56.2 ttp180 -92.26 85.8 5.54 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 174.191 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 6.7 m-90 -167.4 119.48 0.91 Allowed 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 124.195 0.998 . . . . 0.0 109.071 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 31.1 p 44.93 33.76 1.08 Allowed 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.651 1.18 . . . . 0.0 113.143 175.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.54 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.0 tm? -63.28 118.08 7.51 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.161 0.984 . . . . 0.0 110.117 -176.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 41.4 t -53.1 119.22 4.45 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.593 0.757 . . . . 0.0 110.552 175.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.66 -31.59 26.17 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.834 0.853 . . . . 0.0 112.848 -174.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 73.1 m -57.27 -36.89 71.57 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 176.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.436 ' HG2' HD21 ' A' ' 80' ' ' LEU . 11.3 tpp180 -59.83 -53.35 58.94 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.194 0.597 . . . . 0.0 111.83 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.533 ' CD1' HG21 ' A' ' 110' ' ' VAL . 2.8 t-105 -75.26 -51.51 13.11 Favored 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 123.597 0.759 . . . . 0.0 111.007 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.588 ' HB2' HG23 ' A' ' 110' ' ' VAL . 47.0 tp60 -61.65 -42.25 98.64 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.603 0.761 . . . . 0.0 112.928 -172.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -69.86 -30.37 67.82 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 117.706 0.23 . . . . 0.0 111.594 -178.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.99 -34.85 78.41 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 122.92 0.488 . . . . 0.0 110.755 170.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.608 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 80.6 t80 -72.55 -43.49 63.39 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.998 0.919 . . . . 0.0 111.462 176.17 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 86' ' ' GLN . 49.8 mt-10 -66.52 -38.27 86.84 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.858 0.863 . . . . 0.0 111.404 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.13 -20.41 62.32 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.751 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 122.94 -20.87 7.57 Favored Glycine 0 C--N 1.357 1.738 0 N-CA-C 115.179 0.831 . . . . 0.0 115.179 170.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -81.76 -79.97 0.16 Allowed 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 117.721 0.761 . . . . 0.0 111.751 -171.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.608 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 65.91 124.51 0.03 OUTLIER Pre-proline 0 N--CA 1.499 1.999 0 C-N-CA 125.022 1.329 . . . . 0.0 114.409 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -77.39 172.08 16.55 Favored 'Trans proline' 0 CA--C 1.567 2.14 0 C-N-CA 122.959 2.439 . . . . 0.0 113.011 172.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.35 108.27 2.16 Favored 'Trans proline' 0 CA--C 1.565 2.058 0 C-N-CA 122.106 1.87 . . . . 0.0 112.324 169.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.6 p -96.65 151.14 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 123.576 0.75 . . . . 0.0 110.633 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.6 HG21 ' HB3' ' A' ' 101' ' ' SER . 19.2 m -75.84 162.75 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 CA-C-O 121.559 0.695 . . . . 0.0 111.637 173.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 96.3 mt -118.9 -9.42 10.1 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.782 0.833 . . . . 0.0 110.631 168.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -87.15 -47.57 8.77 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.95 0.9 . . . . 0.0 110.341 -171.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.6 ' HB3' HG21 ' A' ' 98' ' ' VAL . 42.3 t -85.71 -32.48 21.9 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.969 179.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 19.4 m -59.61 114.6 2.81 Favored 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 122.657 0.383 . . . . 0.0 111.64 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -79.34 168.24 19.78 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.552 0.741 . . . . 0.0 112.864 -173.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -67.96 -25.23 65.34 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.998 0.919 . . . . 0.0 112.146 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 43.7 t -62.4 -32.98 73.89 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 122.664 0.386 . . . . 0.0 111.633 177.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.16 -34.89 70.79 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.707 0.803 . . . . 0.0 112.057 174.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.6 ' HG ' ' HB2' ' A' ' 112' ' ' LEU . 6.9 mp -64.57 -10.26 24.9 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.937 0.895 . . . . 0.0 113.388 -175.384 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.651 ' HD3' ' HA3' ' A' ' 37' ' ' GLY . 65.0 mtp85 -94.78 -28.5 15.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.494 0.717 . . . . 0.0 111.927 173.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -96.47 -53.81 3.47 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.145 0.578 . . . . 0.0 111.148 -173.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.588 HG23 ' HB2' ' A' ' 86' ' ' GLN . 14.0 p -100.13 -24.06 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 C-N-CA 123.91 0.884 . . . . 0.0 111.567 -178.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 43.4 t 69.53 147.32 0.06 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.102 1.361 . . . . 0.0 112.636 -173.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.6 ' HB2' ' HG ' ' A' ' 107' ' ' LEU . 5.8 tt -61.23 -40.78 95.28 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.168 178.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.17 -38.81 84.33 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.138 0.575 . . . . 0.0 112.127 -172.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -69.12 -33.19 73.07 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.524 0.729 . . . . 0.0 111.036 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.516 HD23 ' HE1' ' A' ' 85' ' ' TRP . 39.9 mt -66.03 -55.82 14.72 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 121.95 0.881 . . . . 0.0 109.916 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.661 ' HB3' ' HA ' ' A' ' 122' ' ' VAL . 13.0 mt-30 -68.55 -24.77 64.67 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 113.896 -1.502 . . . . 0.0 113.146 -173.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.53 -23.36 64.52 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 113.151 0.796 . . . . 0.0 113.151 175.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 11.1 m80 -116.53 -16.56 10.77 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 123.303 0.641 . . . . 0.0 112.57 174.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.03 167.82 18.45 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.659 0.384 . . . . 0.0 110.419 170.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.527 ' HB3' ' HD3' ' A' ' 121' ' ' PRO . 0.2 OUTLIER -67.83 -60.81 4.92 Favored Pre-proline 0 CA--C 1.584 2.286 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -174.223 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.527 ' HD3' ' HB3' ' A' ' 120' ' ' LEU . 40.9 Cg_endo -86.34 86.36 0.9 Allowed 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 122.952 2.435 . . . . 0.0 113.796 -173.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' VAL . . . . . 0.661 ' HA ' ' HB3' ' A' ' 116' ' ' GLN . 6.5 p -79.92 136.3 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.223 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.792 174.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tt -140.29 136.85 33.69 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.891 0.876 . . . . 0.0 109.551 -173.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -76.97 138.89 39.92 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.056 0.942 . . . . 0.0 112.724 -175.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 22.4 m-70 -129.29 179.41 5.8 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.596 1.158 . . . . 0.0 110.681 175.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -105.47 -166.28 1.2 Allowed 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.955 0.902 . . . . 0.0 111.641 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -67.53 135.72 53.44 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.661 0.784 . . . . 0.0 111.959 -175.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 28.0 p80 -128.82 141.89 51.15 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.836 0.854 . . . . 0.0 110.235 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -169.15 166.11 10.89 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.715 0.806 . . . . 0.0 110.263 -176.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 51.0 t-80 . . . . . 0 N--CA 1.489 1.486 0 C-N-CA 125.089 1.356 . . . . 0.0 111.401 173.144 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.1 mtm . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 120.444 0.164 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.96 -161.92 44.2 Favored Glycine 0 C--N 1.351 1.385 0 CA-C-N 116.432 -0.349 . . . . 0.0 113.557 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -168.69 -179.47 3.81 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.587 0.755 . . . . 0.0 110.95 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -125.56 -155.32 8.98 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.295 172.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -89.11 129.14 35.77 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.507 0.723 . . . . 0.0 109.872 177.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -120.77 -173.07 2.51 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.273 0.629 . . . . 0.0 111.309 -175.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 16.9 t -92.13 35.82 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.802 0 C-N-CA 124.461 1.105 . . . . 0.0 111.36 -170.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -80.2 -14.1 58.71 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 121.393 -0.817 . . . . 0.0 112.819 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.14 70.13 0.46 Allowed Glycine 0 N--CA 1.482 1.71 0 N-CA-C 114.375 0.51 . . . . 0.0 114.375 -171.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -144.88 -168.3 2.89 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.744 0.817 . . . . 0.0 110.713 179.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 t70 70.15 -176.67 0.2 Allowed 'General case' 0 CA--C 1.564 1.504 0 C-N-CA 124.886 1.275 . . . . 0.0 112.073 170.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 89.0 mt -64.1 126.04 26.44 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.748 0.819 . . . . 0.0 112.219 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.9 -153.96 0.41 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 124.198 0.999 . . . . 0.0 110.053 176.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.486 HG13 ' HB ' ' A' ' 21' ' ' THR . 6.4 p -87.74 129.01 39.76 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.416 0 O-C-N 121.88 -0.513 . . . . 0.0 110.566 167.696 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 48.2 t -123.22 10.06 9.28 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.379 0.672 . . . . 0.0 110.953 170.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.607 ' HB2' ' HA ' ' A' ' 28' ' ' PHE . 42.0 t -69.71 140.07 53.47 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.13 0.572 . . . . 0.0 111.358 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.4 m 62.2 53.54 2.87 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.307 1.043 . . . . 0.0 110.759 -175.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 72.32 159.73 0.16 Allowed Pre-proline 0 N--CA 1.49 1.534 0 C-N-CA 125.41 1.484 . . . . 0.0 113.101 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -49.69 -7.11 0.08 OUTLIER 'Trans proline' 0 C--N 1.382 2.317 0 C-N-CA 123.8 3.0 . . . . 0.0 116.369 167.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 33.6 ttm -74.33 65.41 1.21 Allowed 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 123.886 0.874 . . . . 0.0 110.635 174.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.486 ' HB ' HG13 ' A' ' 14' ' ' VAL . 45.3 p -135.1 155.65 50.36 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.228 1.011 . . . . 0.0 111.224 -173.322 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -94.02 -104.71 1.8 Allowed Glycine 0 CA--C 1.526 0.739 0 N-CA-C 111.454 -0.658 . . . . 0.0 111.454 172.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 74.4 t90 -153.17 110.1 3.45 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.135 0.574 . . . . 0.0 109.561 177.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -132.78 146.66 52.03 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.924 0.889 . . . . 0.0 110.638 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 -74.83 120.96 21.09 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.504 0.722 . . . . 0.0 110.642 177.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 65.58 -2.52 0.83 Allowed 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 124.329 1.052 . . . . 0.0 113.738 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.83 -22.92 28.34 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 115.522 0.969 . . . . 0.0 115.522 -170.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.607 ' HA ' ' HB2' ' A' ' 16' ' ' CYS . 85.0 t80 -71.86 -51.99 19.62 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.47 0.708 . . . . 0.0 111.445 173.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 69.9 m -95.31 -174.0 3.08 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 123.783 0.833 . . . . 0.0 112.088 -179.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -130.11 126.22 37.03 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.02 0.928 . . . . 0.0 109.575 170.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 50.2 m -86.09 98.0 10.62 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 121.45 0.643 . . . . 0.0 110.004 176.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -94.59 29.4 2.3 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.591 0.756 . . . . 0.0 111.927 -179.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t 63.12 -76.63 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 C-N-CA 124.574 1.15 . . . . 0.0 111.116 -173.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -150.42 -3.34 0.36 Allowed 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 124.226 1.01 . . . . 0.0 111.206 177.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -70.96 -30.93 67.36 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.545 1.138 . . . . 0.0 112.733 -173.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 61.99 98.86 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 124.658 1.183 . . . . 0.0 111.777 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.57 68.23 1.49 Allowed Glycine 0 N--CA 1.473 1.103 0 CA-C-N 116.526 -0.306 . . . . 0.0 112.663 -175.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.8 t -135.09 -167.35 1.98 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.972 0.909 . . . . 0.0 109.833 -176.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 28.9 p-80 -142.78 125.69 16.16 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 121.932 -0.48 . . . . 0.0 110.894 177.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.497 HG23 ' HG2' ' A' ' 103' ' ' GLU . 3.5 t -140.2 135.21 32.16 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.396 1.078 . . . . 0.0 109.452 174.48 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.758 HG21 ' HB2' ' A' ' 82' ' ' ALA . 40.1 t -120.89 111.27 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 123.189 0.596 . . . . 0.0 110.329 -175.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 82.5 m -105.97 107.54 18.6 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.58 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.6 151.31 41.38 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.911 0.884 . . . . 0.0 109.272 -176.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -126.95 115.3 19.05 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 122.458 0.303 . . . . 0.0 110.244 -173.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 63.9 mmm -98.91 152.77 19.4 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.217 0.607 . . . . 0.0 111.671 -174.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.679 HG22 ' HB3' ' A' ' 95' ' ' PRO . 6.8 t -89.11 157.48 18.29 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.468 0.707 . . . . 0.0 110.635 175.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 61.2 tt0 -53.57 -32.18 49.8 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.897 0.879 . . . . 0.0 112.419 -177.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -51.4 -44.88 62.32 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.143 0.977 . . . . 0.0 111.456 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -74.31 -47.42 34.77 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 177.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.419 ' HG ' ' HA ' ' A' ' 73' ' ' LYS . 2.4 mm? -65.28 -32.88 74.76 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.294 0.497 . . . . 0.0 111.543 -174.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.6 mt -76.63 -31.85 57.65 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.118 0.567 . . . . 0.0 112.139 173.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -57.62 -48.77 78.53 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 123.053 0.541 . . . . 0.0 110.666 171.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 37.4 t -69.73 -43.64 71.92 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.601 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -74.38 -33.54 63.08 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -173.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -63.86 -33.32 75.42 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.994 0.518 . . . . 0.0 111.488 -178.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -157.69 90.4 1.08 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.58 0.752 . . . . 0.0 109.411 177.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 148.15 -101.49 0.23 Allowed Glycine 0 N--CA 1.479 1.539 0 CA-C-N 116.579 -0.282 . . . . 0.0 113.711 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -113.67 125.9 54.65 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.88 0.872 . . . . 0.0 110.765 -174.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -59.81 -66.21 0.55 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 122.935 0.494 . . . . 0.0 111.7 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.564 HD11 ' HD3' ' A' ' 84' ' ' ARG . 69.0 mt 72.47 -48.36 0.68 Allowed 'General case' 0 N--CA 1.5 2.062 0 C-N-CA 125.783 1.633 . . . . 0.0 114.474 175.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 82.6 mtp -56.24 -66.59 0.41 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.742 1.217 . . . . 0.0 113.448 -161.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.1 m -146.92 90.13 5.5 Favored Pre-proline 0 N--CA 1.482 1.171 0 C-N-CA 122.668 0.387 . . . . 0.0 110.96 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -85.71 -174.52 1.62 Allowed 'Trans proline' 0 CA--C 1.556 1.587 0 C-N-CA 123.208 2.605 . . . . 0.0 111.466 163.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.47 ' HD2' ' HA ' ' A' ' 67' ' ' PHE . 12.7 ttp180 -158.14 107.26 1.72 Allowed Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 122.226 0.21 . . . . 0.0 111.185 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -78.09 -37.32 0.83 Allowed 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 122.706 2.271 . . . . 0.0 113.064 175.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -129.46 -77.55 0.55 Allowed 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.837 0.855 . . . . 0.0 109.505 -176.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.47 ' HA ' ' HD2' ' A' ' 64' ' ' ARG . 79.2 t80 -156.66 -70.46 0.1 Allowed 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.521 0.728 . . . . 0.0 110.016 175.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -86.19 76.96 9.66 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.111 0.565 . . . . 0.0 110.898 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -171.88 106.29 0.37 Allowed Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 123.747 0.819 . . . . 0.0 110.096 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -91.36 -160.22 0.09 OUTLIER 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 123.098 2.532 . . . . 0.0 112.447 171.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -117.4 -103.09 2.23 Favored Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.244 -0.342 . . . . 0.0 112.244 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -159.35 118.49 2.93 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.833 0.853 . . . . 0.0 110.245 -176.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.419 ' HA ' ' HG ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -130.0 -161.35 1.11 Allowed 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.078 0.551 . . . . 0.0 111.06 -176.165 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.56 118.24 6.78 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.643 0.777 . . . . 0.0 113.036 -174.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 79.23 35.99 28.6 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-N 115.085 -0.961 . . . . 0.0 113.347 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -118.31 98.9 6.52 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.506 0.723 . . . . 0.0 111.216 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -76.74 87.39 3.36 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 166.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -175.39 127.17 0.26 Allowed 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.944 -173.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 39.4 t 59.12 16.09 4.56 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.859 1.264 . . . . 0.0 113.776 171.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.58 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -75.05 108.83 8.04 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -175.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 62.2 m -65.1 135.31 55.37 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.449 0.7 . . . . 0.0 111.14 178.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.758 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -51.32 -49.37 61.48 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.187 0.995 . . . . 0.0 113.31 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.6 m -57.3 -29.52 63.98 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.931 0.892 . . . . 0.0 112.943 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.564 ' HD3' HD11 ' A' ' 60' ' ' LEU . 0.8 OUTLIER -70.06 -51.55 31.03 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.431 0.692 . . . . 0.0 110.767 -177.174 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 3.8 t-105 -62.93 -41.32 99.45 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 123.665 0.786 . . . . 0.0 110.802 172.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -58.52 -41.77 86.18 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.374 1.069 . . . . 0.0 111.997 -176.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -62.43 -37.33 85.43 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.722 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.7 -39.01 89.94 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.285 0.634 . . . . 0.0 111.65 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.565 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 75.4 t80 -68.23 -51.82 41.05 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.1 0.56 . . . . 0.0 111.23 175.005 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.86 -19.15 65.68 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.438 0.695 . . . . 0.0 112.42 -174.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.85 -26.97 21.35 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 123.153 0.581 . . . . 0.0 111.529 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 129.18 -21.76 5.15 Favored Glycine 0 N--CA 1.482 1.751 0 N-CA-C 115.697 1.039 . . . . 0.0 115.697 171.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -72.42 -67.89 0.51 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 118.17 0.985 . . . . 0.0 111.456 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.565 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 54.87 81.07 0.27 Allowed Pre-proline 0 CA--C 1.564 1.496 0 C-N-CA 124.641 1.176 . . . . 0.0 113.139 -177.508 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.679 ' HB3' HG22 ' A' ' 46' ' ' THR . 93.9 Cg_exo -53.4 163.95 2.26 Favored 'Trans proline' 0 N--CA 1.504 2.105 0 C-N-CA 124.352 3.368 . . . . 0.0 115.804 173.418 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -63.86 103.53 0.42 Allowed 'Trans proline' 0 C--N 1.384 2.429 0 C-N-CA 122.927 2.418 . . . . 0.0 112.667 174.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.6 p -94.26 138.01 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 123.299 0.64 . . . . 0.0 109.949 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 7.5 p -79.13 89.11 1.3 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-O 121.852 0.834 . . . . 0.0 112.862 -171.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.461 HD21 ' HB3' ' A' ' 115' ' ' LEU . 2.8 mm? -60.65 -34.37 74.2 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 124.628 1.171 . . . . 0.0 113.544 -177.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -71.33 -12.24 61.33 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 179.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 50.4 m -128.54 -7.11 5.18 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.248 0.619 . . . . 0.0 112.576 -176.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 99.5 m -72.62 120.96 18.97 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 122.552 0.341 . . . . 0.0 110.156 175.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.592 ' HG3' ' H ' ' A' ' 105' ' ' SER . 13.8 tp10 -64.55 149.71 48.21 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 123.131 0.572 . . . . 0.0 111.587 178.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -68.0 -34.18 76.02 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.369 0.667 . . . . 0.0 110.865 177.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.592 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 84.9 p -61.96 -23.86 66.64 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 122.902 0.481 . . . . 0.0 111.987 175.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.02 -36.06 74.33 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.044 0.538 . . . . 0.0 112.356 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.1 mp -55.73 -13.7 1.85 Allowed 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 124.978 1.311 . . . . 0.0 113.431 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -61.95 -34.48 76.2 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.422 1.089 . . . . 0.0 112.376 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -109.76 -21.82 12.21 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.578 1.151 . . . . 0.0 110.247 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.461 HG11 HD21 ' A' ' 115' ' ' LEU . 48.7 t -109.67 -51.67 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 CA-C-N 114.048 -1.433 . . . . 0.0 112.715 -159.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 26.6 m 71.26 140.86 0.05 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 125.746 1.618 . . . . 0.0 112.79 -168.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.42 -39.8 92.1 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.274 1.03 . . . . 0.0 113.372 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.6 -32.5 70.45 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.86 0.464 . . . . 0.0 111.73 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.89 -36.95 85.01 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 124.382 1.073 . . . . 0.0 111.185 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.461 ' HB3' HD21 ' A' ' 99' ' ' LEU . 71.5 mt -75.0 -51.58 13.24 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.637 1.175 . . . . 0.0 110.874 -177.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -70.78 -23.06 62.33 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 114.4 -1.273 . . . . 0.0 112.321 -175.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -50.07 -28.68 7.5 Favored 'General case' 0 CA--C 1.562 1.412 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 171.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -128.73 22.63 5.85 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.507 0.723 . . . . 0.0 112.261 175.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -144.23 -164.37 1.88 Allowed 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.239 0.615 . . . . 0.0 110.577 174.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.457 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 4.3 mm? -72.07 134.18 83.28 Favored Pre-proline 0 CA--C 1.56 1.331 0 O-C-N 122.136 -0.352 . . . . 0.0 111.64 177.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 120' ' ' LEU . 36.8 Cg_endo -88.6 164.69 6.42 Favored 'Trans proline' 0 C--N 1.375 1.922 0 C-N-CA 123.348 2.698 . . . . 0.0 113.81 -175.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 4.1 p -79.84 109.84 14.83 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 CA-C-O 121.896 0.855 . . . . 0.0 112.167 -175.112 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.0 tt -67.03 152.73 45.25 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.894 0.878 . . . . 0.0 108.817 168.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.89 142.14 51.11 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.441 -0.787 . . . . 0.0 111.357 178.375 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -101.42 -41.42 6.66 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.485 0.714 . . . . 0.0 111.269 175.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 66.1 m-70 -114.4 90.94 3.46 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 122.779 0.431 . . . . 0.0 111.186 177.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -80.48 -15.8 55.85 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 120.899 0.38 . . . . 0.0 110.54 172.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -110.83 167.71 10.03 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.148 0.979 . . . . 0.0 111.316 176.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -151.26 168.2 25.46 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.531 0.733 . . . . 0.0 111.836 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 . . . . . 0 N--CA 1.492 1.634 0 C-N-CA 123.622 0.769 . . . . 0.0 112.498 173.988 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.1 mtp . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 120.681 0.277 . . . . 0.0 111.563 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 66.13 46.66 78.58 Favored Glycine 0 C--N 1.353 1.504 0 CA-C-N 116.044 -0.525 . . . . 0.0 114.208 175.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.9 tp60 -123.26 98.97 6.11 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.597 0.759 . . . . 0.0 110.511 179.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.21 -174.69 42.14 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 115.97 -0.559 . . . . 0.0 113.028 174.463 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -90.38 140.48 29.67 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.101 0.56 . . . . 0.0 111.117 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -110.33 154.84 22.93 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.011 0.924 . . . . 0.0 110.16 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 m -66.45 -26.25 37.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-O 121.769 0.795 . . . . 0.0 110.804 177.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 80.3 mt -73.72 -19.35 60.83 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-N 114.28 -1.327 . . . . 0.0 112.02 -177.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.97 -14.14 80.43 Favored Glycine 0 CA--C 1.541 1.703 0 CA-C-N 115.553 -0.749 . . . . 0.0 114.47 177.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -153.04 127.44 9.26 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 117.661 0.73 . . . . 0.0 111.378 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -165.79 177.58 7.12 Favored 'General case' 0 CA--C 1.565 1.555 0 C-N-CA 123.649 0.779 . . . . 0.0 110.381 -177.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.7 mp -56.42 130.06 43.25 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 124.066 0.946 . . . . 0.0 111.945 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.99 -177.89 6.15 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.161 0.984 . . . . 0.0 111.753 -178.769 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.5 p -68.17 134.73 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.337 0 CA-C-O 121.327 0.584 . . . . 0.0 111.975 -179.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.542 ' SG ' ' HA3' ' A' ' 27' ' ' GLY . 78.0 m -84.75 -55.99 3.82 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.554 0.742 . . . . 0.0 110.333 176.295 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.548 ' H ' ' HB2' ' A' ' 28' ' ' PHE . 53.7 t 75.83 -43.34 0.48 Allowed 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 170.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 52.3 t -61.5 -42.92 99.53 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.556 0.742 . . . . 0.0 112.867 -173.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -108.88 138.69 20.4 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 123.106 0.562 . . . . 0.0 110.48 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.39 -53.19 2.54 Favored 'Trans proline' 0 C--N 1.381 2.238 0 C-N-CA 122.752 2.301 . . . . 0.0 112.661 174.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 57.0 mtt -83.22 88.43 6.92 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.44 0.696 . . . . 0.0 110.519 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 37.6 p -129.98 77.8 1.81 Allowed 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.758 0.823 . . . . 0.0 109.88 178.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.45 -42.4 3.15 Favored Glycine 0 CA--C 1.535 1.294 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.693 -176.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 15.0 t90 79.76 -42.85 0.26 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 125.894 1.678 . . . . 0.0 112.245 174.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -84.52 52.59 2.41 Favored 'General case' 0 CA--C 1.572 1.811 0 C-N-CA 124.436 1.094 . . . . 0.0 110.248 174.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HG3' ' SG ' ' A' ' 29' ' ' CYS . 9.3 ttp180 52.97 49.73 19.54 Favored 'General case' 0 CA--C 1.569 1.682 0 C-N-CA 125.502 1.521 . . . . 0.0 113.191 177.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -77.32 -47.94 18.69 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.205 0.526 . . . . 0.0 110.384 172.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.542 ' HA3' ' SG ' ' A' ' 15' ' ' CYS . . . -137.74 -71.52 0.05 OUTLIER Glycine 0 C--N 1.342 0.915 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.595 175.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.548 ' HB2' ' H ' ' A' ' 16' ' ' CYS . 87.9 t80 -101.71 137.16 40.39 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.599 0.76 . . . . 0.0 110.074 177.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.552 ' SG ' ' HG3' ' A' ' 25' ' ' ARG . 26.2 p -159.03 155.11 26.86 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.63 0.772 . . . . 0.0 110.713 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -84.93 71.16 10.94 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.949 0.5 . . . . 0.0 110.455 177.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.462 HG23 ' H ' ' A' ' 32' ' ' ASP . 4.8 t -174.85 -65.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.545 1.138 . . . . 0.0 110.014 174.126 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.462 ' H ' HG23 ' A' ' 31' ' ' THR . 1.9 m-20 -106.54 120.31 41.6 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.867 0.867 . . . . 0.0 110.007 -177.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 34.0 m -75.25 -37.7 39.74 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.148 0 C-N-CA 123.26 0.624 . . . . 0.0 111.237 177.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -179.07 -57.19 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.716 1.206 . . . . 0.0 109.702 -178.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -67.59 155.51 38.97 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.894 0.878 . . . . 0.0 111.725 177.078 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -59.22 121.91 12.54 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 124.089 0.956 . . . . 0.0 112.3 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -132.3 -93.41 0.56 Allowed Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 175.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 59.6 m 62.04 169.45 0.12 Allowed 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 125.124 1.37 . . . . 0.0 114.035 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.9 m80 58.82 32.22 22.01 Favored 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 124.064 0.945 . . . . 0.0 112.784 -179.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.415 ' O ' ' HB3' ' A' ' 105' ' ' SER . 65.8 p -98.99 116.13 30.51 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.883 1.273 . . . . 0.0 111.938 -176.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.538 HG11 ' HB2' ' A' ' 82' ' ' ALA . 46.5 t -137.89 117.96 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.746 -0.596 . . . . 0.0 111.126 176.07 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 57.8 m -116.74 108.22 15.62 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 168.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.637 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -137.69 148.23 45.52 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -176.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.5 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 28.0 tt0 -115.49 116.56 28.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.843 0.354 . . . . 0.0 111.77 -171.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 52.5 mmm -103.5 123.41 46.85 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.272 175.092 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 79.3 p -81.39 167.04 19.87 Favored 'General case' 0 C--O 1.246 0.895 0 C-N-CA 123.13 0.572 . . . . 0.0 110.549 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -58.03 -29.57 65.45 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.382 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -49.64 -56.13 11.17 Favored 'General case' 0 CA--C 1.567 1.622 0 C-N-CA 124.826 1.25 . . . . 0.0 112.377 177.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -70.55 -38.81 74.21 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 176.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.9 mp -66.34 -25.09 66.66 Favored 'General case' 0 CA--C 1.566 1.569 0 O-C-N 122.129 -0.357 . . . . 0.0 111.481 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 39.3 mt -75.13 -35.44 61.68 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.227 1.011 . . . . 0.0 110.555 172.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.449 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 89.6 t80 -60.64 -51.34 69.81 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.95 0.5 . . . . 0.0 110.286 171.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.9 m -58.99 -33.04 70.24 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 124.193 0.997 . . . . 0.0 111.646 177.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.7 ttt180 -61.82 -52.22 65.05 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.758 175.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -74.84 -13.04 60.52 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 5.2 mmp_? -77.46 -13.4 59.93 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 172.654 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 139.63 7.69 1.01 Allowed Glycine 0 N--CA 1.482 1.739 0 N-CA-C 115.068 0.787 . . . . 0.0 115.068 174.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -117.86 -171.65 2.1 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-N 117.795 0.798 . . . . 0.0 111.614 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -157.57 86.41 0.93 Allowed 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.983 0.913 . . . . 0.0 109.759 171.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.34 -26.94 60.45 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.635 0.774 . . . . 0.0 111.524 -174.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.51 ' SD ' ' N ' ' A' ' 61' ' ' MET . 0.2 OUTLIER -75.49 -31.27 60.13 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.534 0.734 . . . . 0.0 110.158 173.722 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.2 m 62.86 84.39 0.19 Allowed Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 124.743 1.217 . . . . 0.0 111.647 177.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -85.55 45.96 1.65 Allowed 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 123.577 2.851 . . . . 0.0 110.381 172.026 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.429 ' HG2' ' H ' ' A' ' 66' ' ' GLU . 10.0 ttm180 -138.7 133.0 16.5 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 114.278 -1.328 . . . . 0.0 109.98 -161.442 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.83 -23.11 30.85 Favored 'Trans proline' 0 C--N 1.372 1.797 0 C-N-CA 122.662 2.241 . . . . 0.0 113.123 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.429 ' H ' ' HG2' ' A' ' 64' ' ' ARG . 21.0 mm-40 -75.09 156.38 36.12 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.255 0.622 . . . . 0.0 111.573 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -89.57 51.72 2.17 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.766 0.826 . . . . 0.0 112.139 -168.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -92.72 -0.59 57.25 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.523 0.729 . . . . 0.0 112.355 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -70.84 132.29 87.0 Favored Pre-proline 0 CA--C 1.564 1.509 0 C-N-CA 123.495 0.718 . . . . 0.0 112.31 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -79.92 154.54 22.93 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.483 2.122 . . . . 0.0 112.751 172.05 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.72 -36.65 93.6 Favored Glycine 0 CA--C 1.54 1.599 0 N-CA-C 114.386 0.514 . . . . 0.0 114.386 -178.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -74.56 123.34 24.61 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.303 0.641 . . . . 0.0 110.662 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -99.0 173.69 6.71 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.8 0.84 . . . . 0.0 110.602 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.7 105.56 4.34 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.211 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 108.27 27.66 4.95 Favored Glycine 0 CA--C 1.535 1.333 0 CA-C-N 115.814 -0.63 . . . . 0.0 113.581 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -105.47 111.18 23.79 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.186 0.594 . . . . 0.0 111.237 171.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.5 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 11.9 ptt85 -83.1 88.05 6.9 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 165.292 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.4 t-105 -172.46 121.1 0.42 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.289 -173.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 43.4 t 54.56 19.24 2.32 Favored 'General case' 0 N--CA 1.499 1.978 0 C-N-CA 124.702 1.201 . . . . 0.0 113.708 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.637 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -71.4 124.11 23.85 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.36 0.664 . . . . 0.0 109.772 -175.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 52.0 t -62.14 110.5 1.62 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.177 0.591 . . . . 0.0 110.162 174.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.538 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -57.22 -26.7 61.13 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 113.885 1.069 . . . . 0.0 113.885 -171.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 78.6 p -68.64 -30.47 69.19 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.132 0.573 . . . . 0.0 112.228 176.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -72.85 -31.36 64.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.576 0.75 . . . . 0.0 111.027 175.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.528 ' HD1' HG11 ' A' ' 110' ' ' VAL . 8.8 t-105 -67.29 -53.97 24.99 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.259 0.624 . . . . 0.0 110.114 171.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.453 HE21 ' HG3' ' A' ' 90' ' ' GLU . 18.2 tp60 -56.88 -34.97 68.39 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.865 0.866 . . . . 0.0 112.263 177.185 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -52.41 -39.02 60.44 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.674 0.79 . . . . 0.0 111.826 175.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.06 -36.31 81.75 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.443 0.697 . . . . 0.0 112.727 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -67.42 -46.46 73.1 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 120.913 0.387 . . . . 0.0 110.391 173.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.453 ' HG3' HE21 ' A' ' 86' ' ' GLN . 42.1 mt-10 -66.2 -19.62 65.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.834 0.854 . . . . 0.0 111.827 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.08 -25.77 31.73 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.208 1.003 . . . . 0.0 111.708 171.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 111.17 -12.88 28.8 Favored Glycine 0 CA--C 1.537 1.465 0 CA-C-N 116.235 -0.439 . . . . 0.0 114.052 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 58.8 mtp -89.17 -81.61 0.27 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.725 0.81 . . . . 0.0 111.659 -174.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 59.86 99.5 0.04 OUTLIER Pre-proline 0 CA--C 1.564 1.505 0 C-N-CA 125.184 1.394 . . . . 0.0 114.226 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -57.18 166.47 4.26 Favored 'Trans proline' 0 CA--C 1.567 2.172 0 C-N-CA 124.098 3.199 . . . . 0.0 114.655 171.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.58 129.27 20.81 Favored 'Trans proline' 0 CA--C 1.567 2.144 0 C-N-CA 122.168 1.912 . . . . 0.0 112.996 171.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.8 p -116.61 151.39 18.42 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.158 0 C-N-CA 123.945 0.898 . . . . 0.0 111.096 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.6 m -88.33 97.61 6.94 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 124.262 1.025 . . . . 0.0 113.5 -171.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 22.8 mt -59.97 -24.33 64.33 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.134 -0.979 . . . . 0.0 112.305 172.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -67.81 -32.38 72.89 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 124.144 0.977 . . . . 0.0 112.738 178.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.8 t -115.4 -45.69 2.91 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -174.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.1 m -48.12 112.75 0.62 Allowed 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 123.571 0.748 . . . . 0.0 112.398 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -83.5 175.42 9.81 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -169.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.636 ' HA ' HD13 ' A' ' 107' ' ' LEU . 14.7 mmmm -67.76 -21.09 65.28 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 124.043 0.937 . . . . 0.0 113.197 -175.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.415 ' HB3' ' O ' ' A' ' 40' ' ' THR . 31.3 t -68.54 -29.72 68.36 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 176.326 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.2 -31.19 70.95 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.05 0.54 . . . . 0.0 112.453 176.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.636 HD13 ' HA ' ' A' ' 104' ' ' LYS . 8.1 mp -61.38 -28.03 68.95 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 124.019 0.928 . . . . 0.0 111.935 176.409 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -74.5 -5.78 44.66 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.889 0.876 . . . . 0.0 112.624 -177.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -120.92 -45.67 2.37 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.031 0.932 . . . . 0.0 110.721 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.528 HG11 ' HD1' ' A' ' 85' ' ' TRP . 0.6 OUTLIER -103.6 -35.38 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 C-N-CA 122.917 0.487 . . . . 0.0 111.9 -172.777 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 111' ' ' SER . . . . . 0.406 ' O ' HG23 ' A' ' 110' ' ' VAL . 39.3 t 77.05 134.68 0.06 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.616 1.567 . . . . 0.0 110.849 -166.297 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 tt -44.93 -28.16 0.63 Allowed 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 124.734 1.214 . . . . 0.0 113.827 -177.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.73 -37.26 70.74 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.613 0.765 . . . . 0.0 113.0 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -72.85 -40.98 65.25 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 120.891 0.377 . . . . 0.0 110.813 177.114 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.517 HD23 ' HE1' ' A' ' 85' ' ' TRP . 67.7 mt -57.6 -46.46 84.03 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.601 0.76 . . . . 0.0 111.74 177.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -76.06 -34.35 59.59 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.699 0.8 . . . . 0.0 112.409 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -57.72 -28.05 63.52 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.174 0.589 . . . . 0.0 112.435 173.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -126.48 26.62 6.31 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.789 0.836 . . . . 0.0 111.938 -177.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.53 157.2 34.26 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.055 172.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.37 146.64 86.75 Favored Pre-proline 0 CA--C 1.559 1.3 0 C-N-CA 122.691 0.396 . . . . 0.0 111.198 173.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -60.6 117.07 3.8 Favored 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 123.353 2.702 . . . . 0.0 112.593 -176.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 93.8 t 65.85 107.53 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 C-N-CA 124.613 1.165 . . . . 0.0 111.695 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 46.3 tp -72.07 -55.65 6.98 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.058 0.543 . . . . 0.0 110.748 177.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.3 144.25 51.16 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.128 0.971 . . . . 0.0 110.337 -178.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 11.1 p80 -72.69 91.19 1.44 Allowed 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 121.504 0.668 . . . . 0.0 110.618 178.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -68.35 138.16 55.17 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.432 -179.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 7.5 p80 -151.96 134.84 15.62 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.702 1.201 . . . . 0.0 109.294 -170.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 17.7 t60 58.76 38.92 24.73 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.653 0.781 . . . . 0.0 110.559 -177.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 69.76 5.42 5.21 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 125.478 1.511 . . . . 0.0 113.458 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 6.0 p-80 . . . . . 0 CA--C 1.574 1.881 0 C-N-CA 124.099 0.959 . . . . 0.0 111.01 176.348 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.1 mmt . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.598 0.237 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.79 -95.2 2.25 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 116.257 -0.429 . . . . 0.0 112.785 178.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.614 ' HB3' ' HG3' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -70.35 153.91 42.49 Favored 'General case' 0 CA--C 1.565 1.541 0 C-N-CA 124.1 0.96 . . . . 0.0 110.95 -179.283 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.04 -145.81 0.53 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 115.457 0.943 . . . . 0.0 115.457 -173.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -147.9 152.28 37.3 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 122.033 -0.687 . . . . 0.0 111.91 -176.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -109.9 -172.7 2.09 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.669 0.788 . . . . 0.0 111.523 -176.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.6 m -74.55 -6.48 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 C-N-CA 123.716 0.806 . . . . 0.0 112.529 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.5 mt -67.84 -22.14 65.15 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.195 1.398 . . . . 0.0 113.411 -167.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 88.9 -60.98 3.8 Favored Glycine 0 C--N 1.345 1.047 0 N-CA-C 111.652 -0.579 . . . . 0.0 111.652 -176.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -151.76 140.12 20.46 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.995 0.918 . . . . 0.0 109.954 175.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -144.1 163.63 32.99 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.219 0.608 . . . . 0.0 110.397 -172.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.1 tt -153.95 86.93 1.19 Allowed 'General case' 0 CA--C 1.562 1.411 0 CA-C-O 120.849 0.357 . . . . 0.0 110.396 -173.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -97.39 86.63 3.92 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 123.9 0.88 . . . . 0.0 111.089 176.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.559 HG21 ' HB3' ' A' ' 38' ' ' SER . 14.2 p -106.4 157.93 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 C-N-CA 123.668 0.787 . . . . 0.0 112.406 -173.264 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.2 m -132.89 -51.44 0.9 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.112 0.565 . . . . 0.0 109.509 167.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.417 ' SG ' ' N ' ' A' ' 17' ' ' CYS . 32.9 t 56.07 -172.4 0.07 Allowed 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 124.137 0.975 . . . . 0.0 113.238 175.009 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.417 ' N ' ' SG ' ' A' ' 16' ' ' CYS . 49.9 t 73.99 -63.41 0.43 Allowed 'General case' 0 N--CA 1.499 2.015 0 C-N-CA 125.203 1.401 . . . . 0.0 112.647 175.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.81 145.08 86.39 Favored Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.368 0.667 . . . . 0.0 111.191 173.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -53.17 109.12 0.32 Allowed 'Trans proline' 0 C--N 1.383 2.357 0 C-N-CA 123.179 2.586 . . . . 0.0 114.16 178.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 52.0 ttm 58.79 85.31 0.1 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 125.473 1.509 . . . . 0.0 112.418 178.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.0 t -155.1 150.65 27.41 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.495 0.718 . . . . 0.0 110.917 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.89 148.46 15.26 Favored Glycine 0 C--N 1.349 1.282 0 N-CA-C 111.899 -0.48 . . . . 0.0 111.899 -169.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -63.69 112.62 2.92 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.613 0.72 . . . . 0.0 112.038 -178.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -70.0 -12.48 61.64 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 125.185 1.394 . . . . 0.0 112.296 -176.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.614 ' HG3' ' HB3' ' A' ' 3' ' ' GLN . 0.1 OUTLIER -77.34 -60.69 2.26 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 124.164 0.986 . . . . 0.0 110.782 178.472 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -112.79 -32.07 6.53 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.701 0.8 . . . . 0.0 112.624 -170.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.58 -85.09 1.09 Allowed Glycine 0 CA--C 1.528 0.89 0 N-CA-C 114.498 0.559 . . . . 0.0 114.498 -174.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -62.65 -54.95 31.83 Favored 'General case' 0 CA--C 1.56 1.345 0 C-N-CA 123.406 0.683 . . . . 0.0 111.279 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 66.5 m 61.25 -173.85 0.13 Allowed 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 172.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -91.91 65.36 4.88 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.68 165.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 37.8 m -85.16 79.72 9.47 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.557 176.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -94.35 -101.14 0.15 Allowed 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.675 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 14.0 p -101.79 5.91 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.351 0 C-N-CA 123.416 0.686 . . . . 0.0 110.757 -174.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -109.84 -69.15 0.88 Allowed 'General case' 0 CA--C 1.555 1.165 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -174.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -78.18 178.48 7.56 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -163.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -109.07 17.17 21.95 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 124.505 1.122 . . . . 0.0 112.241 176.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -77.45 -149.67 3.71 Favored Glycine 0 N--CA 1.48 1.571 0 N-CA-C 112.621 -0.191 . . . . 0.0 112.621 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.559 ' HB3' HG21 ' A' ' 14' ' ' VAL . 59.0 p -72.64 101.37 3.02 Favored 'General case' 0 N--CA 1.486 1.327 0 O-C-N 122.242 -0.564 . . . . 0.0 111.649 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.496 ' HB3' ' HB3' ' A' ' 105' ' ' SER . 94.2 m-70 -75.73 151.39 37.63 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.057 174.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.9 t -123.9 131.63 53.61 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.403 0.681 . . . . 0.0 111.076 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.452 HG11 ' HB2' ' A' ' 82' ' ' ALA . 48.5 t -129.85 101.4 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 123.65 0.78 . . . . 0.0 109.311 176.061 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 75.5 m -96.96 105.68 17.87 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.674 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -138.58 137.31 36.87 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.82 0.848 . . . . 0.0 108.954 -177.298 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.471 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 14.4 tt0 -117.78 108.83 15.84 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.124 0.487 . . . . 0.0 110.977 -168.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.477 ' HB2' HD11 ' A' ' 50' ' ' LEU . 59.3 mmm -91.55 132.6 36.18 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.817 0.847 . . . . 0.0 109.359 -179.562 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.655 HG22 ' HB3' ' A' ' 95' ' ' PRO . 8.0 t -80.12 155.29 27.56 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 175.509 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.467 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 37.1 tt0 -51.83 -31.23 26.66 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 118.902 -0.571 . . . . 0.0 112.291 -174.172 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -49.86 -43.79 49.3 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.802 0.841 . . . . 0.0 112.427 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -71.57 -38.21 70.96 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.593 0.357 . . . . 0.0 111.804 175.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.477 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.0 mp -71.04 -21.54 62.25 Favored 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 122.491 0.317 . . . . 0.0 111.742 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 47' ' ' GLU . 90.4 mt -72.72 -31.61 65.11 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 124.177 0.991 . . . . 0.0 109.565 169.734 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -74.86 -31.42 61.63 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 123.49 0.716 . . . . 0.0 111.465 168.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.9 m -70.11 -36.68 75.03 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.387 0.675 . . . . 0.0 111.781 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -71.69 -32.97 68.41 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 120.939 0.4 . . . . 0.0 110.51 172.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -71.03 -30.19 66.32 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.263 1.025 . . . . 0.0 111.067 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -80.18 -55.33 5.0 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.45 0.7 . . . . 0.0 110.49 174.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -120.15 -88.04 1.06 Allowed Glycine 0 C--N 1.351 1.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 112.745 -177.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -153.27 156.83 39.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.576 0.751 . . . . 0.0 109.961 -174.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -57.89 151.81 17.33 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.742 0.817 . . . . 0.0 111.978 177.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 42.1 tp -138.86 -37.85 0.52 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.239 0.616 . . . . 0.0 111.085 178.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.11 -38.48 56.85 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -175.256 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 52.6 m 58.95 92.25 0.07 OUTLIER Pre-proline 0 N--CA 1.489 1.509 0 C-N-CA 124.224 1.01 . . . . 0.0 111.475 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -71.5 58.87 2.52 Favored 'Trans proline' 0 CA--C 1.569 2.268 0 C-N-CA 123.425 2.75 . . . . 0.0 113.567 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.413 ' HB3' ' HD2' ' A' ' 65' ' ' PRO . 44.1 mtm180 -139.69 167.2 19.42 Favored Pre-proline 0 CA--C 1.563 1.463 0 C-N-CA 125.146 1.379 . . . . 0.0 109.835 -178.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 64' ' ' ARG . 59.6 Cg_endo -68.87 -1.83 8.43 Favored 'Trans proline' 0 C--N 1.389 2.683 0 C-N-CA 122.682 2.255 . . . . 0.0 113.386 175.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -64.41 97.14 0.18 Allowed 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.736 0.815 . . . . 0.0 111.584 172.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -110.5 75.74 0.94 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 168.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -102.2 21.78 14.37 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.454 -178.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 59.94 82.32 0.23 Allowed Pre-proline 0 CA--C 1.56 1.338 0 C-N-CA 124.97 1.308 . . . . 0.0 111.039 -172.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.59 -17.77 20.4 Favored 'Trans proline' 0 C--N 1.377 2.04 0 C-N-CA 122.484 2.123 . . . . 0.0 112.817 177.636 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 78.55 93.56 0.29 Allowed Glycine 0 C--N 1.351 1.366 0 CA-C-O 119.65 -0.528 . . . . 0.0 112.05 -178.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.1 tp 64.91 108.85 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.362 1.065 . . . . 0.0 111.926 -175.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -136.62 -172.07 3.07 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.336 0.654 . . . . 0.0 111.359 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.12 126.11 28.14 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.422 0.689 . . . . 0.0 111.89 -176.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 77.01 28.59 58.38 Favored Glycine 0 C--N 1.349 1.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 113.971 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -131.51 102.94 6.14 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 123.601 0.761 . . . . 0.0 110.905 178.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.471 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 11.5 ptt180 -85.57 88.88 7.58 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.881 0.848 . . . . 0.0 111.905 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -160.05 119.73 2.86 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.144 0.977 . . . . 0.0 109.353 -177.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 85.9 m 57.98 20.65 6.97 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.157 0.983 . . . . 0.0 113.179 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.674 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.5 tm? -68.02 115.97 8.12 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 48.4 m -63.32 114.79 4.04 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 123.649 0.593 . . . . 0.0 109.434 177.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.584 ' HB1' HG13 ' A' ' 110' ' ' VAL . . . -51.83 -35.51 44.75 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.822 0.849 . . . . 0.0 112.695 -176.457 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.7 m -57.55 -34.95 69.69 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.855 0.862 . . . . 0.0 112.688 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -74.69 -29.5 61.24 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 177.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -67.83 -51.74 44.93 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 169.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.74 ' HB2' HG12 ' A' ' 110' ' ' VAL . 13.3 tp60 -49.9 -35.6 24.25 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.891 0.876 . . . . 0.0 112.79 171.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -56.02 -44.01 78.32 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.934 0.894 . . . . 0.0 111.974 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.72 83.57 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.917 0.887 . . . . 0.0 113.095 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.37 -47.08 87.5 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.313 0.577 . . . . 0.0 110.69 173.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -69.49 -28.39 66.02 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.123 0.969 . . . . 0.0 112.114 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.7 -25.79 49.66 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.279 0.632 . . . . 0.0 111.308 174.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.76 29.82 25.43 Favored Glycine 0 CA--C 1.537 1.444 0 CA-C-N 116.101 -0.499 . . . . 0.0 113.822 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 23.1 ptm -139.6 25.26 2.4 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.209 0.604 . . . . 0.0 111.83 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -40.13 112.6 0.85 Allowed Pre-proline 0 CA--C 1.572 1.802 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 177.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.655 ' HB3' HG22 ' A' ' 46' ' ' THR . 54.3 Cg_exo -60.48 161.61 20.08 Favored 'Trans proline' 0 C--N 1.382 2.296 0 C-N-CA 123.745 2.963 . . . . 0.0 114.157 168.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -73.83 115.1 4.21 Favored 'Trans proline' 0 C--N 1.374 1.9 0 C-N-CA 122.138 1.892 . . . . 0.0 111.237 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 9.0 p -97.17 164.55 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-O 121.394 0.616 . . . . 0.0 109.846 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p -107.86 96.9 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.325 0 C-N-CA 123.882 0.873 . . . . 0.0 110.448 -178.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 25.6 mt -52.27 -41.17 62.63 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 124.248 1.019 . . . . 0.0 113.165 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.423 ' HB3' HG11 ' A' ' 122' ' ' VAL . 18.7 pt20 -74.14 -1.27 19.57 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -176.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.8 t -122.5 -26.18 4.62 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.516 0.726 . . . . 0.0 111.154 172.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 30.4 m -76.3 104.07 6.64 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.19 0.596 . . . . 0.0 109.922 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -65.8 152.32 44.63 Favored 'General case' 0 CA--C 1.564 1.518 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.612 -175.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.16 -14.58 56.05 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 125.155 1.382 . . . . 0.0 112.551 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.496 ' HB3' ' HB3' ' A' ' 39' ' ' HIS . 54.9 m -55.82 -31.14 62.42 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.996 0.918 . . . . 0.0 111.259 169.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.432 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -56.32 -41.24 75.68 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.741 0.817 . . . . 0.0 112.004 175.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.7 -13.81 6.91 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 124.216 1.006 . . . . 0.0 113.502 -177.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -86.62 -8.7 57.25 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.469 0.708 . . . . 0.0 111.483 -179.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.507 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 44.8 m-85 -123.24 -45.41 2.1 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.826 1.251 . . . . 0.0 109.306 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.74 HG12 ' HB2' ' A' ' 86' ' ' GLN . 13.9 m -85.81 -167.81 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 CA-C-O 122.135 0.969 . . . . 0.0 111.608 167.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 43.9 t -115.03 150.85 35.23 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 114.323 -1.308 . . . . 0.0 108.713 156.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.1 tt -48.69 -39.28 23.91 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.079 0.552 . . . . 0.0 111.629 173.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.93 -31.49 65.0 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.15 0.98 . . . . 0.0 113.248 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -64.4 -46.05 85.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.043 0.537 . . . . 0.0 111.058 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.653 HD21 HG21 ' A' ' 110' ' ' VAL . 8.1 mt -66.17 -48.85 69.39 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.815 0.817 . . . . 0.0 109.83 -175.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -74.04 -24.84 59.6 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.26 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.95 -34.05 62.9 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 123.62 0.768 . . . . 0.0 112.704 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.28 33.62 3.06 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.1 0.56 . . . . 0.0 111.546 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -151.37 130.27 12.5 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.227 0.611 . . . . 0.0 110.147 171.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 4.6 mm? -80.55 144.27 56.6 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 123.065 0.546 . . . . 0.0 111.686 -176.193 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 120' ' ' LEU . 28.2 Cg_exo -62.8 100.0 0.23 Allowed 'Trans proline' 0 C--N 1.381 2.263 0 C-N-CA 123.329 2.686 . . . . 0.0 112.435 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' VAL . . . . . 0.423 HG11 ' HB3' ' A' ' 100' ' ' GLN . 7.8 p -68.49 143.46 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.328 0 C-N-CA 123.914 0.886 . . . . 0.0 111.356 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 7.8 tt -69.94 112.22 6.2 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.515 0.674 . . . . 0.0 111.439 -175.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -106.74 -60.42 1.67 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.627 1.171 . . . . 0.0 108.914 172.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 44.9 t60 -178.92 109.96 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.083 1.353 . . . . 0.0 108.265 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 50.5 p-80 -92.13 121.53 33.76 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 121.319 0.581 . . . . 0.0 110.889 175.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -143.3 123.21 13.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.813 0.845 . . . . 0.0 109.155 171.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -139.41 161.58 37.13 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.552 0.741 . . . . 0.0 109.405 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -143.65 136.79 27.74 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.764 0.426 . . . . 0.0 110.416 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 . . . . . 0 CA--C 1.562 1.433 0 C-N-CA 123.033 0.533 . . . . 0.0 109.758 170.335 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptm . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 120.561 0.219 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.85 -5.21 51.01 Favored Glycine 0 CA--C 1.537 1.468 0 CA-C-N 116.415 -0.357 . . . . 0.0 113.522 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.47 133.32 46.72 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.627 0.771 . . . . 0.0 109.819 177.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.81 107.13 1.92 Allowed Glycine 0 C--N 1.352 1.472 0 O-C-N 123.189 0.305 . . . . 0.0 113.112 178.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -126.96 127.85 45.49 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.303 1.041 . . . . 0.0 110.032 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -100.0 162.48 12.95 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.543 0.737 . . . . 0.0 110.891 176.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.7 m -62.43 -24.26 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 C-N-CA 124.105 0.962 . . . . 0.0 113.567 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.696 HD13 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -87.85 -11.86 46.6 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.19 0.596 . . . . 0.0 112.451 -179.633 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 72.32 100.84 0.07 OUTLIER Glycine 0 CA--C 1.541 1.676 0 O-C-N 123.141 0.275 . . . . 0.0 113.391 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -136.68 156.42 48.55 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.264 0.626 . . . . 0.0 112.035 -175.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -159.67 17.68 0.16 Allowed 'General case' 0 CA--C 1.559 1.322 0 CA-C-O 121.61 0.719 . . . . 0.0 110.518 177.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 89.9 mt -105.25 166.9 10.08 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.163 0.985 . . . . 0.0 110.135 173.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.4 141.01 43.31 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 122.59 0.356 . . . . 0.0 110.837 176.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.5 p -176.51 147.54 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.635 0.774 . . . . 0.0 110.91 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.407 ' HB3' HG21 ' A' ' 21' ' ' THR . 42.4 t -83.29 -63.77 1.29 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.631 0.372 . . . . 0.0 110.377 169.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 56.9 m -148.47 152.26 36.6 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.504 0.722 . . . . 0.0 110.516 177.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.4 p -84.13 -1.06 54.3 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.624 0.77 . . . . 0.0 111.85 176.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.19 141.26 46.28 Favored Pre-proline 0 CA--C 1.558 1.285 0 C-N-CA 123.754 0.822 . . . . 0.0 111.95 -177.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.98 -15.56 28.05 Favored 'Trans proline' 0 C--N 1.384 2.442 0 C-N-CA 123.547 2.832 . . . . 0.0 114.926 177.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 51.6 ttm -68.56 -42.31 78.52 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.535 0.334 . . . . 0.0 111.302 175.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.407 HG21 ' HB3' ' A' ' 15' ' ' CYS . 47.8 m -72.48 -51.19 21.17 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.027 0.531 . . . . 0.0 110.583 170.174 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.6 150.5 24.52 Favored Glycine 0 CA--C 1.536 1.375 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.687 -176.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 13.3 m-90 -92.48 101.56 14.01 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.781 0.832 . . . . 0.0 109.631 -178.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.519 ' HB3' ' HG3' ' A' ' 30' ' ' GLN . 89.7 m-85 -81.51 66.03 6.89 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.275 0.63 . . . . 0.0 111.35 -177.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? 59.52 -77.44 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 125.25 1.42 . . . . 0.0 111.724 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -72.29 -63.28 1.18 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.835 0.854 . . . . 0.0 110.055 178.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -165.94 -55.76 0.03 OUTLIER Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.878 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -138.34 -33.79 0.67 Allowed 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.622 0.369 . . . . 0.0 111.271 173.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 28.3 p -97.43 116.61 29.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.489 0.316 . . . . 0.0 110.792 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.519 ' HG3' ' HB3' ' A' ' 24' ' ' TYR . 54.1 mt-30 -84.76 -51.88 6.46 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.627 0.771 . . . . 0.0 111.26 177.66 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.24 74.75 5.81 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 121.558 0.694 . . . . 0.0 110.522 173.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -169.41 164.3 10.61 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 114.4 -1.273 . . . . 0.0 110.403 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 28.7 m -91.44 27.41 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.566 1.574 0 C-N-CA 124.374 1.07 . . . . 0.0 111.174 173.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 52.46 23.65 2.63 Favored 'General case' 0 N--CA 1.506 2.357 0 C-N-CA 127.103 2.161 . . . . 0.0 113.544 -174.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -117.07 116.08 26.63 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.225 1.01 . . . . 0.0 109.326 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 51.96 10.83 0.12 Allowed 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 126.766 2.026 . . . . 0.0 116.121 -179.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.0 127.6 0.42 Allowed Glycine 0 CA--C 1.544 1.888 0 N-CA-C 115.405 0.922 . . . . 0.0 115.405 168.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 97.8 p 50.92 34.16 10.0 Favored 'General case' 0 N--CA 1.501 2.08 0 C-N-CA 125.411 1.485 . . . . 0.0 114.6 168.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -79.95 89.81 5.33 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.569 0.748 . . . . 0.0 111.374 -177.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.77 111.08 9.65 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 123.04 0.536 . . . . 0.0 111.459 178.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.585 HG11 ' HB2' ' A' ' 82' ' ' ALA . 40.9 t -128.13 120.51 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 169.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 81.5 m -116.61 109.14 16.83 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-O 121.192 0.52 . . . . 0.0 109.86 173.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.622 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -132.06 150.38 52.17 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.332 1.053 . . . . 0.0 108.512 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -117.58 109.18 16.37 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.968 0.413 . . . . 0.0 110.236 -176.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.553 ' HE1' ' HE3' ' A' ' 85' ' ' TRP . 60.5 mmm -84.97 131.42 34.48 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.481 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 5.4 t -81.95 153.71 26.13 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 174.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -49.06 -30.04 5.84 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.489 1.116 . . . . 0.0 113.106 -175.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -49.62 -48.41 49.06 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.65 1.18 . . . . 0.0 112.293 175.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.455 ' HB2' ' HG3' ' A' ' 95' ' ' PRO . 59.8 t80 -68.95 -41.35 78.15 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.034 0.533 . . . . 0.0 112.04 176.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.463 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.3 mp -70.94 -29.45 65.47 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 122.592 0.357 . . . . 0.0 111.713 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 67.9 mt -76.38 -32.86 58.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.695 0.798 . . . . 0.0 110.527 171.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -68.27 -32.19 72.18 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.08 0.552 . . . . 0.0 111.08 171.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 70.0 m -63.67 -49.59 72.58 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.327 0.651 . . . . 0.0 110.658 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.43 ' HD2' ' SD ' ' A' ' 61' ' ' MET . 16.3 ptm180 -72.14 -22.83 61.26 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 177.406 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -76.48 -28.82 56.63 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 123.781 0.832 . . . . 0.0 111.931 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -130.08 -59.17 1.06 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -175.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -76.11 -88.96 0.27 Allowed Glycine 0 CA--C 1.541 1.697 0 N-CA-C 114.128 0.411 . . . . 0.0 114.128 -174.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.429 HD21 ' HB3' ' A' ' 68' ' ' ASN . 44.3 t-20 -140.36 142.62 35.53 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.719 0.808 . . . . 0.0 109.935 -179.136 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -66.83 87.11 0.13 Allowed 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 122.288 1.042 . . . . 0.0 111.738 177.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 34.5 tp -65.52 -11.92 48.01 Favored 'General case' 0 CA--C 1.562 1.427 0 C-N-CA 125.267 1.427 . . . . 0.0 112.946 -176.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.43 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 20.5 ptp -126.01 39.36 3.96 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.656 0.783 . . . . 0.0 112.191 -174.039 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 14.1 t -86.65 152.18 53.96 Favored Pre-proline 0 N--CA 1.489 1.486 0 C-N-CA 122.854 0.462 . . . . 0.0 110.538 171.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -60.82 -166.32 0.04 OUTLIER 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.863 2.376 . . . . 0.0 113.404 166.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 70.71 159.34 0.16 Allowed Pre-proline 0 N--CA 1.501 2.113 0 C-N-CA 124.605 1.162 . . . . 0.0 111.6 -175.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo -58.18 -55.6 2.13 Favored 'Trans proline' 0 C--N 1.39 2.75 0 C-N-CA 122.135 1.89 . . . . 0.0 111.333 173.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 69.04 148.76 0.07 Allowed 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 125.485 1.514 . . . . 0.0 113.823 171.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -122.75 -19.61 6.17 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.224 1.01 . . . . 0.0 112.077 -179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.429 ' HB3' HD21 ' A' ' 58' ' ' ASN . 95.0 m-20 -53.58 -34.31 57.9 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -174.32 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 32.3 p90 -138.18 156.21 73.92 Favored Pre-proline 0 N--CA 1.481 1.102 0 C-N-CA 123.582 0.753 . . . . 0.0 111.504 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.15 175.04 10.17 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.449 2.099 . . . . 0.0 111.587 166.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -75.96 -119.86 0.14 Allowed Glycine 0 CA--C 1.537 1.452 0 C-N-CA 121.795 -0.24 . . . . 0.0 113.435 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.3 mm? 56.2 91.08 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.881 1.273 . . . . 0.0 112.093 -178.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.48 174.06 6.45 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.371 -176.076 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.03 116.74 4.74 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.611 0.765 . . . . 0.0 112.242 -173.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 102.34 14.73 27.36 Favored Glycine 0 CA--C 1.536 1.347 0 N-CA-C 114.456 0.543 . . . . 0.0 114.456 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -122.55 103.8 8.94 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 117.783 0.791 . . . . 0.0 111.815 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.411 ' HB3' HG11 ' A' ' 98' ' ' VAL . 0.0 OUTLIER -86.75 91.98 8.8 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.365 0.603 . . . . 0.0 111.324 168.712 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -166.71 121.01 1.07 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.278 0.631 . . . . 0.0 109.323 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 73.4 m 52.78 24.81 3.44 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 175.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.622 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.3 tm? -72.29 105.25 3.98 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 175.207 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 49.5 t -55.72 120.66 7.64 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 123.551 0.532 . . . . 0.0 110.567 175.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.585 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -56.84 -22.72 38.7 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.842 0.857 . . . . 0.0 113.131 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 64.6 m -54.1 -39.98 66.88 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.078 0.551 . . . . 0.0 112.348 170.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -66.84 -44.56 80.75 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.92 0.888 . . . . 0.0 111.552 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.652 ' HE1' HD23 ' A' ' 115' ' ' LEU . 5.3 t-105 -70.53 -54.02 13.82 Favored 'General case' 0 CA--C 1.566 1.559 0 C-N-CA 123.215 0.606 . . . . 0.0 110.99 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.699 ' HB2' HG12 ' A' ' 110' ' ' VAL . 6.5 tp60 -49.64 -42.51 45.33 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.31 0.644 . . . . 0.0 112.303 175.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.23 -32.7 62.49 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 123.56 0.744 . . . . 0.0 112.752 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.93 -43.12 91.13 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.111 0.564 . . . . 0.0 111.839 175.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -69.83 -41.24 75.22 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.483 0.713 . . . . 0.0 111.232 176.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 9.4 mm-40 -65.35 -23.71 67.06 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.458 0.703 . . . . 0.0 111.372 178.345 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.05 -25.63 29.7 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.865 0.866 . . . . 0.0 111.523 172.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 117.7 -12.92 13.36 Favored Glycine 0 N--CA 1.48 1.572 0 N-CA-C 114.187 0.435 . . . . 0.0 114.187 177.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 91.1 mmm -83.92 -80.84 0.18 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.336 0.654 . . . . 0.0 111.773 -176.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.46 92.17 0.07 OUTLIER Pre-proline 0 N--CA 1.487 1.422 0 C-N-CA 124.664 1.185 . . . . 0.0 113.043 -174.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.455 ' HG3' ' HB2' ' A' ' 49' ' ' PHE . 67.6 Cg_endo -77.6 179.27 6.67 Favored 'Trans proline' 0 CA--C 1.574 2.492 0 C-N-CA 123.215 2.61 . . . . 0.0 112.734 174.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -62.06 127.8 22.27 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 121.953 1.768 . . . . 0.0 113.971 174.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.7 p -104.01 145.4 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 124.119 0.968 . . . . 0.0 109.884 173.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 77' ' ' ARG . 7.5 p -85.67 89.44 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.842 0 CA-C-O 122.192 0.996 . . . . 0.0 111.873 -176.111 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.623 HD12 ' H ' ' A' ' 120' ' ' LEU . 7.9 mt -64.36 -24.06 67.51 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -177.774 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -73.27 -6.72 47.86 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 177.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.8 t -123.3 -12.99 7.76 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.679 0.791 . . . . 0.0 112.022 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 91.1 m -85.67 127.09 34.4 Favored 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 123.424 0.689 . . . . 0.0 112.171 -175.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -91.04 165.67 13.4 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.528 0.731 . . . . 0.0 111.518 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -63.32 -17.34 62.46 Favored 'General case' 0 CA--C 1.564 1.519 0 C-N-CA 124.398 1.079 . . . . 0.0 113.867 177.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 64.2 m -61.23 -24.91 66.7 Favored 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 122.696 0.398 . . . . 0.0 111.898 173.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.401 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -55.09 -38.9 68.68 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.418 0.687 . . . . 0.0 111.782 172.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.431 HD21 ' HB2' ' A' ' 112' ' ' LEU . 8.8 mp -67.47 3.4 1.33 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 124.647 1.179 . . . . 0.0 113.47 -176.713 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -95.72 -2.85 47.04 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.101 0.56 . . . . 0.0 110.357 174.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 75.6 m-85 -130.39 -53.24 1.1 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.122 1.369 . . . . 0.0 108.542 -177.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.699 HG12 ' HB2' ' A' ' 86' ' ' GLN . 17.0 m -89.07 177.87 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-O 122.256 1.027 . . . . 0.0 112.348 172.281 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.0 t -97.13 148.87 22.6 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 113.924 -1.489 . . . . 0.0 108.888 156.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.431 ' HB2' HD21 ' A' ' 107' ' ' LEU . 1.8 tt -57.99 -34.29 69.82 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 120.98 0.419 . . . . 0.0 109.958 170.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.91 -30.22 65.72 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.694 0.797 . . . . 0.0 112.524 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -71.57 -37.69 71.02 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.346 0.594 . . . . 0.0 110.131 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.652 HD23 ' HE1' ' A' ' 85' ' ' TRP . 75.9 mt -66.62 -50.0 64.44 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.652 0.781 . . . . 0.0 110.98 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.666 HE22 ' HB ' ' A' ' 122' ' ' VAL . 14.7 mt-30 -75.04 -37.7 61.65 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.065 -0.971 . . . . 0.0 112.582 -173.167 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -59.31 -25.65 64.33 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.469 173.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -120.05 19.84 12.22 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 123.526 0.731 . . . . 0.0 112.14 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -155.05 -101.69 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 170.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.623 ' H ' HD12 ' A' ' 99' ' ' LEU . 3.7 mm? -117.94 133.95 23.34 Favored Pre-proline 0 N--CA 1.483 1.193 0 C-N-CA 123.563 0.745 . . . . 0.0 111.444 -171.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -87.63 135.37 3.53 Favored 'Trans proline' 0 CA--C 1.561 1.83 0 C-N-CA 123.16 2.574 . . . . 0.0 112.968 -176.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' VAL . . . . . 0.666 ' HB ' HE22 ' A' ' 116' ' ' GLN . 7.5 p -75.39 153.17 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 C-N-CA 122.884 0.474 . . . . 0.0 110.821 176.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.582 HD13 ' H ' ' A' ' 123' ' ' LEU . 0.0 OUTLIER -115.89 171.85 7.51 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.402 0.681 . . . . 0.0 110.108 170.276 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.92 161.42 27.52 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.724 0.81 . . . . 0.0 110.746 -177.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -71.2 111.88 6.9 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.44 176.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -83.86 127.07 33.57 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.968 0.507 . . . . 0.0 111.745 -175.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -156.76 167.44 30.46 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.817 0.847 . . . . 0.0 110.892 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -65.48 121.65 15.37 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.675 0.39 . . . . 0.0 110.743 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -79.68 101.91 8.66 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.507 0.723 . . . . 0.0 111.512 -174.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 . . . . . 0 N--CA 1.488 1.455 0 C-N-CA 125.287 1.435 . . . . 0.0 112.608 176.099 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -148.49 80.01 0.21 Allowed Glycine 0 N--CA 1.477 1.38 0 CA-C-N 116.382 -0.372 . . . . 0.0 112.783 -176.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -73.19 -27.38 61.59 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.928 0.891 . . . . 0.0 111.773 177.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.62 108.76 2.55 Favored Glycine 0 C--N 1.354 1.577 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.618 174.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -139.65 170.46 15.86 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.874 0.87 . . . . 0.0 111.672 -174.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -114.29 150.3 34.64 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.627 0.771 . . . . 0.0 111.405 178.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -78.2 -12.57 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 123.9 0.88 . . . . 0.0 111.053 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 78.3 mt -84.63 -40.8 17.02 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.564 1.146 . . . . 0.0 111.981 -176.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.77 58.59 4.75 Favored Glycine 0 N--CA 1.481 1.678 0 CA-C-N 116.263 -0.426 . . . . 0.0 114.131 -177.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -157.18 -49.78 0.07 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.087 0.955 . . . . 0.0 110.778 -178.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -77.37 158.78 29.93 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.513 0.725 . . . . 0.0 111.611 -178.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.4 mp -79.29 132.02 36.33 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.413 0.685 . . . . 0.0 110.961 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -65.87 -31.1 71.85 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.768 0.827 . . . . 0.0 112.682 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.421 HG22 ' H ' ' A' ' 16' ' ' CYS . 7.2 p -138.09 139.1 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 124.193 0.997 . . . . 0.0 110.746 -175.21 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 51.1 t -99.52 -16.55 18.26 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.287 0.635 . . . . 0.0 111.847 177.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.421 ' H ' HG22 ' A' ' 14' ' ' VAL . 49.8 t -74.48 77.15 1.93 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-O 121.521 0.676 . . . . 0.0 112.336 -176.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.0 m -116.8 -66.85 1.04 Allowed 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 168.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.57 -48.15 0.47 Allowed Pre-proline 0 CA--C 1.57 1.724 0 CA-C-O 118.605 -0.712 . . . . 0.0 111.802 173.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -82.24 172.71 11.45 Favored 'Trans proline' 0 C--N 1.392 2.844 0 C-N-CA 122.127 1.884 . . . . 0.0 113.236 173.24 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 42.0 mtt -105.45 90.94 3.57 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.146 0.979 . . . . 0.0 109.026 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 56.5 p -107.87 79.23 1.26 Allowed 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.696 0.76 . . . . 0.0 110.569 -177.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 69.59 -145.51 42.24 Favored Glycine 0 C--N 1.355 1.632 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.875 -171.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.456 ' HE3' ' HB2' ' A' ' 124' ' ' GLU . 20.5 m0 -111.4 -64.98 1.22 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 167.089 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -174.97 87.83 0.04 OUTLIER 'General case' 0 C--N 1.36 1.058 0 C-N-CA 123.659 0.784 . . . . 0.0 110.482 174.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.497 ' NH2' HG11 ' A' ' 122' ' ' VAL . 37.1 ttm105 -125.93 -71.75 0.68 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.298 0.639 . . . . 0.0 110.41 174.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -93.79 1.57 56.44 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.11 0.564 . . . . 0.0 110.873 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.41 -50.84 4.41 Favored Glycine 0 C--N 1.356 1.668 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.937 -175.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -148.05 152.99 38.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.185 0.994 . . . . 0.0 110.814 177.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.1 m 66.78 161.72 0.16 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 168.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -170.02 21.62 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 115.25 -0.887 . . . . 0.0 112.196 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.4 t -155.47 155.74 34.03 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -85.12 -14.24 47.71 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.626 1.171 . . . . 0.0 112.072 175.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.1 t 71.83 -66.2 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 C-N-CA 124.958 1.303 . . . . 0.0 111.535 -175.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -80.85 105.58 12.19 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.519 0.728 . . . . 0.0 110.487 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -118.55 -9.9 10.19 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.149 0.98 . . . . 0.0 113.241 -176.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 76.12 -30.09 0.18 Allowed 'General case' 0 N--CA 1.501 2.123 0 C-N-CA 125.334 1.454 . . . . 0.0 114.246 -177.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -93.77 -0.13 66.86 Favored Glycine 0 CA--C 1.54 1.651 0 CA-C-O 119.147 -0.807 . . . . 0.0 114.321 -177.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.7 p 71.15 -5.67 1.49 Allowed 'General case' 0 N--CA 1.512 2.631 0 C-N-CA 126.378 1.871 . . . . 0.0 113.705 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 p-80 -148.65 99.99 3.06 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.654 0.782 . . . . 0.0 109.786 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.7 t -96.2 116.51 29.12 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.555 0.742 . . . . 0.0 111.235 -175.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.459 HG21 ' HB2' ' A' ' 82' ' ' ALA . 48.2 t -139.75 106.18 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.549 0.74 . . . . 0.0 109.871 -179.132 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 76.2 m -95.8 105.93 18.0 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.527 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -144.97 150.54 37.12 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.232 1.013 . . . . 0.0 108.793 -179.419 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -122.84 119.03 29.35 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 117.938 0.335 . . . . 0.0 110.632 -176.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 56.9 mtp -109.93 158.01 18.66 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.931 0.893 . . . . 0.0 111.274 178.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.41 ' OG1' ' HG2' ' A' ' 48' ' ' GLU . 25.6 p -96.86 158.85 15.23 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.971 0.908 . . . . 0.0 111.073 -177.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.594 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 23.7 tt0 -62.75 -29.12 70.45 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.973 -178.173 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.41 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 12.3 pt-20 -52.34 -45.41 65.65 Favored 'General case' 0 CA--C 1.565 1.548 0 C-N-CA 123.45 0.7 . . . . 0.0 112.73 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -79.38 -37.79 36.46 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 173.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.1 -20.16 64.91 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.73 -0.607 . . . . 0.0 111.616 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.594 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 76.4 mt -73.46 -30.74 63.37 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.536 1.134 . . . . 0.0 110.939 168.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.533 ' HE2' ' SD ' ' A' ' 93' ' ' MET . 13.7 m-85 -64.49 -47.65 78.15 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 118.319 0.509 . . . . 0.0 110.783 169.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.2 t -55.42 -35.19 65.12 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.43 0.633 . . . . 0.0 111.577 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.527 HH11 HD22 ' A' ' 51' ' ' LEU . 25.6 ttt180 -71.67 -60.15 2.38 Favored 'General case' 0 CA--C 1.564 1.516 0 C-N-CA 124.032 0.933 . . . . 0.0 112.016 173.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -85.19 -4.9 59.32 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.677 0.791 . . . . 0.0 112.273 -163.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -111.91 -24.68 9.83 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.467 0.707 . . . . 0.0 109.626 175.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -81.96 -112.28 0.41 Allowed Glycine 0 CA--C 1.538 1.505 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.849 176.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -130.47 20.58 5.19 Favored 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 123.909 0.883 . . . . 0.0 111.459 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.6 t70 67.74 157.33 0.13 Allowed 'General case' 0 CA--C 1.564 1.496 0 C-N-CA 125.008 1.323 . . . . 0.0 112.718 -175.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.446 ' H ' ' HG3' ' A' ' 54' ' ' ARG . 50.7 tp -154.68 -57.57 0.11 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.516 0.726 . . . . 0.0 110.314 178.33 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 66.8 mtm -101.34 92.04 4.76 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.489 0.715 . . . . 0.0 111.986 -171.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.9 p -134.01 163.34 51.89 Favored Pre-proline 0 N--CA 1.495 1.796 0 C-N-CA 124.334 1.054 . . . . 0.0 110.871 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -61.89 85.88 0.1 OUTLIER 'Trans proline' 0 C--N 1.392 2.852 0 C-N-CA 122.612 2.208 . . . . 0.0 112.214 172.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -129.17 153.95 80.46 Favored Pre-proline 0 N--CA 1.48 1.044 0 C-N-CA 124.945 1.298 . . . . 0.0 110.376 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.26 -53.28 2.03 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.435 2.09 . . . . 0.0 111.307 169.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 64.17 153.36 0.05 Allowed 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 125.767 1.627 . . . . 0.0 114.039 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -97.97 -84.54 0.38 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.25 0.62 . . . . 0.0 112.119 -177.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -157.96 99.97 1.7 Allowed 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 121.251 0.548 . . . . 0.0 110.635 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -128.76 98.46 24.72 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 123.923 0.889 . . . . 0.0 109.047 174.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -84.54 -171.41 1.0 Allowed 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.959 2.439 . . . . 0.0 113.805 178.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 104.0 -157.86 17.09 Favored Glycine 0 N--CA 1.479 1.528 0 N-CA-C 114.345 0.498 . . . . 0.0 114.345 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.71 117.96 13.94 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.168 0.987 . . . . 0.0 111.052 -177.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -113.63 -53.8 2.66 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.539 0.736 . . . . 0.0 110.733 179.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 170.41 137.45 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 126.436 1.894 . . . . 0.0 109.634 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 68.87 26.33 74.69 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 116.69 -0.232 . . . . 0.0 113.118 -174.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -110.1 115.47 29.81 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.791 0.836 . . . . 0.0 110.065 176.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -99.17 84.89 3.11 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 171.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -158.76 116.63 2.88 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.244 0.618 . . . . 0.0 109.798 -175.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.0 t 43.84 33.86 0.8 Allowed 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 124.462 1.105 . . . . 0.0 113.218 175.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.527 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -62.85 123.42 18.44 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.97 0.908 . . . . 0.0 109.968 -174.421 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 63.0 m -62.6 105.44 0.64 Allowed 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.459 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -55.59 -26.05 41.71 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.208 1.003 . . . . 0.0 112.692 -177.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 65.2 m -58.87 -42.26 89.04 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.687 0.795 . . . . 0.0 112.474 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.7 mmt85 -69.68 -40.56 76.3 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.671 0.788 . . . . 0.0 112.04 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.619 ' HE1' HD23 ' A' ' 115' ' ' LEU . 15.9 t-105 -64.7 -54.14 36.37 Favored 'General case' 0 CA--C 1.559 1.296 0 C-N-CA 122.535 0.334 . . . . 0.0 110.162 175.502 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.744 ' HB2' HG12 ' A' ' 110' ' ' VAL . 29.5 tp60 -48.85 -43.64 38.9 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.906 0.882 . . . . 0.0 112.718 174.185 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -67.46 -33.48 75.21 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.839 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.22 -37.05 82.94 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 122.836 0.454 . . . . 0.0 111.361 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.647 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 81.5 t80 -58.13 -52.13 66.81 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.55 170.215 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -66.13 -23.97 66.59 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.749 0.819 . . . . 0.0 112.392 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.12 -5.89 59.32 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.783 0.833 . . . . 0.0 112.516 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.67 10.68 72.55 Favored Glycine 0 CA--C 1.538 1.496 0 N-CA-C 114.249 0.46 . . . . 0.0 114.249 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' MET . . . . . 0.533 ' SD ' ' HE2' ' A' ' 52' ' ' PHE . 97.2 mmm -97.98 -75.39 0.55 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.649 0.78 . . . . 0.0 110.902 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.647 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 53.95 82.85 0.24 Allowed Pre-proline 0 CA--C 1.565 1.553 0 C-N-CA 125.0 1.32 . . . . 0.0 113.494 -178.251 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -56.89 160.15 12.94 Favored 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.677 2.918 . . . . 0.0 114.557 170.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -63.79 106.32 0.62 Allowed 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 122.776 2.318 . . . . 0.0 113.234 174.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 10.6 p -96.05 154.25 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 C-N-CA 123.481 0.712 . . . . 0.0 110.261 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.562 HG21 ' HB3' ' A' ' 101' ' ' SER . 27.7 m -73.1 141.98 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.446 0 C-N-CA 123.472 0.709 . . . . 0.0 111.864 173.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 73.1 mt -105.32 -8.62 18.12 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 123.265 0.626 . . . . 0.0 111.252 167.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.15 2.73 29.53 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.531 1.132 . . . . 0.0 112.312 -170.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.562 ' HB3' HG21 ' A' ' 98' ' ' VAL . 21.8 t -132.51 -51.64 0.93 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.884 0.874 . . . . 0.0 110.989 -179.066 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 98.3 m -38.11 123.6 1.13 Allowed 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 125.222 1.409 . . . . 0.0 113.87 -177.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -83.54 174.54 10.49 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.314 1.045 . . . . 0.0 113.419 -171.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -61.32 -38.74 87.95 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.402 1.081 . . . . 0.0 112.468 177.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 39.3 t -63.36 -28.12 69.78 Favored 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.805 -176.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.482 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -64.55 -47.14 79.88 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.15 0.58 . . . . 0.0 111.725 173.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.62 -15.78 13.11 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 124.369 1.068 . . . . 0.0 113.117 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -75.93 -39.27 56.5 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.503 0.721 . . . . 0.0 110.189 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -87.38 -36.31 17.85 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.696 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.744 HG12 ' HB2' ' A' ' 86' ' ' GLN . 26.8 m -97.55 -56.42 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 -176.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' SER . . . . . 0.408 ' N ' HG23 ' A' ' 110' ' ' VAL . 38.4 t 83.67 134.11 0.05 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 125.924 1.689 . . . . 0.0 110.579 -151.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.655 ' HA ' HD12 ' A' ' 115' ' ' LEU . 1.7 tt -50.07 -30.64 11.31 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.281 1.032 . . . . 0.0 113.628 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.85 -36.11 71.86 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.179 0.592 . . . . 0.0 112.436 -178.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.65 -31.07 57.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.755 0.822 . . . . 0.0 110.637 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.655 HD12 ' HA ' ' A' ' 112' ' ' LEU . 56.9 mt -63.88 -56.18 17.25 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 123.879 0.872 . . . . 0.0 110.013 173.005 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -65.72 -28.72 69.26 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.074 0.95 . . . . 0.0 112.371 -175.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -49.17 -38.53 25.94 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -138.36 39.49 2.27 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-O 121.224 0.535 . . . . 0.0 111.818 178.183 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -114.59 -172.24 2.08 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.55 0.74 . . . . 0.0 111.094 170.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.3 pp -61.74 141.13 95.23 Favored Pre-proline 0 CA--C 1.564 1.493 0 C-N-CA 123.223 0.609 . . . . 0.0 112.298 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.82 128.96 16.73 Favored 'Trans proline' 0 C--N 1.371 1.758 0 C-N-CA 122.83 2.353 . . . . 0.0 111.884 172.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' VAL . . . . . 0.497 HG11 ' NH2' ' A' ' 25' ' ' ARG . 9.1 p -149.43 141.36 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 123.099 0.56 . . . . 0.0 110.974 -175.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.6 81.65 2.0 Allowed 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 122.206 1.003 . . . . 0.0 110.533 176.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.456 ' HB2' ' HE3' ' A' ' 23' ' ' TRP . 41.2 mt-10 -72.46 131.72 42.94 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.116 -178.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -76.31 121.37 22.88 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.944 0.497 . . . . 0.0 110.985 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 22.3 m80 -77.44 -25.03 50.24 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.709 0.804 . . . . 0.0 111.754 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 45.3 m80 59.55 -89.79 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 125.257 1.423 . . . . 0.0 111.537 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 25.5 t60 63.12 -75.7 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.711 1.605 . . . . 0.0 113.174 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 68.95 126.53 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 125.591 1.556 . . . . 0.0 110.759 -173.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 . . . . . 0 CA--C 1.568 1.654 0 C-N-CA 123.936 0.894 . . . . 0.0 110.674 -171.314 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.484 1.264 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.65 128.87 1.25 Allowed Glycine 0 C--N 1.35 1.344 0 CA-C-N 116.424 -0.353 . . . . 0.0 112.75 179.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -141.6 104.68 4.6 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.014 0.926 . . . . 0.0 109.884 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.07 114.91 4.18 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 116.63 -0.259 . . . . 0.0 113.377 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -134.09 126.75 30.74 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.041 0.537 . . . . 0.0 110.936 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -168.49 140.64 2.82 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.182 0.993 . . . . 0.0 110.029 176.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 20.0 t 67.18 -57.77 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.646 0 C-N-CA 126.361 1.865 . . . . 0.0 113.307 -176.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.2 pp -65.85 -5.53 9.37 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.319 1.448 . . . . 0.0 114.427 -179.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -59.39 -22.55 56.43 Favored Glycine 0 CA--C 1.543 1.828 0 N-CA-C 115.374 0.909 . . . . 0.0 115.374 -176.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.2 pm0 -153.0 165.07 36.73 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.548 0.739 . . . . 0.0 109.906 176.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -155.0 148.06 24.75 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.404 0.682 . . . . 0.0 111.48 -177.119 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 18.2 tp -142.67 12.84 1.91 Allowed 'General case' 0 CA--C 1.555 1.154 0 CA-C-O 121.596 0.713 . . . . 0.0 110.051 170.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -80.35 -53.06 6.97 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 121.026 0.441 . . . . 0.0 110.004 177.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.46 HG13 ' H ' ' A' ' 15' ' ' CYS . 5.6 p -116.71 -68.36 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.6 0 C-N-CA 123.141 0.576 . . . . 0.0 112.258 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.46 ' H ' HG13 ' A' ' 14' ' ' VAL . 83.3 m 47.91 51.42 14.4 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 124.216 1.006 . . . . 0.0 113.242 -174.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.4 t -76.63 130.72 38.21 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.288 177.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 53.4 t 69.02 -63.73 0.36 Allowed 'General case' 0 N--CA 1.497 1.903 0 C-N-CA 125.202 1.401 . . . . 0.0 112.791 179.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.89 159.94 37.16 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 124.518 1.127 . . . . 0.0 110.859 178.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -70.96 169.96 19.18 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.264 1.976 . . . . 0.0 112.075 166.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 83.2 mtp 66.44 14.79 9.88 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.576 1.15 . . . . 0.0 113.495 175.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 42.5 p -79.89 114.59 18.92 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 118.388 0.54 . . . . 0.0 110.52 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.0 -101.64 0.28 Allowed Glycine 0 CA--C 1.534 1.275 0 CA-C-N 116.734 -0.212 . . . . 0.0 112.586 178.209 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 56.5 p-90 -150.51 168.04 25.41 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.264 0.626 . . . . 0.0 111.242 178.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -166.07 -57.54 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.007 0.923 . . . . 0.0 109.425 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -118.35 -75.52 0.58 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.088 0.555 . . . . 0.0 111.605 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -123.37 91.19 3.43 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.341 0.657 . . . . 0.0 110.36 -171.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.52 -75.78 1.0 Allowed Glycine 0 N--CA 1.48 1.591 0 CA-C-N 116.524 -0.307 . . . . 0.0 113.266 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.433 ' HA ' HG11 ' A' ' 14' ' ' VAL . 45.4 p90 -73.53 -176.92 2.47 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.933 0.893 . . . . 0.0 111.828 174.699 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 64.3 m -72.99 -91.07 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.613 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.789 172.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -159.17 24.9 0.2 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.543 0.687 . . . . 0.0 111.172 -177.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.8 t -88.03 7.61 30.48 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.342 1.057 . . . . 0.0 113.109 -169.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -101.81 -76.75 0.56 Allowed 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.127 0.571 . . . . 0.0 110.515 178.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.4 p -147.16 -40.64 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 C-N-CA 124.127 0.971 . . . . 0.0 109.71 173.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 63.61 -77.01 0.03 OUTLIER 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 125.914 1.686 . . . . 0.0 112.005 -171.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -140.03 -175.41 4.22 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 124.236 1.014 . . . . 0.0 110.741 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -83.86 36.12 0.54 Allowed 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 123.56 0.744 . . . . 0.0 112.435 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -96.49 -128.72 5.86 Favored Glycine 0 C--N 1.35 1.325 0 O-C-N 122.094 -0.379 . . . . 0.0 113.75 -176.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 t -80.25 -11.32 59.74 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.614 0.766 . . . . 0.0 112.974 -175.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 70.1 m80 62.94 -163.38 0.27 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.479 1.112 . . . . 0.0 112.339 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.406 ' O ' ' HB2' ' A' ' 105' ' ' SER . 18.2 p -94.82 102.9 14.78 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-O 121.558 0.694 . . . . 0.0 110.966 -171.253 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.766 HG11 ' HB2' ' A' ' 82' ' ' ALA . 39.6 t -127.78 101.14 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.095 0.558 . . . . 0.0 109.831 174.429 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.5 m -111.38 106.59 15.57 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 171.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.427 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -139.32 150.67 45.65 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.36 1.064 . . . . 0.0 108.919 -176.454 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -116.62 108.54 16.07 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 122.065 -0.397 . . . . 0.0 110.584 -172.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.538 ' HB2' HD11 ' A' ' 50' ' ' LEU . 85.3 mmm -95.29 153.91 17.44 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.651 0.78 . . . . 0.0 111.024 177.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.411 ' OG1' ' HG2' ' A' ' 48' ' ' GLU . 73.0 p -90.94 156.47 17.96 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.898 0.879 . . . . 0.0 111.084 177.481 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.42 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 34.8 tt0 -62.7 -28.71 70.13 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.206 0.602 . . . . 0.0 112.146 -177.104 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.411 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 7.8 pt-20 -54.11 -38.05 64.97 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 122.825 0.45 . . . . 0.0 110.875 173.374 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.534 ' HB2' ' HG2' ' A' ' 95' ' ' PRO . 74.8 t80 -77.4 -45.59 25.4 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 123.658 0.783 . . . . 0.0 112.031 173.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' A' ' 45' ' ' MET . 9.0 mp -64.08 -41.12 97.42 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -174.171 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.42 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 88.6 mt -65.12 -31.33 72.48 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.768 0.427 . . . . 0.0 111.353 174.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -67.32 -44.07 80.05 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 123.647 0.779 . . . . 0.0 111.461 172.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 97.7 p -73.64 -30.39 62.92 Favored 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 123.499 0.72 . . . . 0.0 111.68 -179.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.545 ' HA ' HD12 ' A' ' 60' ' ' LEU . 8.2 mpt_? -67.73 -47.25 69.84 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.937 0.895 . . . . 0.0 110.569 174.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -69.57 -28.12 65.71 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 124.103 0.961 . . . . 0.0 111.536 176.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -58.01 -45.25 87.19 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.534 1.133 . . . . 0.0 110.566 175.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.43 -72.8 1.27 Allowed Glycine 0 CA--C 1.536 1.357 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.389 175.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 59.4 t30 -162.74 -72.61 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.297 0.639 . . . . 0.0 110.512 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -141.58 -51.43 0.42 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.316 0.647 . . . . 0.0 111.071 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 54' ' ' ARG . 87.5 mt 66.68 -21.91 0.1 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 116.302 1.964 . . . . 0.0 116.302 170.293 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -158.06 -48.53 0.06 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 119.321 0.964 . . . . 0.0 112.215 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 85.4 m 65.28 133.26 0.04 OUTLIER Pre-proline 0 N--CA 1.496 1.858 0 C-N-CA 124.152 0.981 . . . . 0.0 112.763 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -59.06 104.77 0.21 Allowed 'Trans proline' 0 C--N 1.386 2.513 0 C-N-CA 122.547 2.165 . . . . 0.0 111.581 170.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 44.7 ttt180 -150.91 141.98 15.07 Favored Pre-proline 0 CA--C 1.562 1.404 0 C-N-CA 123.318 0.647 . . . . 0.0 110.293 -171.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -74.03 14.3 0.72 Allowed 'Trans proline' 0 C--N 1.386 2.518 0 C-N-CA 122.988 2.459 . . . . 0.0 115.219 -177.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -107.55 149.36 28.09 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.6 0.76 . . . . 0.0 111.957 -177.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -91.02 20.65 4.74 Favored 'General case' 0 CA--C 1.565 1.521 0 C-N-CA 124.502 1.121 . . . . 0.0 111.159 -178.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -64.98 -18.93 65.71 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.639 0.776 . . . . 0.0 112.874 -175.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -123.07 94.29 47.32 Favored Pre-proline 0 N--CA 1.488 1.439 0 C-N-CA 123.815 0.846 . . . . 0.0 111.119 -178.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -93.97 26.87 0.33 Allowed 'Trans proline' 0 CA--C 1.56 1.816 0 C-N-CA 123.19 2.593 . . . . 0.0 112.699 170.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -87.7 64.82 3.64 Favored Glycine 0 C--N 1.352 1.446 0 N-CA-C 114.121 0.409 . . . . 0.0 114.121 -174.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 58.93 99.94 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.734 1.214 . . . . 0.0 113.305 176.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.8 pttt -96.53 170.42 9.23 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.228 0.611 . . . . 0.0 109.857 174.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.61 113.53 3.04 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.004 0.522 . . . . 0.0 110.941 176.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 116.54 -11.17 16.27 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 116.193 -0.458 . . . . 0.0 113.668 -175.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -85.21 97.34 9.86 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 117.242 0.521 . . . . 0.0 110.59 175.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.534 ' HD2' HG21 ' A' ' 98' ' ' VAL . 44.8 ttp180 -96.66 84.12 3.58 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -174.95 120.7 0.21 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 125.873 1.669 . . . . 0.0 108.075 -174.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 36.2 m 59.47 27.99 17.26 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.511 0.724 . . . . 0.0 112.888 173.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.427 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -67.78 135.76 53.14 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 123.817 0.847 . . . . 0.0 110.559 -177.4 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.2 m -66.51 95.26 0.32 Allowed 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.845 0.858 . . . . 0.0 111.083 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.766 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -60.23 -29.42 68.74 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.847 0.859 . . . . 0.0 113.163 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.7 m -56.45 -35.21 67.62 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.553 0.741 . . . . 0.0 112.184 175.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -73.62 -41.56 62.64 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.136 0.974 . . . . 0.0 111.472 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 3.0 t-105 -66.54 -48.59 69.22 Favored 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 122.816 0.446 . . . . 0.0 110.366 176.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.56 ' HB2' HG12 ' A' ' 110' ' ' VAL . 11.0 tp60 -49.43 -43.28 44.61 Favored 'General case' 0 CA--C 1.564 1.481 0 C-N-CA 124.052 0.941 . . . . 0.0 111.885 169.168 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.11 -47.27 85.89 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.949 0.5 . . . . 0.0 111.765 175.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.05 -39.34 74.68 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -173.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.497 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 49.7 t80 -72.18 -45.06 61.92 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.354 0.261 . . . . 0.0 111.495 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -71.71 -21.59 61.75 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.253 0.621 . . . . 0.0 112.173 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.29 -24.59 29.81 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.036 0.934 . . . . 0.0 111.216 175.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.62 42.42 7.81 Favored Glycine 0 C--N 1.349 1.281 0 CA-C-N 116.418 -0.355 . . . . 0.0 113.474 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -142.05 12.54 2.02 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.032 0.933 . . . . 0.0 111.33 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.497 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -50.66 114.08 4.29 Favored Pre-proline 0 CA--C 1.566 1.586 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -176.028 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.534 ' HG2' ' HB2' ' A' ' 49' ' ' PHE . 12.0 Cg_exo -74.92 177.04 9.09 Favored 'Trans proline' 0 CA--C 1.57 2.296 0 C-N-CA 123.978 3.119 . . . . 0.0 112.651 170.165 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.479 ' HA ' ' HB3' ' A' ' 118' ' ' HIS . 65.5 Cg_endo -70.55 152.59 65.32 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.178 1.919 . . . . 0.0 113.715 174.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 14.9 p -138.1 167.68 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 124.294 1.038 . . . . 0.0 109.461 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.534 HG21 ' HD2' ' A' ' 77' ' ' ARG . 16.6 m -90.7 135.69 25.96 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 123.159 0.584 . . . . 0.0 111.231 169.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 12.5 mt -90.9 -36.9 13.89 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.598 0.713 . . . . 0.0 109.532 161.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -78.99 13.57 1.71 Allowed 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 125.093 1.357 . . . . 0.0 113.671 -171.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.477 ' HB3' HG21 ' A' ' 98' ' ' VAL . 46.3 t -147.01 -39.82 0.2 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.124 0.569 . . . . 0.0 111.279 179.59 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.7 m -61.78 130.14 44.32 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 122.697 0.399 . . . . 0.0 111.248 174.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -75.81 161.41 29.04 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.061 0.545 . . . . 0.0 111.957 -177.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.409 ' HA ' HD13 ' A' ' 107' ' ' LEU . 13.8 mptt -70.97 -17.5 62.65 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.532 0.733 . . . . 0.0 112.126 178.142 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' A' ' 40' ' ' THR . 49.6 m -60.82 -26.94 67.69 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.269 0.628 . . . . 0.0 111.938 174.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.431 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -61.72 -32.56 72.79 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.729 0.811 . . . . 0.0 112.587 176.14 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.5 mp -62.75 1.86 0.35 Allowed 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 125.027 1.331 . . . . 0.0 114.534 -174.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -96.12 -28.81 14.42 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.397 0.679 . . . . 0.0 110.214 177.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -97.64 -43.8 7.05 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.139 1.375 . . . . 0.0 109.139 -177.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.78 HG21 HD21 ' A' ' 115' ' ' LEU . 35.5 m -93.39 -171.25 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 122.087 0.946 . . . . 0.0 110.646 163.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 44.7 t -115.39 154.29 29.48 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 114.549 -1.205 . . . . 0.0 108.566 155.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.0 tt -48.8 -36.02 15.73 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.762 0.825 . . . . 0.0 111.513 170.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.64 74.63 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 123.937 0.895 . . . . 0.0 113.388 -177.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.72 -42.38 91.17 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.373 0.606 . . . . 0.0 110.463 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.78 HD21 HG21 ' A' ' 110' ' ' VAL . 6.4 mt -66.36 -52.43 46.98 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.791 -178.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -70.38 -25.11 63.1 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.173 0.989 . . . . 0.0 112.505 -174.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.78 -26.26 67.13 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 170.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' HIS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 96' ' ' PRO . 78.0 m80 -132.54 26.68 4.41 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.76 0.824 . . . . 0.0 112.16 -177.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -166.68 155.8 10.84 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.125 0.97 . . . . 0.0 110.387 176.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.507 HD11 HD11 ' A' ' 123' ' ' LEU . 2.4 pt? -140.58 161.57 53.88 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 122.875 0.47 . . . . 0.0 110.79 175.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -49.68 139.09 31.9 Favored 'Trans proline' 0 C--N 1.378 2.088 0 C-N-CA 123.317 2.678 . . . . 0.0 113.265 165.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 9.9 p -65.48 126.53 24.78 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.339 0 CA-C-O 121.252 0.548 . . . . 0.0 110.049 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.507 HD11 HD11 ' A' ' 120' ' ' LEU . 5.3 mp -72.93 100.74 3.01 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.733 0.813 . . . . 0.0 112.069 -163.297 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.03 -21.13 12.14 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.074 0.949 . . . . 0.0 111.544 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -128.21 178.98 5.86 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.619 0.767 . . . . 0.0 111.844 173.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 55.3 t60 -72.93 134.06 44.6 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.096 0.958 . . . . 0.0 112.746 -171.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -121.93 171.17 9.12 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.611 1.165 . . . . 0.0 108.665 166.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 66.97 98.99 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.305 1.042 . . . . 0.0 111.203 -174.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -160.69 167.06 27.71 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.051 0.94 . . . . 0.0 110.92 -176.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 . . . . . 0 CA--C 1.564 1.499 0 C-N-CA 123.24 0.616 . . . . 0.0 110.606 176.793 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -74.3 107.48 2.28 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 120.178 -0.235 . . . . 0.0 112.903 176.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -72.3 115.55 11.68 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.199 0.599 . . . . 0.0 110.394 176.184 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.57 108.87 3.09 Favored Glycine 0 C--N 1.347 1.191 0 O-C-N 123.187 0.304 . . . . 0.0 112.934 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -90.24 143.6 26.62 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -153.27 121.16 6.06 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.631 0.372 . . . . 0.0 111.767 -174.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.9 t 52.67 20.22 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.897 0 C-N-CA 126.176 1.79 . . . . 0.0 114.117 173.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -71.41 -18.86 62.32 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.154 0.981 . . . . 0.0 113.128 -178.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 161.29 89.71 0.07 OUTLIER Glycine 0 CA--C 1.53 0.987 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -156.61 -48.49 0.07 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.626 0.77 . . . . 0.0 111.765 -171.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -86.19 -171.27 3.48 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.579 0.751 . . . . 0.0 109.542 -176.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.3 mp -80.48 71.07 7.3 Favored 'General case' 0 CA--C 1.555 1.14 0 O-C-N 121.173 -0.954 . . . . 0.0 110.348 174.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -59.86 -47.36 86.06 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.321 0.648 . . . . 0.0 109.472 169.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.1 p -148.17 141.8 18.99 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.953 0.901 . . . . 0.0 109.317 169.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.647 ' HA ' ' HD2' ' A' ' 28' ' ' PHE . 42.0 t -147.32 122.46 10.17 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.236 0.614 . . . . 0.0 111.061 -177.494 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.476 ' HB2' ' HB3' ' A' ' 26' ' ' ASN . 29.9 p -84.76 144.95 28.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.424 0.69 . . . . 0.0 111.753 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.0 m -69.44 -15.59 63.31 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.073 0.549 . . . . 0.0 112.121 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.05 127.99 93.54 Favored Pre-proline 0 CA--C 1.558 1.274 0 C-N-CA 123.575 0.75 . . . . 0.0 111.768 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -53.19 155.16 12.49 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 123.675 2.917 . . . . 0.0 114.198 176.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 85.4 mtp 63.03 46.95 4.45 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.34 1.056 . . . . 0.0 111.846 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.0 p -51.9 96.51 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 123.738 0.815 . . . . 0.0 112.433 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.402 ' H ' ' HG3' ' A' ' 25' ' ' ARG . . . -158.87 -101.92 0.18 Allowed Glycine 0 C--N 1.347 1.148 0 CA-C-N 116.316 -0.402 . . . . 0.0 112.642 -176.377 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.9 t90 -70.56 93.24 0.89 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.71 0.804 . . . . 0.0 111.389 -176.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 61.66 -76.44 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.417 1.487 . . . . 0.0 112.742 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.402 ' HG3' ' H ' ' A' ' 22' ' ' GLY . 1.7 mmp_? 69.2 -76.13 0.06 Allowed 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 125.016 1.326 . . . . 0.0 112.896 175.032 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.476 ' HB3' ' HB2' ' A' ' 16' ' ' CYS . 5.0 t30 -155.16 10.48 0.32 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.658 0.783 . . . . 0.0 109.893 177.136 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 129.58 64.38 0.11 Allowed Glycine 0 C--N 1.351 1.386 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.774 -175.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.647 ' HD2' ' HA ' ' A' ' 15' ' ' CYS . 41.5 t80 -145.52 138.78 26.31 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.656 0.782 . . . . 0.0 109.048 174.09 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.0 t -154.11 -35.76 0.1 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.126 0.57 . . . . 0.0 110.8 171.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 60.53 29.46 19.03 Favored 'General case' 0 N--CA 1.501 2.115 0 CA-C-O 123.013 1.387 . . . . 0.0 112.412 172.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.9 t -135.88 16.67 3.29 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 122.392 1.091 . . . . 0.0 109.05 171.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -88.38 145.85 25.58 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 113.923 -1.49 . . . . 0.0 108.87 -177.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.411 HG21 ' SG ' ' A' ' 79' ' ' CYS . 48.5 t -86.43 74.4 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.171 0 CA-C-O 121.123 0.487 . . . . 0.0 111.127 -176.298 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 64.03 -65.99 0.12 Allowed 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 126.113 1.765 . . . . 0.0 115.354 166.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -52.38 148.43 6.74 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 124.726 1.211 . . . . 0.0 114.084 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.757 ' H ' ' HD3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -86.74 118.37 26.1 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.905 0.882 . . . . 0.0 111.154 -177.174 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 129.13 -168.68 20.73 Favored Glycine 0 N--CA 1.477 1.411 0 CA-C-N 116.113 -0.494 . . . . 0.0 113.46 177.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.1 m 61.65 -172.39 0.15 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.477 1.111 . . . . 0.0 112.456 -179.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -126.3 174.62 8.43 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.939 0.896 . . . . 0.0 109.911 171.11 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.2 m -93.11 105.9 17.93 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.038 0.447 . . . . 0.0 110.742 -172.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.9 t -125.62 122.8 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.708 0.803 . . . . 0.0 110.448 176.276 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 79.4 m -121.08 107.29 12.44 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 168.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.5 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -136.18 142.89 44.17 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.147 0.979 . . . . 0.0 108.645 179.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.452 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 17.4 tt0 -122.02 110.02 15.3 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.808 0.337 . . . . 0.0 110.548 -171.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.617 ' HB2' HD11 ' A' ' 50' ' ' LEU . 42.7 mmm -89.56 136.02 33.27 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.803 0.841 . . . . 0.0 109.157 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 14.7 t -82.23 159.98 23.1 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 176.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.471 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 31.7 tt0 -54.57 -32.07 57.82 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.364 0.666 . . . . 0.0 112.601 -172.412 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -57.29 -37.55 72.6 Favored 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -175.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -76.01 -39.83 54.91 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.617 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.3 mp -68.41 -25.02 64.83 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 120.97 0.414 . . . . 0.0 110.765 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.471 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 94.1 mt -74.98 -44.75 46.48 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.483 1.113 . . . . 0.0 109.835 170.337 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -55.99 -39.53 71.98 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.915 0.486 . . . . 0.0 111.006 174.074 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.0 t -66.1 -42.21 89.56 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.741 0.816 . . . . 0.0 111.892 -176.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.522 ' HB2' ' HA ' ' A' ' 59' ' ' ASP . 7.8 ptm180 -77.68 -47.66 18.65 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 179.547 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -69.46 -19.09 63.77 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.169 0.988 . . . . 0.0 113.012 -176.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -69.97 -32.57 70.86 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 122.701 0.4 . . . . 0.0 111.499 176.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -119.34 -81.89 0.75 Allowed Glycine 0 C--N 1.352 1.453 0 CA-C-N 116.655 -0.248 . . . . 0.0 113.543 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -138.06 -79.9 0.35 Allowed 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 124.028 0.931 . . . . 0.0 110.528 -179.281 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.522 ' HA ' ' HB2' ' A' ' 54' ' ' ARG . 6.9 p-10 -167.91 121.34 0.92 Allowed 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 123.94 0.896 . . . . 0.0 110.593 175.118 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 94.2 mt -110.75 -65.6 1.15 Allowed 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.857 0.863 . . . . 0.0 110.337 174.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 44.3 ttp -80.5 91.02 5.7 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-O 121.049 0.452 . . . . 0.0 109.834 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.467 HG21 ' HB2' ' A' ' 59' ' ' ASP . 4.7 p -145.65 163.29 32.25 Favored Pre-proline 0 N--CA 1.49 1.533 0 C-N-CA 124.609 1.164 . . . . 0.0 110.409 -178.425 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -60.89 86.4 0.08 OUTLIER 'Trans proline' 0 C--N 1.39 2.734 0 C-N-CA 123.015 2.477 . . . . 0.0 112.434 173.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.645 ' HB3' ' HB2' ' A' ' 67' ' ' PHE . 27.0 mmt180 -122.08 74.47 38.69 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 124.425 1.09 . . . . 0.0 109.383 178.155 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.87 -33.87 9.44 Favored 'Trans proline' 0 C--N 1.371 1.746 0 C-N-CA 122.406 2.071 . . . . 0.0 113.358 -169.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -97.09 -5.44 37.4 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.089 0.955 . . . . 0.0 111.783 -178.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.645 ' HB2' ' HB3' ' A' ' 64' ' ' ARG . 59.6 m-85 -108.87 -30.79 7.95 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.753 0.821 . . . . 0.0 111.115 -176.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -154.27 96.53 1.94 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.86 0.864 . . . . 0.0 109.934 -175.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.403 ' HB3' ' HD3' ' A' ' 70' ' ' PRO . 85.7 t80 -74.56 -49.68 4.83 Favored Pre-proline 0 CA--C 1.573 1.856 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.644 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.403 ' HD3' ' HB3' ' A' ' 69' ' ' PHE . 33.6 Cg_endo -91.57 -93.95 0.0 OUTLIER 'Trans proline' 0 C--N 1.394 2.963 0 C-N-CA 122.219 1.946 . . . . 0.0 112.259 173.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 72.74 -9.35 6.36 Favored Glycine 0 C--N 1.358 1.788 0 N-CA-C 115.537 0.975 . . . . 0.0 115.537 179.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 72' ' ' LEU . 4.2 mm? 64.63 108.91 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 125.048 1.339 . . . . 0.0 112.609 -174.14 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.05 167.71 11.06 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 173.091 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.67 125.69 24.65 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.407 0.683 . . . . 0.0 112.344 -176.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 99.8 2.28 56.23 Favored Glycine 0 CA--C 1.537 1.465 0 N-CA-C 114.738 0.655 . . . . 0.0 114.738 -177.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -97.14 109.27 22.06 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 117.96 0.88 . . . . 0.0 111.834 173.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.452 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 27.6 ptt-85 -90.95 87.84 6.78 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-O 122.079 0.943 . . . . 0.0 109.482 168.287 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -166.75 118.67 0.97 Allowed 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.67 -167.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.411 ' SG ' HG21 ' A' ' 33' ' ' VAL . 73.5 m 50.03 22.47 0.91 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 178.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.5 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -59.08 -31.03 68.51 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.823 0.849 . . . . 0.0 112.103 -169.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 42.4 t 67.11 113.53 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.685 1.194 . . . . 0.0 110.613 -172.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.86 -29.42 66.95 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -172.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.7 t -63.69 -33.23 75.18 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.466 0.706 . . . . 0.0 112.417 177.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -66.09 -41.83 90.13 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.624 0.769 . . . . 0.0 111.406 177.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.511 ' NE1' HD23 ' A' ' 115' ' ' LEU . 1.5 t-105 -69.26 -49.34 56.99 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 123.107 0.563 . . . . 0.0 110.822 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -52.98 -41.79 64.92 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.783 0.833 . . . . 0.0 111.397 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -64.12 -24.57 67.74 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.596 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.43 82.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.086 0.555 . . . . 0.0 111.477 176.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -65.03 -43.59 91.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.197 0.599 . . . . 0.0 110.552 173.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -68.0 -22.64 64.99 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.95 0.9 . . . . 0.0 111.665 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.6 -3.68 56.49 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.916 0.886 . . . . 0.0 112.206 173.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.03 41.2 23.05 Favored Glycine 0 C--N 1.352 1.444 0 C-N-CA 122.937 0.303 . . . . 0.0 113.25 -178.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 1.8 mmt -130.19 -78.02 0.54 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.501 0.721 . . . . 0.0 110.879 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.74 94.39 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.262 0 C-N-CA 124.624 1.169 . . . . 0.0 112.69 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -74.27 158.02 45.3 Favored 'Trans proline' 0 CA--C 1.567 2.13 0 C-N-CA 122.533 2.155 . . . . 0.0 112.663 170.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -59.6 111.42 0.94 Allowed 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 122.295 1.997 . . . . 0.0 113.1 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 6.6 p -95.07 149.49 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.41 0 C-N-CA 123.914 0.886 . . . . 0.0 111.318 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.5 p -80.32 91.79 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.865 0 CA-C-O 122.259 1.028 . . . . 0.0 113.036 -173.188 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.455 HD21 ' HB3' ' A' ' 115' ' ' LEU . 3.4 mm? -70.48 -22.08 62.7 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -178.326 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -73.91 -17.61 61.01 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 71.6 m -124.92 -4.78 7.51 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 96.7 m -71.0 126.42 29.53 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.422 0.556 . . . . 0.0 111.388 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -85.38 157.74 20.43 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.549 0.74 . . . . 0.0 111.712 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -58.07 -31.83 67.45 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.804 1.242 . . . . 0.0 113.488 -176.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 73.4 m -60.87 -29.13 69.36 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.2 70.74 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.312 0.645 . . . . 0.0 112.611 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.18 -24.68 65.9 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.834 0.854 . . . . 0.0 111.995 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -68.42 -18.14 64.37 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.928 0.491 . . . . 0.0 111.678 178.512 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -102.81 -53.07 2.93 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.101 0.96 . . . . 0.0 110.803 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.723 HG23 ' HB3' ' A' ' 114' ' ' ASP . 0.9 OUTLIER -99.34 -37.22 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 C-N-CA 122.625 0.37 . . . . 0.0 111.901 -172.481 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.1 t 73.25 134.37 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 125.135 1.522 . . . . 0.0 110.817 -166.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' A' ' 115' ' ' LEU . 5.5 tt -45.88 -29.46 1.39 Allowed 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -175.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.62 -34.84 74.83 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.731 0.412 . . . . 0.0 112.07 -179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.723 ' HB3' HG23 ' A' ' 110' ' ' VAL . 27.7 t70 -73.74 -40.44 63.53 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.568 0.747 . . . . 0.0 111.073 177.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.593 HD12 ' HA ' ' A' ' 112' ' ' LEU . 82.1 mt -54.93 -51.84 64.84 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.205 1.002 . . . . 0.0 111.36 173.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -75.34 -22.79 57.34 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.29 -1.323 . . . . 0.0 112.492 -176.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.23 -19.4 5.17 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 172.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -138.76 21.01 2.68 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 174.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -142.55 -172.82 3.71 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.772 -0.58 . . . . 0.0 111.329 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.421 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 4.0 pp -63.47 149.84 91.15 Favored Pre-proline 0 CA--C 1.562 1.421 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -177.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 120' ' ' LEU . 4.6 Cg_exo -77.56 149.41 27.05 Favored 'Trans proline' 0 C--N 1.379 2.156 0 C-N-CA 122.586 2.191 . . . . 0.0 112.444 174.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 8.7 p -100.98 120.18 50.15 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 CA-C-O 121.504 0.669 . . . . 0.0 109.652 171.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 49.3 tp -108.05 125.66 51.82 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.472 0.709 . . . . 0.0 110.018 176.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -83.74 162.63 20.61 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-O 121.296 0.569 . . . . 0.0 111.24 174.115 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -88.1 -66.31 0.93 Allowed 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 167.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -144.41 152.17 40.29 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.412 1.085 . . . . 0.0 108.706 171.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -63.52 -73.85 0.11 Allowed 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 121.177 0.513 . . . . 0.0 110.177 174.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -170.11 60.88 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.174 1.39 . . . . 0.0 108.484 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 67.5 m80 58.63 -93.29 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.071 1.348 . . . . 0.0 111.903 -170.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 . . . . . 0 CA--C 1.572 1.827 0 C-N-CA 124.697 1.199 . . . . 0.0 112.261 -175.179 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 120.482 0.182 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.1 -140.08 3.87 Favored Glycine 0 C--N 1.344 0.981 0 N-CA-C 112.028 -0.429 . . . . 0.0 112.028 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -94.91 89.38 5.61 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 117.996 0.898 . . . . 0.0 111.453 179.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -98.88 -153.76 28.41 Favored Glycine 0 N--CA 1.473 1.13 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 167.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -95.37 117.58 30.59 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 117.826 0.813 . . . . 0.0 109.973 174.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.5 p-10 -135.69 98.69 3.98 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.588 -178.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.8 t 61.13 -0.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.584 2.278 0 C-N-CA 125.891 1.677 . . . . 0.0 114.062 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.408 ' H ' ' HG ' ' A' ' 8' ' ' LEU . 3.5 pp -89.1 5.06 46.26 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.928 0.891 . . . . 0.0 112.79 -174.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.79 -110.34 0.3 Allowed Glycine 0 CA--C 1.532 1.123 0 N-CA-C 111.773 -0.531 . . . . 0.0 111.773 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -142.41 123.39 14.45 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.751 0.821 . . . . 0.0 110.287 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -175.93 137.18 0.32 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.945 0.898 . . . . 0.0 110.248 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 63.91 -83.05 0.03 OUTLIER 'General case' 0 CA--C 1.568 1.652 0 C-N-CA 124.656 1.182 . . . . 0.0 110.484 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 52.2 94.78 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 125.22 1.408 . . . . 0.0 113.27 176.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 14.4 p -137.82 168.4 20.64 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.357 0 C-N-CA 123.54 0.736 . . . . 0.0 111.913 -164.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 45.9 t -69.34 -13.87 62.61 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.687 1.195 . . . . 0.0 112.424 172.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.9 t 82.96 131.26 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 126.409 1.884 . . . . 0.0 112.011 177.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.564 ' HB3' HG23 ' A' ' 21' ' ' THR . 39.8 t -171.6 -48.04 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.753 1.221 . . . . 0.0 109.344 -175.026 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -155.44 160.62 30.71 Favored Pre-proline 0 CA--C 1.557 1.228 0 C-N-CA 124.537 1.135 . . . . 0.0 109.42 176.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -44.32 -50.12 8.19 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 123.256 2.637 . . . . 0.0 114.947 172.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 23.7 ptp -88.05 -27.36 22.05 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.501 0.32 . . . . 0.0 111.023 173.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.564 HG23 ' HB3' ' A' ' 17' ' ' CYS . 90.1 m 65.22 -75.63 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 125.416 1.487 . . . . 0.0 112.179 -174.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -170.66 137.18 4.3 Favored Glycine 0 C--N 1.349 1.261 0 CA-C-O 119.597 -0.557 . . . . 0.0 112.474 -178.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -61.75 -25.8 67.68 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -76.26 81.14 3.03 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.259 0.623 . . . . 0.0 109.692 171.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? 62.52 85.93 0.12 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.763 1.225 . . . . 0.0 112.067 -171.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -59.27 -28.05 66.38 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.888 0.875 . . . . 0.0 111.204 176.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -96.3 63.38 1.18 Allowed Glycine 0 CA--C 1.538 1.494 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.645 170.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -52.5 107.67 0.23 Allowed 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.645 0.778 . . . . 0.0 111.755 168.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.6 t -89.01 58.46 4.57 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.315 0.579 . . . . 0.0 110.6 177.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 57.07 17.39 3.41 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 125.08 1.352 . . . . 0.0 113.189 -174.032 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 61.2 m -109.43 98.01 7.48 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.243 0.617 . . . . 0.0 111.154 -174.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -87.37 138.53 31.4 Favored 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 165.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.585 HG22 HH11 ' A' ' 108' ' ' ARG . 11.8 p -68.9 -31.09 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.429 0 C-N-CA 123.383 0.673 . . . . 0.0 112.708 -173.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -140.89 -43.4 0.39 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.066 0.546 . . . . 0.0 111.558 -175.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.4 t70 70.47 161.85 0.23 Allowed 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.277 1.431 . . . . 0.0 112.415 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -75.53 -51.83 12.04 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.981 0.512 . . . . 0.0 111.356 -179.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.97 -62.26 1.94 Allowed Glycine 0 C--N 1.35 1.332 0 CA-C-N 116.301 -0.408 . . . . 0.0 112.556 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.3 t -158.06 136.55 11.1 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.175 0.59 . . . . 0.0 110.864 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.5 p80 -56.8 149.9 17.31 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.854 0.862 . . . . 0.0 112.539 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.2 t -95.44 114.65 26.44 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 121.448 0.642 . . . . 0.0 111.54 -171.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.473 HG11 ' HB2' ' A' ' 82' ' ' ALA . 82.2 t -140.38 110.33 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.214 1.006 . . . . 0.0 108.747 174.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 71.9 m -95.99 105.53 17.57 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.543 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -143.38 151.25 40.2 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.084 1.354 . . . . 0.0 108.26 -178.429 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.532 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 24.2 tt0 -125.24 108.52 11.82 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.013 0.824 . . . . 0.0 112.245 -174.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 70.6 mtp -87.41 135.22 33.42 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.355 0.662 . . . . 0.0 109.522 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.564 HG23 ' HD1' ' A' ' 49' ' ' PHE . 0.9 OUTLIER -91.63 155.18 18.52 Favored 'General case' 0 N--CA 1.502 2.142 0 CA-C-N 118.154 0.433 . . . . 0.0 110.734 -179.952 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -56.11 -32.1 63.89 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.944 0.898 . . . . 0.0 113.024 -169.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -53.69 -45.04 70.24 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.584 0.707 . . . . 0.0 110.621 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.564 ' HD1' HG23 ' A' ' 46' ' ' THR . 86.7 m-85 -78.58 -35.16 46.23 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.958 1.303 . . . . 0.0 113.899 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.9 mp -68.08 -42.22 80.71 Favored 'General case' 0 N--CA 1.499 2.011 0 CA-C-N 119.365 0.984 . . . . 0.0 110.727 177.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 83.5 mt -67.93 -37.34 81.53 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.072 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.406 ' HD2' ' SD ' ' A' ' 93' ' ' MET . 68.9 t80 -65.9 -39.35 90.52 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.261 0.624 . . . . 0.0 111.425 176.244 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 43.8 t -61.77 -44.68 96.41 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.612 0.765 . . . . 0.0 110.694 177.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.415 ' HG3' ' HA ' ' A' ' 59' ' ' ASP . 63.0 ttt180 -61.26 -47.37 86.35 Favored 'General case' 0 CA--C 1.559 1.304 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.278 175.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -71.73 -27.87 63.29 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 124.11 0.964 . . . . 0.0 112.284 -175.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.6 ttt85 -68.06 -44.21 76.89 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.643 0.777 . . . . 0.0 111.121 -175.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -96.19 -92.69 1.8 Allowed Glycine 0 CA--C 1.532 1.117 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.204 175.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -145.61 -59.27 0.33 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.765 1.226 . . . . 0.0 108.512 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.415 ' HA ' ' HG3' ' A' ' 54' ' ' ARG . 7.2 t0 -156.53 115.45 3.41 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.172 173.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 82.5 mt -119.37 7.73 11.27 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.338 0.655 . . . . 0.0 111.367 175.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 13.3 tmm? 176.78 111.72 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.09 1.356 . . . . 0.0 108.885 -178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.5 m -93.38 105.95 18.19 Favored Pre-proline 0 N--CA 1.495 1.806 0 C-N-CA 122.783 0.433 . . . . 0.0 110.671 176.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -82.32 -49.77 0.05 OUTLIER 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.47 2.113 . . . . 0.0 113.504 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 75.8 mtt-85 66.31 136.02 0.04 OUTLIER Pre-proline 0 N--CA 1.493 1.702 0 C-N-CA 125.331 1.452 . . . . 0.0 113.041 -172.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.35 45.78 2.03 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 122.739 2.292 . . . . 0.0 112.753 172.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -136.54 163.71 29.89 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 125.713 1.605 . . . . 0.0 107.847 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -84.86 37.67 0.67 Allowed 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 123.355 0.662 . . . . 0.0 112.383 -175.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -66.75 -44.07 82.44 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 124.236 1.014 . . . . 0.0 112.436 -176.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.4 t80 63.84 100.0 0.04 OUTLIER Pre-proline 0 CA--C 1.564 1.494 0 C-N-CA 125.165 1.386 . . . . 0.0 112.705 -176.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -77.51 159.29 32.38 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 123.032 2.488 . . . . 0.0 112.846 169.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.49 112.3 4.7 Favored Glycine 0 C--N 1.352 1.458 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 171.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.5 mp 66.54 133.64 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.459 1.104 . . . . 0.0 111.175 -164.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.84 175.97 10.8 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.327 0.651 . . . . 0.0 111.623 -177.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.06 131.46 50.66 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -173.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 66.4 40.95 94.65 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.486 -0.779 . . . . 0.0 113.464 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -124.94 104.88 8.83 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 122.854 0.461 . . . . 0.0 110.247 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.532 ' HB2' ' HB2' ' A' ' 44' ' ' GLU . 0.1 OUTLIER -83.5 88.03 7.0 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 122.813 0.445 . . . . 0.0 110.024 174.934 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -168.61 120.79 0.81 Allowed 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 124.261 1.024 . . . . 0.0 110.115 177.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 39.3 t 53.36 26.4 5.32 Favored 'General case' 0 N--CA 1.5 2.066 0 C-N-CA 124.687 1.195 . . . . 0.0 112.937 174.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.543 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -62.77 131.39 48.73 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.451 1.1 . . . . 0.0 111.041 -176.695 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 42.6 t -63.06 101.4 0.28 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.644 0.778 . . . . 0.0 111.394 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.473 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -59.08 -25.95 64.23 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.722 0.809 . . . . 0.0 112.297 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.5 m -69.33 -39.88 77.92 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.718 0.807 . . . . 0.0 112.029 174.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -74.99 -32.76 61.74 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.172 0.589 . . . . 0.0 111.338 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.571 ' HE1' HD23 ' A' ' 115' ' ' LEU . 3.4 t-105 -65.1 -46.73 79.87 Favored 'General case' 0 CA--C 1.567 1.598 0 C-N-CA 123.456 0.702 . . . . 0.0 109.377 171.249 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -57.49 -44.45 84.96 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.12 0.968 . . . . 0.0 111.576 174.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -60.25 -34.82 74.24 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.056 0.942 . . . . 0.0 111.42 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.89 -39.12 87.38 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 122.927 0.491 . . . . 0.0 111.739 175.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -66.76 -39.78 88.0 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 121.074 0.464 . . . . 0.0 110.715 176.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -69.22 -28.44 66.35 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 123.728 0.811 . . . . 0.0 111.425 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.18 -5.68 57.99 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.852 0.861 . . . . 0.0 111.978 173.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 92.76 -20.94 41.91 Favored Glycine 0 C--N 1.353 1.497 0 N-CA-C 114.226 0.45 . . . . 0.0 114.226 177.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' MET . . . . . 0.406 ' SD ' ' HD2' ' A' ' 52' ' ' PHE . 6.3 ptm -71.27 -87.92 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.773 0 C-N-CA 124.03 0.932 . . . . 0.0 112.59 -177.08 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 61.58 112.67 0.02 OUTLIER Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -67.69 176.72 4.77 Favored 'Trans proline' 0 N--CA 1.507 2.304 0 C-N-CA 123.498 2.799 . . . . 0.0 113.661 170.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -82.01 134.47 8.23 Favored 'Trans proline' 0 C--N 1.381 2.267 0 C-N-CA 122.402 2.068 . . . . 0.0 111.897 166.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.9 p -122.79 143.74 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.912 0.885 . . . . 0.0 110.179 177.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.3 p -94.65 120.2 43.72 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.652 0 C-N-CA 123.216 0.606 . . . . 0.0 111.852 -178.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.4 mt -61.0 -45.82 93.28 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.161 0.985 . . . . 0.0 113.384 -176.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -75.14 14.75 0.5 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.988 0.915 . . . . 0.0 113.451 -172.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.2 t -137.39 -5.73 1.8 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 123.521 0.728 . . . . 0.0 112.07 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 53.5 m -91.24 124.2 35.26 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.029 0.532 . . . . 0.0 110.888 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.8 mp0 -66.39 154.6 39.71 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.001 0.52 . . . . 0.0 112.194 175.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.437 ' O ' ' HD3' ' A' ' 104' ' ' LYS . 1.4 tmtp? -67.17 -19.32 65.56 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 123.633 0.773 . . . . 0.0 111.545 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 42.9 t -56.43 -26.68 54.35 Favored 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 123.715 0.806 . . . . 0.0 111.918 176.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.37 73.73 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.956 0.902 . . . . 0.0 112.692 174.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 10.6 mp -62.9 -6.82 4.16 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -173.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.585 HH11 HG22 ' A' ' 33' ' ' VAL . 59.6 mtp180 -83.67 -34.2 25.04 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 121.084 0.469 . . . . 0.0 111.526 172.523 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -102.21 -22.73 14.12 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.501 1.121 . . . . 0.0 111.524 -173.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.424 HG21 ' NE1' ' A' ' 85' ' ' TRP . 7.6 p -136.24 170.98 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 124.331 1.052 . . . . 0.0 108.756 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' SER . . . . . 0.512 ' HB3' ' HB2' ' A' ' 114' ' ' ASP . 28.7 t -92.97 151.29 20.0 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 121.747 -0.596 . . . . 0.0 111.277 170.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.9 tt -59.9 -44.63 94.16 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.551 0.34 . . . . 0.0 110.196 167.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.07 -30.65 69.35 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.298 0.639 . . . . 0.0 111.356 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.512 ' HB2' ' HB3' ' A' ' 111' ' ' SER . 5.5 t70 -67.1 -41.01 86.98 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.588 1.155 . . . . 0.0 110.45 175.706 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.571 HD23 ' HE1' ' A' ' 85' ' ' TRP . 71.3 mt -66.33 -53.48 35.88 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.845 0.858 . . . . 0.0 110.509 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.46 ' HA ' ' HB3' ' A' ' 119' ' ' ALA . 11.3 mt-30 -69.47 -28.03 65.74 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.445 1.098 . . . . 0.0 111.947 -173.385 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -55.2 -37.03 66.56 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.283 0.633 . . . . 0.0 112.43 171.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -113.22 30.26 7.34 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.757 0.823 . . . . 0.0 111.455 178.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.46 ' HB3' ' HA ' ' A' ' 116' ' ' GLN . . . -139.14 177.99 7.5 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.423 ' H ' HD23 ' A' ' 120' ' ' LEU . 2.6 pt? -85.27 163.12 46.52 Favored Pre-proline 0 CA--C 1.562 1.418 0 C-N-CA 124.096 0.958 . . . . 0.0 111.962 177.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_exo -51.85 115.21 1.98 Allowed 'Trans proline' 0 C--N 1.375 1.956 0 C-N-CA 123.133 2.556 . . . . 0.0 113.748 162.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.3 p -86.26 129.48 38.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 122.618 0.367 . . . . 0.0 110.364 174.416 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.0 pp -151.6 143.34 23.69 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.342 0.657 . . . . 0.0 112.061 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -160.96 140.17 10.41 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.631 0.772 . . . . 0.0 110.981 174.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -157.71 131.35 7.89 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.931 0.492 . . . . 0.0 110.886 173.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -110.92 147.67 34.13 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.605 1.162 . . . . 0.0 108.798 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -144.28 -59.82 0.38 Allowed 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -173.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 56.7 m80 70.2 149.19 0.08 Allowed 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 124.863 1.265 . . . . 0.0 112.266 -168.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -99.03 125.82 44.6 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.505 0.722 . . . . 0.0 110.073 176.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 55.8 t60 . . . . . 0 CA--C 1.568 1.643 0 C-N-CA 123.404 0.682 . . . . 0.0 110.943 178.458 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.8 ttm . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 120.463 0.173 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.65 118.18 0.81 Allowed Glycine 0 CA--C 1.533 1.205 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 177.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -72.24 123.9 23.92 Favored 'General case' 0 CA--C 1.556 1.201 0 CA-C-N 117.326 0.563 . . . . 0.0 112.087 -177.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.66 141.82 32.65 Favored Glycine 0 CA--C 1.539 1.543 0 CA-C-N 115.918 -0.583 . . . . 0.0 113.521 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -147.53 155.6 42.02 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.345 0.658 . . . . 0.0 111.532 -176.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -117.35 177.3 4.79 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -170.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 m -89.65 -14.12 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 124.593 1.157 . . . . 0.0 111.325 -174.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.41 HD13 ' HB3' ' A' ' 11' ' ' ASP . 43.0 mt -62.73 -55.11 29.72 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.619 1.168 . . . . 0.0 112.914 -161.35 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 80.68 -51.48 4.27 Favored Glycine 0 N--CA 1.481 1.674 0 CA-C-O 121.589 0.549 . . . . 0.0 112.195 -174.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -151.66 119.67 6.24 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.153 1.381 . . . . 0.0 107.657 172.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.41 ' HB3' HD13 ' A' ' 8' ' ' LEU . 7.7 p-10 -104.71 -24.56 12.92 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.026 0.53 . . . . 0.0 111.437 -174.449 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.59 98.49 1.16 Allowed 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.387 0.675 . . . . 0.0 109.898 174.26 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -74.94 170.11 16.62 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.81 0.444 . . . . 0.0 110.876 172.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.631 HG22 ' H ' ' A' ' 16' ' ' CYS . 10.6 p -143.75 130.77 17.27 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 CA-C-O 120.887 0.375 . . . . 0.0 111.627 -173.677 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 90.3 m -69.9 -15.49 63.08 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.542 0.737 . . . . 0.0 112.351 176.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.631 ' H ' HG22 ' A' ' 14' ' ' VAL . 60.6 m -71.62 -38.6 70.79 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 122.862 0.465 . . . . 0.0 112.081 174.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 52.8 t 66.93 -71.02 0.1 Allowed 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 125.47 1.508 . . . . 0.0 112.268 -174.46 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.607 ' H ' ' HD2' ' A' ' 19' ' ' PRO . . . -143.32 -49.23 0.02 OUTLIER Pre-proline 0 CA--C 1.572 1.799 0 C-N-CA 123.86 0.864 . . . . 0.0 112.733 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.607 ' HD2' ' H ' ' A' ' 18' ' ' ALA . 60.2 Cg_endo -68.1 160.3 49.3 Favored 'Trans proline' 0 C--N 1.399 3.204 0 C-N-CA 121.794 1.663 . . . . 0.0 113.797 174.535 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.0 57.53 2.43 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.231 1.012 . . . . 0.0 112.485 -167.474 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.8 t -69.76 -21.88 63.4 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 123.514 0.726 . . . . 0.0 112.56 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 170.36 -179.17 42.67 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-O 120.89 0.161 . . . . 0.0 113.426 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -94.09 -53.98 3.76 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.458 0.703 . . . . 0.0 109.856 175.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 67.57 -1.87 1.49 Allowed 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 125.84 1.656 . . . . 0.0 113.634 179.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 60.2 -70.12 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 125.548 1.539 . . . . 0.0 112.249 -173.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -61.51 -28.29 69.2 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.554 1.142 . . . . 0.0 112.001 175.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.68 -40.99 2.25 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.259 -176.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -126.94 96.59 4.67 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-O 121.925 0.869 . . . . 0.0 111.35 -177.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.0 p -172.36 -179.96 2.39 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.69 1.196 . . . . 0.0 110.619 178.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 63.74 83.06 0.17 Allowed 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.331 1.052 . . . . 0.0 111.619 -178.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 13.4 t -77.65 -13.39 59.92 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 171.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 60.49 -85.98 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 125.15 1.38 . . . . 0.0 112.446 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.263 10.4 p 44.19 -68.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 C-N-CA 127.049 2.14 . . . . 0.0 115.348 -172.019 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -174.29 -31.97 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 125.695 1.598 . . . . 0.0 108.91 -176.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -83.16 136.69 34.34 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 124.232 1.013 . . . . 0.0 111.821 -174.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -69.99 -33.09 71.61 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.709 0.804 . . . . 0.0 110.711 172.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.64 98.11 1.65 Allowed Glycine 0 CA--C 1.537 1.421 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.844 176.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.7 t -83.93 58.39 4.67 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.571 0.7 . . . . 0.0 111.346 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -132.3 31.1 4.12 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 124.598 1.159 . . . . 0.0 109.704 171.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.8 t -97.22 132.73 42.69 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.393 1.077 . . . . 0.0 111.935 -178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.604 HG11 ' HB2' ' A' ' 82' ' ' ALA . 42.3 t -139.5 110.6 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 C-N-CA 123.591 0.756 . . . . 0.0 110.618 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.8 m -108.23 106.92 17.31 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.631 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.27 151.31 41.91 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.45 0.7 . . . . 0.0 109.321 -168.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.465 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 29.1 tt0 -112.25 115.81 29.4 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.837 0.351 . . . . 0.0 111.667 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.443 ' HB3' HD11 ' A' ' 50' ' ' LEU . 75.5 mmm -95.19 114.84 26.68 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 170.487 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.695 ' HB ' ' HB2' ' A' ' 95' ' ' PRO . 92.4 m -83.56 147.73 27.59 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.34 0.656 . . . . 0.0 110.294 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.48 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 35.6 tt0 -47.31 -32.52 4.8 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -164.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -53.1 -41.87 65.39 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -76.08 -32.5 59.27 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.383 0.273 . . . . 0.0 111.595 175.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.598 HD22 ' HA ' ' A' ' 74' ' ' ALA . 5.3 mp -77.39 -22.54 51.48 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.803 0.441 . . . . 0.0 110.813 -177.665 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.48 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 70.2 mt -68.79 -46.82 67.72 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.811 1.244 . . . . 0.0 109.626 168.244 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -55.08 -48.77 73.08 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.427 1.091 . . . . 0.0 110.98 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -68.22 -28.46 67.27 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.117 0.967 . . . . 0.0 111.949 177.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.566 ' HA ' ' O ' ' A' ' 58' ' ' ASN . 50.0 ttt180 -69.23 -58.3 4.22 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.205 0.602 . . . . 0.0 111.833 -178.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -68.53 -11.58 60.08 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -176.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 58.2 ttt-85 -151.93 88.02 1.38 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.034 0.534 . . . . 0.0 109.681 173.244 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 151.95 -90.75 0.13 Allowed Glycine 0 C--N 1.353 1.485 0 CA-C-N 116.229 -0.441 . . . . 0.0 112.697 -179.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 54' ' ' ARG . 0.2 OUTLIER -139.93 156.83 46.48 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.735 0.814 . . . . 0.0 111.599 -177.701 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -63.19 -50.84 68.73 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -177.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.7 tm? 69.82 -70.46 0.14 Allowed 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 125.75 1.62 . . . . 0.0 111.544 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 56.6 mtt -61.38 -52.87 62.83 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.66 1.184 . . . . 0.0 112.898 -171.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.6 m 68.45 122.33 0.03 OUTLIER Pre-proline 0 N--CA 1.49 1.568 0 C-N-CA 124.46 1.104 . . . . 0.0 111.431 -179.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -78.0 41.38 1.0 Allowed 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 123.166 2.577 . . . . 0.0 114.051 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 75.1 mtp180 -120.64 142.57 34.5 Favored Pre-proline 0 N--CA 1.483 1.179 0 C-N-CA 124.517 1.127 . . . . 0.0 109.596 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -81.35 30.51 0.52 Allowed 'Trans proline' 0 C--N 1.376 2.001 0 C-N-CA 122.984 2.456 . . . . 0.0 112.932 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -125.04 126.55 45.57 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.996 1.318 . . . . 0.0 109.715 -170.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -112.26 82.91 1.71 Allowed 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.437 0.695 . . . . 0.0 109.494 -176.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -137.87 84.29 2.03 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.022 175.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -136.88 153.38 75.46 Favored Pre-proline 0 N--CA 1.487 1.425 0 C-N-CA 124.495 1.118 . . . . 0.0 110.338 -174.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -77.69 40.41 0.85 Allowed 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.853 2.369 . . . . 0.0 113.485 173.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -169.26 -144.08 4.11 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-N 116.652 -0.249 . . . . 0.0 113.008 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.473 HD12 ' HB3' ' A' ' 76' ' ' ASP . 2.3 pt? -140.75 -177.47 5.08 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.746 0.818 . . . . 0.0 111.34 -176.028 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.749 ' HG2' ' HB2' ' A' ' 76' ' ' ASP . 11.2 ptpt -106.5 -176.24 3.02 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.834 0.854 . . . . 0.0 111.973 -172.009 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.598 ' HA ' HD22 ' A' ' 50' ' ' LEU . . . -73.87 120.24 19.19 Favored 'General case' 0 CA--C 1.55 0.942 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.543 171.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 75.65 44.88 19.32 Favored Glycine 0 C--N 1.346 1.12 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.811 -176.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.749 ' HB2' ' HG2' ' A' ' 73' ' ' LYS . 14.5 t70 -119.93 149.14 42.6 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.227 0.611 . . . . 0.0 109.96 173.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.465 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -135.54 91.68 2.75 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.206 0.602 . . . . 0.0 110.787 -174.713 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -179.61 123.8 0.08 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.551 1.141 . . . . 0.0 109.454 173.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.2 t 54.57 30.86 13.89 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.392 1.077 . . . . 0.0 112.706 177.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.631 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.4 tm? -68.6 131.77 45.78 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.697 0.799 . . . . 0.0 110.538 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 60.8 m -60.26 106.93 0.58 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.133 0.973 . . . . 0.0 110.761 176.231 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.604 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -64.5 -24.8 67.73 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.261 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.6 t -64.0 -34.01 77.02 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 122.756 0.422 . . . . 0.0 111.741 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -63.07 -37.99 89.38 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.82 0.848 . . . . 0.0 110.978 176.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -75.14 -50.62 15.74 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 124.279 1.032 . . . . 0.0 111.155 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.47 ' HB2' HG12 ' A' ' 110' ' ' VAL . 19.6 tp60 -49.1 -44.29 42.01 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.952 0.901 . . . . 0.0 112.07 173.382 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -69.61 -30.01 67.65 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.48 -43.13 91.21 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 122.822 0.449 . . . . 0.0 111.911 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.524 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 80.0 t80 -64.68 -41.37 96.1 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.134 0.574 . . . . 0.0 111.127 176.489 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -67.07 -29.94 69.85 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.612 0.765 . . . . 0.0 112.647 175.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.48 -14.7 56.7 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.598 0.759 . . . . 0.0 111.914 175.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 78.58 7.51 88.04 Favored Glycine 0 C--N 1.352 1.448 0 CA-C-N 116.25 -0.432 . . . . 0.0 113.318 -174.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 94.6 mmm -104.2 17.82 23.33 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.227 1.011 . . . . 0.0 112.075 -177.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.524 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -52.06 108.56 1.1 Allowed Pre-proline 0 CA--C 1.569 1.701 0 C-N-CA 125.39 1.476 . . . . 0.0 114.439 178.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.695 ' HB2' ' HB ' ' A' ' 46' ' ' THR . 32.3 Cg_endo -86.56 168.06 8.6 Favored 'Trans proline' 0 CA--C 1.571 2.327 0 C-N-CA 123.06 2.507 . . . . 0.0 113.172 175.205 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.79 126.58 21.6 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.853 2.369 . . . . 0.0 114.803 176.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.2 p -115.43 175.61 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 125.381 1.472 . . . . 0.0 109.363 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.414 HG21 ' HB3' ' A' ' 101' ' ' SER . 10.0 m -95.67 161.1 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.435 0 O-C-N 121.625 -0.672 . . . . 0.0 110.612 165.44 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.46 HD11 ' HG2' ' A' ' 116' ' ' GLN . 7.7 mt -113.44 -29.73 7.11 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.214 1.006 . . . . 0.0 108.889 161.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -59.43 -46.06 89.79 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.802 1.241 . . . . 0.0 112.082 -173.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.414 ' HB3' HG21 ' A' ' 98' ' ' VAL . 28.1 t -96.63 -23.83 16.3 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.008 178.101 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.7 m -63.49 110.1 1.85 Allowed 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 120.855 0.359 . . . . 0.0 111.482 175.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.0 mp0 -65.59 155.65 35.15 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.947 0.899 . . . . 0.0 112.11 178.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -66.86 -16.61 64.42 Favored 'General case' 0 N--CA 1.5 2.03 0 C-N-CA 123.45 0.7 . . . . 0.0 112.057 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.4 t -61.34 -26.34 67.74 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.095 0.958 . . . . 0.0 112.302 173.016 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.497 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -54.66 -37.64 65.96 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.117 0.567 . . . . 0.0 112.084 174.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 7.0 mp -65.85 4.04 0.69 Allowed 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 124.956 1.303 . . . . 0.0 113.261 -176.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 65.1 mtp85 -98.69 -10.19 23.56 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.485 1.114 . . . . 0.0 110.848 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -121.06 -49.28 2.2 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.997 1.319 . . . . 0.0 108.611 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.838 HG21 HD21 ' A' ' 115' ' ' LEU . 32.6 m -90.1 -174.32 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 CA-C-O 122.101 0.953 . . . . 0.0 111.09 167.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.9 t -110.02 160.68 16.22 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.219 155.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.58 -36.91 62.42 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.252 0.621 . . . . 0.0 112.39 173.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.36 -30.74 71.4 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -177.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -61.47 -46.36 90.39 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.307 0.575 . . . . 0.0 110.12 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.838 HD21 HG21 ' A' ' 110' ' ' VAL . 5.9 mt -66.55 -56.58 10.17 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.431 -175.05 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.46 ' HG2' HD11 ' A' ' 99' ' ' LEU . 3.2 mt-30 -65.84 -24.65 66.94 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.479 -170.673 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -51.17 -40.32 58.37 Favored 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 172.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -140.7 21.52 2.33 Favored 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 123.258 0.623 . . . . 0.0 112.639 -176.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -73.26 -30.34 63.37 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.625 ' H ' HD23 ' A' ' 120' ' ' LEU . 2.3 pt? -110.91 165.67 12.25 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 123.707 0.803 . . . . 0.0 110.795 -175.262 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -49.19 91.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.378 2.082 0 C-N-CA 122.828 2.352 . . . . 0.0 113.135 161.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 4.9 p -115.52 131.07 68.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.986 0.915 . . . . 0.0 110.729 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.7 pp -141.63 157.56 44.93 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.796 0.838 . . . . 0.0 111.07 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -67.23 99.0 0.65 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 122.981 0.512 . . . . 0.0 110.754 176.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -115.17 3.8 14.43 Favored 'General case' 0 CA--C 1.562 1.414 0 C-N-CA 123.981 0.912 . . . . 0.0 111.045 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 68.18 133.83 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 125.06 1.344 . . . . 0.0 111.968 -173.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -85.36 123.37 30.75 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -174.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -153.28 106.6 2.99 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.562 1.145 . . . . 0.0 108.87 171.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 30.7 p80 -124.44 150.69 45.39 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 122.822 0.449 . . . . 0.0 111.672 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 19.6 p80 . . . . . 0 CA--C 1.57 1.727 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.872 174.326 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.8 mtt . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -78.57 69.39 2.83 Favored Glycine 0 CA--C 1.537 1.45 0 O-C-N 122.88 0.112 . . . . 0.0 113.087 177.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -155.57 151.66 27.85 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.998 0.919 . . . . 0.0 110.596 -177.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.97 108.92 0.36 Allowed Glycine 0 N--CA 1.476 1.348 0 C-N-CA 121.988 -0.148 . . . . 0.0 113.304 179.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -110.26 116.72 31.99 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.6 0.76 . . . . 0.0 109.226 176.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.57 ' H ' HD12 ' A' ' 8' ' ' LEU . 2.5 p-10 -158.78 98.99 1.53 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.225 0.61 . . . . 0.0 110.876 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.9 t 43.28 67.5 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.562 1.432 0 C-N-CA 125.639 1.576 . . . . 0.0 113.322 174.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.57 HD12 ' H ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -122.31 -14.06 7.96 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.592 0.757 . . . . 0.0 113.035 -173.974 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -53.0 -28.77 33.51 Favored Glycine 0 N--CA 1.479 1.516 0 N-CA-C 116.568 1.387 . . . . 0.0 116.568 -166.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -160.05 -175.16 4.93 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.935 0.894 . . . . 0.0 109.695 172.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 36.5 t70 63.29 92.35 0.06 Allowed 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 124.589 1.156 . . . . 0.0 112.48 174.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.9 166.74 21.99 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.02 0.928 . . . . 0.0 109.648 171.203 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -76.69 -171.37 1.86 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -171.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.592 ' HA ' ' HB2' ' A' ' 28' ' ' PHE . 3.8 p -52.43 107.69 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.563 1.451 0 C-N-CA 124.377 1.071 . . . . 0.0 113.049 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.454 ' SG ' ' HB3' ' A' ' 70' ' ' PRO . 81.6 m -85.65 -45.84 11.32 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.183 178.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -82.09 88.41 6.44 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.301 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 47.7 t -157.98 -56.63 0.07 Allowed 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.644 0.778 . . . . 0.0 110.936 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.501 ' HB3' ' HD3' ' A' ' 19' ' ' PRO . . . -109.01 -52.4 0.06 OUTLIER Pre-proline 0 CA--C 1.571 1.76 0 CA-C-O 118.65 -0.69 . . . . 0.0 111.329 174.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.501 ' HD3' ' HB3' ' A' ' 18' ' ' ALA . 20.0 Cg_exo -68.95 120.41 7.32 Favored 'Trans proline' 0 C--N 1.398 3.151 0 C-N-CA 121.981 1.787 . . . . 0.0 111.398 168.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.2 mmt -73.92 97.22 2.76 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.178 0.591 . . . . 0.0 111.136 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.5 p -78.3 -3.22 41.86 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.904 0.881 . . . . 0.0 112.035 175.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 168.4 -60.93 0.2 Allowed Glycine 0 C--N 1.342 0.894 0 N-CA-C 110.596 -1.002 . . . . 0.0 110.596 177.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 22.3 t90 -168.75 171.73 8.41 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 124.878 1.271 . . . . 0.0 108.65 176.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -67.29 86.22 0.16 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-O 121.511 0.672 . . . . 0.0 110.377 172.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -95.01 -55.61 3.03 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.535 0.734 . . . . 0.0 110.337 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -172.63 158.63 4.16 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.532 1.133 . . . . 0.0 108.02 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.17 110.42 2.68 Favored Glycine 0 CA--C 1.541 1.674 0 CA-C-O 119.611 -0.55 . . . . 0.0 112.773 173.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.592 ' HB2' ' HA ' ' A' ' 14' ' ' VAL . 56.7 t80 80.27 140.31 0.07 Allowed 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 125.267 1.427 . . . . 0.0 112.567 174.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 57.7 m -88.62 98.1 11.48 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.668 0.787 . . . . 0.0 110.564 178.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -86.48 142.32 28.46 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-O 121.302 0.572 . . . . 0.0 110.921 173.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.591 HG21 ' SG ' ' A' ' 42' ' ' CYS . 9.6 t -108.71 6.03 25.33 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.972 0.909 . . . . 0.0 110.193 175.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -90.2 173.2 8.29 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.571 1.149 . . . . 0.0 111.696 -168.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.2 m 51.87 15.07 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 C-N-CA 126.276 1.83 . . . . 0.0 115.193 177.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -115.34 -82.5 0.62 Allowed 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 175.344 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 54.98 51.29 13.79 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.495 1.118 . . . . 0.0 113.269 172.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -121.63 -6.99 9.15 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.578 0.751 . . . . 0.0 112.733 -174.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.4 80.83 0.82 Allowed Glycine 0 CA--C 1.537 1.459 0 N-CA-C 112.741 -0.144 . . . . 0.0 112.741 -172.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -130.0 -61.82 0.97 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.995 0.918 . . . . 0.0 111.162 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.9 p80 -161.11 18.08 0.12 Allowed 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 123.86 0.864 . . . . 0.0 111.028 -177.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 45.0 p -96.42 111.18 23.37 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.079 1.352 . . . . 0.0 111.639 -173.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.42 HG11 ' HB2' ' A' ' 82' ' ' ALA . 39.2 t -129.07 123.51 58.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.781 -0.574 . . . . 0.0 110.525 173.169 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.591 ' SG ' HG21 ' A' ' 31' ' ' THR . 71.9 m -119.95 108.91 14.9 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 167.082 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.684 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -138.96 147.93 42.87 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.851 0.86 . . . . 0.0 108.835 -174.057 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -112.17 118.76 36.22 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 117.796 0.271 . . . . 0.0 111.501 -172.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.508 ' SD ' ' HB2' ' A' ' 85' ' ' TRP . 75.7 mmm -101.88 129.86 48.22 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.501 0.72 . . . . 0.0 110.641 178.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.47 ' H ' ' HB3' ' A' ' 95' ' ' PRO . 57.0 m -85.73 150.96 24.22 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.222 1.009 . . . . 0.0 110.412 -178.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -47.92 -30.01 3.84 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.631 1.573 . . . . 0.0 114.432 -172.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -48.19 -55.15 11.13 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.164 0.986 . . . . 0.0 112.179 177.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -74.39 -33.74 63.12 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.277 -176.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.8 mp -73.19 -35.61 66.39 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 117.914 0.324 . . . . 0.0 111.293 -176.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 38.8 mt -74.16 -33.67 63.56 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.972 0.509 . . . . 0.0 110.995 173.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -58.28 -51.92 67.76 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.908 0.483 . . . . 0.0 110.664 171.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.429 ' HA ' ' HE ' ' A' ' 56' ' ' ARG . 68.4 m -63.12 -45.19 93.13 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.662 0.785 . . . . 0.0 111.745 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.607 ' HA ' ' H ' ' A' ' 59' ' ' ASP . 50.8 ttt85 -60.27 -52.36 65.6 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.318 0.647 . . . . 0.0 111.4 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.33 -32.25 73.78 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.212 1.005 . . . . 0.0 111.851 178.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.429 ' HE ' ' HA ' ' A' ' 53' ' ' SER . 16.4 ttp180 -66.7 -34.22 77.38 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.252 1.021 . . . . 0.0 112.037 178.352 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 130.16 21.62 1.18 Allowed Glycine 0 N--CA 1.479 1.539 0 N-CA-C 114.295 0.478 . . . . 0.0 114.295 177.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -88.48 -51.17 5.86 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.232 0.613 . . . . 0.0 109.919 172.427 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.607 ' H ' ' HA ' ' A' ' 54' ' ' ARG . 2.5 m-20 65.42 -11.12 0.18 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 115.836 1.791 . . . . 0.0 115.836 176.671 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.8 tp -72.49 92.99 1.52 Allowed 'General case' 0 CA--C 1.552 1.023 0 CA-C-O 122.014 0.912 . . . . 0.0 110.892 -175.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.1 ttm -157.43 136.25 11.55 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.49 1.516 . . . . 0.0 107.052 177.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.4 m -59.81 105.93 0.65 Allowed Pre-proline 0 CA--C 1.563 1.474 0 C-N-CA 123.34 0.656 . . . . 0.0 111.379 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -92.3 -0.71 4.08 Favored 'Trans proline' 0 C--N 1.383 2.373 0 C-N-CA 123.225 2.617 . . . . 0.0 112.782 -178.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -100.08 130.63 25.75 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 124.402 1.081 . . . . 0.0 108.541 179.607 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.13 -18.72 63.5 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.884 2.389 . . . . 0.0 113.929 -172.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -76.06 116.69 17.01 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-O 121.02 0.438 . . . . 0.0 110.477 175.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -88.83 14.14 11.0 Favored 'General case' 0 CA--C 1.563 1.458 0 C-N-CA 123.682 0.793 . . . . 0.0 111.187 178.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.84 -37.13 73.3 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 125.326 1.451 . . . . 0.0 110.558 170.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -77.7 126.85 83.73 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 124.08 0.952 . . . . 0.0 110.792 -178.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PRO . . . . . 0.454 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 40.2 Cg_endo -65.42 107.75 1.07 Allowed 'Trans proline' 0 C--N 1.378 2.112 0 C-N-CA 122.442 2.095 . . . . 0.0 111.946 176.299 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -164.04 133.19 2.94 Favored Glycine 0 C--N 1.34 0.8 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.582 178.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.8 127.09 31.68 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.149 0.58 . . . . 0.0 111.025 179.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.462 ' HD3' ' H ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -126.93 172.94 10.01 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.074 0.95 . . . . 0.0 109.589 178.256 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.41 111.23 2.57 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.304 0.641 . . . . 0.0 112.674 -172.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.85 20.8 25.28 Favored Glycine 0 CA--C 1.537 1.452 0 CA-C-N 115.648 -0.705 . . . . 0.0 113.431 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -95.99 134.02 39.51 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.565 0.746 . . . . 0.0 110.772 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.67 90.56 3.13 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.934 0.873 . . . . 0.0 111.791 172.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -173.96 121.4 0.3 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.485 1.114 . . . . 0.0 108.765 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 36.6 t 58.75 21.51 9.01 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.945 0.898 . . . . 0.0 112.374 177.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.684 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -68.87 112.92 5.85 Favored 'General case' 0 C--N 1.355 0.82 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 63.0 m -59.46 115.34 3.21 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.997 0.519 . . . . 0.0 109.967 176.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.42 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -56.28 -25.12 47.04 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -176.15 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.5 t -61.45 -33.32 73.54 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.623 0.769 . . . . 0.0 112.52 174.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -71.01 -40.21 71.93 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 123.852 0.861 . . . . 0.0 112.016 177.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.744 ' HE1' HD23 ' A' ' 115' ' ' LEU . 10.7 t-105 -68.84 -51.67 38.04 Favored 'General case' 0 CA--C 1.561 1.385 0 O-C-N 122.249 -0.282 . . . . 0.0 111.009 173.413 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.494 ' HB2' HG12 ' A' ' 110' ' ' VAL . 6.8 tp60 -48.43 -37.32 16.83 Favored 'General case' 0 CA--C 1.567 1.603 0 C-N-CA 124.167 0.987 . . . . 0.0 111.62 173.546 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -59.43 -44.04 92.98 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.634 1.174 . . . . 0.0 112.425 174.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.5 -36.6 73.9 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.149 0.58 . . . . 0.0 111.97 -173.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.726 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 65.5 t80 -66.02 -52.23 51.09 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.057 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -67.78 -22.52 65.19 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.92 -22.14 60.78 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.301 0.641 . . . . 0.0 111.528 171.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 102.26 -4.89 51.98 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 114.136 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 61.5 mtp -81.11 -70.14 0.55 Allowed 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 117.356 0.578 . . . . 0.0 109.909 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.726 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 57.21 92.05 0.07 OUTLIER Pre-proline 0 CA--C 1.557 1.224 0 C-N-CA 125.034 1.333 . . . . 0.0 113.54 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.47 ' HB3' ' H ' ' A' ' 46' ' ' THR . 93.5 Cg_exo -55.06 159.25 10.02 Favored 'Trans proline' 0 CA--C 1.564 2.004 0 C-N-CA 123.049 2.499 . . . . 0.0 114.496 163.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.65 110.98 2.0 Favored 'Trans proline' 0 CA--C 1.558 1.699 0 C-N-CA 121.776 1.651 . . . . 0.0 110.999 163.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -95.24 157.15 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 123.245 0.618 . . . . 0.0 110.224 178.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.52 HG21 ' HB3' ' A' ' 101' ' ' SER . 28.1 m -73.48 147.28 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.149 0 C-N-CA 123.097 0.559 . . . . 0.0 111.175 171.703 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.458 HD23 ' HG2' ' A' ' 116' ' ' GLN . 0.6 OUTLIER -105.17 -30.25 9.83 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 167.766 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -80.52 -14.42 58.26 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.629 1.171 . . . . 0.0 113.338 -172.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.52 ' HB3' HG21 ' A' ' 98' ' ' VAL . 33.0 t -119.6 -24.69 6.17 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 122.759 0.424 . . . . 0.0 111.783 -179.115 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 85.5 m -63.31 106.3 0.87 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.747 0.419 . . . . 0.0 111.113 172.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -76.57 160.31 29.55 Favored 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 124.167 0.987 . . . . 0.0 110.702 -176.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -57.98 -23.36 53.51 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -174.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.6 m -59.23 -32.23 69.78 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 120.765 0.317 . . . . 0.0 111.628 176.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.451 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -59.8 -36.36 76.58 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.556 0.742 . . . . 0.0 112.801 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.7 mp -65.47 5.49 0.41 Allowed 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 124.615 1.166 . . . . 0.0 113.495 -178.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 49.4 mtp180 -98.72 -26.01 14.49 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.044 0.938 . . . . 0.0 110.525 175.234 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -95.79 -53.15 3.8 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.731 1.212 . . . . 0.0 108.065 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.626 HG21 HD21 ' A' ' 115' ' ' LEU . 33.1 m -91.02 -171.54 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 122.207 1.003 . . . . 0.0 111.569 170.202 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 47.1 t -114.52 161.1 18.46 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.304 -1.316 . . . . 0.0 108.216 156.227 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.2 tt -53.88 -40.24 66.42 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.479 0.311 . . . . 0.0 110.97 168.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.89 -30.31 67.68 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.524 0.73 . . . . 0.0 112.43 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.57 -39.09 88.3 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.613 0.765 . . . . 0.0 110.298 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.744 HD23 ' HE1' ' A' ' 85' ' ' TRP . 23.4 mt -71.61 -53.67 12.92 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.738 -177.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.458 ' HG2' HD23 ' A' ' 99' ' ' LEU . 28.6 mt-30 -69.51 -27.16 64.95 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.445 -173.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -50.53 -54.54 21.62 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.878 0.871 . . . . 0.0 113.331 177.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 23.1 t-80 -99.9 -14.36 18.77 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.4 ' HB1' HD11 ' A' ' 99' ' ' LEU . . . -89.08 -93.82 0.11 Allowed 'General case' 0 CA--C 1.557 1.232 0 O-C-N 122.195 -0.316 . . . . 0.0 111.051 179.199 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 17.4 mt -141.24 159.37 61.5 Favored Pre-proline 0 N--CA 1.486 1.348 0 C-N-CA 123.463 0.705 . . . . 0.0 112.345 177.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -58.02 144.62 94.3 Favored 'Trans proline' 0 C--N 1.376 2.003 0 C-N-CA 123.809 3.006 . . . . 0.0 113.261 163.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.6 p -78.3 129.29 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 169.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.7 tt -76.02 104.35 6.51 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 173.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -150.9 143.11 24.15 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.812 0.845 . . . . 0.0 110.92 -177.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -72.65 118.16 15.24 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.045 0.538 . . . . 0.0 109.78 172.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -69.04 -35.41 76.56 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -169.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -83.85 92.95 7.89 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-O 121.287 0.565 . . . . 0.0 111.525 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -89.69 126.55 35.69 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.714 0.806 . . . . 0.0 109.205 171.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 25.8 p80 -139.26 -177.56 4.97 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.644 0.778 . . . . 0.0 111.271 -177.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 85.4 t60 . . . . . 0 CA--C 1.564 1.51 0 C-N-CA 123.453 0.701 . . . . 0.0 111.364 175.375 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 68.1 p . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 121.493 0.663 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.824 HG21 ' HB2' ' A' ' 82' ' ' ALA . 53.2 t -134.44 111.1 14.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.602 1.161 . . . . 0.0 109.516 175.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 78.2 m -107.44 106.69 17.21 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 169.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.555 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -143.76 152.39 41.19 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.679 1.191 . . . . 0.0 108.904 -175.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -117.54 109.57 16.87 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 121.638 -0.663 . . . . 0.0 111.71 -176.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.488 ' HB3' HD11 ' A' ' 50' ' ' LEU . 89.7 mmm -93.02 141.98 27.8 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.983 0.913 . . . . 0.0 110.838 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.4 p -93.78 156.84 16.45 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.025 0.53 . . . . 0.0 111.497 -176.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -68.15 -33.64 74.84 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.124 0.569 . . . . 0.0 111.713 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -53.61 -49.17 68.4 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 124.194 0.998 . . . . 0.0 111.307 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -77.48 -33.45 54.52 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.087 0.955 . . . . 0.0 111.864 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.488 HD11 ' HB3' ' A' ' 45' ' ' MET . 5.2 mp -77.6 -33.71 53.68 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 113.55 0.945 . . . . 0.0 113.55 -176.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 61.0 mt -71.97 -34.67 69.15 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.901 0.481 . . . . 0.0 110.713 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.418 ' CD2' ' SD ' ' A' ' 93' ' ' MET . 81.9 t80 -63.44 -52.55 61.01 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.074 0.549 . . . . 0.0 110.688 175.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.7 t . . . . . 0 N--CA 1.487 1.383 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.853 -178.57 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.027 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 109.3 -1.17 31.11 Favored Glycine 0 N--CA 1.474 1.208 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 175.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -74.77 93.8 2.65 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 117.55 0.675 . . . . 0.0 110.991 173.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -85.63 85.0 7.43 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 173.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.6 t90 163.11 127.7 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 125.27 1.428 . . . . 0.0 108.552 -171.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 51.4 t 52.28 27.3 4.64 Favored 'General case' 0 N--CA 1.505 2.294 0 C-N-CA 124.184 0.994 . . . . 0.0 112.744 174.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.555 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.6 tm? -66.11 130.41 43.14 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.216 -176.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.4 t -57.22 104.44 0.16 Allowed 'General case' 0 N--CA 1.474 0.732 0 O-C-N 123.638 0.586 . . . . 0.0 110.957 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.824 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -51.72 -35.72 44.13 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.652 1.181 . . . . 0.0 112.897 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.8 m -63.97 -32.81 74.48 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.055 0.942 . . . . 0.0 112.286 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -71.6 -47.75 52.72 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.246 0.618 . . . . 0.0 112.041 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.472 ' HE1' HD23 ' A' ' 115' ' ' LEU . 8.3 t-105 -59.21 -47.77 84.11 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.284 0.564 . . . . 0.0 109.966 174.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.411 HE21 ' HG3' ' A' ' 90' ' ' GLU . 22.6 tp60 -60.31 -39.15 85.99 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.923 177.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -65.32 -43.28 91.47 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.137 0.575 . . . . 0.0 111.556 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.86 -24.98 60.94 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.244 0.217 . . . . 0.0 111.446 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.597 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 49.1 t80 -66.87 -48.52 68.55 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-O 120.909 0.385 . . . . 0.0 110.331 171.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.411 ' HG3' HE21 ' A' ' 86' ' ' GLN . 39.8 mt-10 -65.5 -27.05 68.2 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.807 0.843 . . . . 0.0 112.109 177.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.73 -2.31 22.83 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.348 0.659 . . . . 0.0 112.465 174.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.39 23.0 63.79 Favored Glycine 0 C--N 1.355 1.631 0 CA-C-N 116.662 -0.245 . . . . 0.0 113.542 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . 0.418 ' SD ' ' CD2' ' A' ' 52' ' ' PHE . 67.9 mtp -114.6 -86.06 0.6 Allowed 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 123.571 0.749 . . . . 0.0 111.129 -175.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.597 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 63.71 108.47 0.03 OUTLIER Pre-proline 0 CA--C 1.573 1.83 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 175.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -67.59 167.68 20.27 Favored 'Trans proline' 0 C--N 1.386 2.52 0 C-N-CA 123.367 2.711 . . . . 0.0 113.809 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.05 105.54 0.85 Allowed 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.396 2.064 . . . . 0.0 111.97 171.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.5 p -95.16 142.58 13.36 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 C-N-CA 123.631 0.773 . . . . 0.0 110.934 -176.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.9 m -75.14 94.55 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.834 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.424 HD11 ' HG2' ' A' ' 116' ' ' GLN . 3.3 mm? -58.9 -27.49 65.28 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 123.585 0.754 . . . . 0.0 112.352 173.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -69.62 -47.01 64.94 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.742 0.817 . . . . 0.0 112.085 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.6 t -92.97 -30.47 15.33 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -171.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.8 p -56.6 121.03 8.76 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 170.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -84.83 172.55 11.34 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.893 0.877 . . . . 0.0 112.106 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -72.55 -28.24 62.71 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 122.972 0.509 . . . . 0.0 111.015 -172.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.2 t -59.64 -25.97 65.13 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.63 0.772 . . . . 0.0 112.367 176.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.52 -37.65 70.73 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.885 0.874 . . . . 0.0 113.299 177.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.0 mp -65.81 2.78 0.93 Allowed 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -173.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 -98.4 -20.24 17.26 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 123.107 0.563 . . . . 0.0 111.618 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -109.07 -32.01 7.4 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.586 HG12 ' H ' ' A' ' 111' ' ' SER . 2.5 t -110.09 -166.06 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 CA-C-N 112.395 -2.184 . . . . 0.0 108.529 -178.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . 0.586 ' H ' HG12 ' A' ' 110' ' ' VAL . 58.2 p -140.73 156.05 46.29 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 121.591 -0.693 . . . . 0.0 109.594 164.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.2 tt -53.5 -45.47 69.7 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.275 0.63 . . . . 0.0 112.114 173.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.17 -39.47 82.6 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.314 0.645 . . . . 0.0 111.997 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -64.52 -36.22 83.49 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.543 0.737 . . . . 0.0 112.02 175.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.472 HD23 ' HE1' ' A' ' 85' ' ' TRP . 39.2 mt -66.82 -55.58 14.2 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-O 121.214 0.53 . . . . 0.0 109.671 177.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . 0.424 ' HG2' HD11 ' A' ' 99' ' ' LEU . 2.8 mt-30 -64.75 -34.88 79.37 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.27 1.028 . . . . 0.0 112.213 -172.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.8 -40.69 69.77 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.901 0.88 . . . . 0.0 112.656 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -123.76 47.61 2.01 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.288 0.635 . . . . 0.0 110.36 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.967 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 175.975 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.425 ' HB ' ' HG2' ' A' ' 103' ' ' GLU . 26.4 m . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.961 0.41 . . . . 0.0 110.704 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.498 HG21 ' HB2' ' A' ' 82' ' ' ALA . 26.2 t -131.37 112.98 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 124.267 1.027 . . . . 0.0 110.426 -177.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 81.6 m -107.09 108.04 19.32 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 171.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.414 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -145.12 153.74 41.72 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.28 1.032 . . . . 0.0 109.138 -176.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.668 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 27.8 tt0 -119.12 107.76 13.86 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 118.708 0.685 . . . . 0.0 111.88 177.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.591 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 81.5 mmm -84.8 114.47 22.1 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.102 0.961 . . . . 0.0 109.035 166.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.6 t -80.94 151.61 28.45 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 122.86 0.464 . . . . 0.0 110.301 -176.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.406 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 28.8 tt0 -56.84 -33.62 66.97 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 123.558 0.536 . . . . 0.0 111.706 -175.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -50.76 -55.69 15.56 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 124.165 0.986 . . . . 0.0 110.99 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -79.67 -29.61 40.93 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 124.661 1.185 . . . . 0.0 113.189 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.1 tp -82.69 -24.49 33.65 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.304 0.641 . . . . 0.0 111.894 -173.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 47' ' ' GLU . 63.8 mt -64.92 -34.03 77.42 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 122.885 0.474 . . . . 0.0 110.55 171.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -58.31 -44.46 88.6 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.13 0.572 . . . . 0.0 110.899 169.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.1 m . . . . . 0 N--CA 1.491 1.577 0 C-N-CA 123.201 0.6 . . . . 0.0 111.777 175.495 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.07 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 82.43 56.94 2.71 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.952 -174.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -147.03 107.21 4.02 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 123.683 0.793 . . . . 0.0 110.462 176.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.668 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 4.8 ptp180 -79.78 89.83 5.23 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.245 0.618 . . . . 0.0 111.606 -176.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 31.3 t-105 -178.06 122.07 0.1 Allowed 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.789 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 42.3 t 52.36 53.82 11.72 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.155 0.982 . . . . 0.0 112.226 174.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.414 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.3 tm? -92.99 124.24 36.82 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.626 -175.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 61.5 m -59.39 111.97 1.58 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.023 0.529 . . . . 0.0 109.995 173.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.498 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -57.47 -27.29 62.36 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -171.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.8 m -69.59 -28.76 66.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.396 0.679 . . . . 0.0 112.266 176.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -61.89 -45.11 95.18 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.803 0.841 . . . . 0.0 111.325 175.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.591 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 1.3 t-105 -70.85 -47.92 56.73 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.63 174.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.48 HE21 ' HG3' ' A' ' 90' ' ' GLU . 21.2 tp60 -56.15 -42.79 77.56 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.098 0.959 . . . . 0.0 111.665 -177.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -55.31 -45.54 76.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.724 0.81 . . . . 0.0 111.574 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.21 -37.76 86.57 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.457 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.529 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 51.6 t80 -71.9 -34.41 69.11 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 122.439 0.296 . . . . 0.0 111.649 178.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.48 ' HG3' HE21 ' A' ' 86' ' ' GLN . 58.3 mt-10 -69.45 -23.11 63.63 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.206 0.602 . . . . 0.0 111.754 178.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.61 -11.37 59.66 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.558 0.743 . . . . 0.0 111.99 170.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.81 8.8 86.31 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-N 116.496 -0.32 . . . . 0.0 112.995 -174.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 25.9 ttt -88.13 -77.95 0.34 Allowed 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 124.313 1.045 . . . . 0.0 110.135 -174.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.529 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 61.94 114.18 0.02 OUTLIER Pre-proline 0 N--CA 1.497 1.905 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 167.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.443 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 92.6 Cg_endo -74.6 171.46 18.12 Favored 'Trans proline' 0 CA--C 1.572 2.39 0 C-N-CA 122.824 2.349 . . . . 0.0 113.152 171.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.38 111.15 2.65 Favored 'Trans proline' 0 C--N 1.383 2.394 0 C-N-CA 122.057 1.838 . . . . 0.0 111.778 171.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -97.35 134.26 35.96 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 123.065 0.546 . . . . 0.0 110.525 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.1 m -67.97 98.78 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 123.954 0.902 . . . . 0.0 113.231 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.553 HD21 ' HB3' ' A' ' 115' ' ' LEU . 3.6 mm? -73.57 -13.4 61.02 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.743 -0.598 . . . . 0.0 112.062 172.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -83.18 -12.45 56.89 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 124.273 1.029 . . . . 0.0 112.418 176.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.2 t -130.73 -26.35 2.23 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -174.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.3 p -55.33 106.0 0.21 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.407 0.622 . . . . 0.0 112.098 170.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.455 ' HG3' ' H ' ' A' ' 105' ' ' SER . 15.1 tp10 -61.77 141.28 58.0 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 125.09 1.356 . . . . 0.0 110.968 168.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.465 ' HA ' HD13 ' A' ' 107' ' ' LEU . 21.5 ptmt -61.33 -17.52 54.19 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -177.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.455 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 69.6 m -58.19 -27.33 63.78 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 123.186 0.594 . . . . 0.0 112.594 171.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.05 -28.29 68.96 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.573 0.749 . . . . 0.0 112.712 173.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' A' ' 104' ' ' LYS . 7.9 mp -70.31 1.99 4.31 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 124.29 1.036 . . . . 0.0 113.65 -175.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 48.3 mtp180 -88.75 -35.29 16.77 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.143 0.577 . . . . 0.0 111.235 167.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -91.34 -49.47 6.33 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.212 1.005 . . . . 0.0 110.361 -174.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.58 HG21 ' HE1' ' A' ' 85' ' ' TRP . 6.9 p -106.08 176.02 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.367 0 C-N-CA 124.407 1.083 . . . . 0.0 108.496 169.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 47.0 m -116.17 153.26 32.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.975 -1.078 . . . . 0.0 109.992 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.8 tt -57.09 -36.5 70.67 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.511 0.724 . . . . 0.0 112.603 179.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.22 -34.16 73.26 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.5 -36.72 79.31 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.499 0.719 . . . . 0.0 110.526 175.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.553 ' HB3' HD21 ' A' ' 99' ' ' LEU . 85.6 mt -68.35 -52.74 29.91 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.376 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -73.77 -27.86 61.37 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 114.73 -1.123 . . . . 0.0 112.672 -172.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -66.97 -17.16 64.79 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 175.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -130.42 20.01 5.24 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 123.383 0.673 . . . . 0.0 111.955 172.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.959 0 C-N-CA 123.644 0.778 . . . . 0.0 110.475 168.497 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 105' ' ' SER . 60.3 p . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 121.461 0.648 . . . . 0.0 110.35 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.737 HG11 ' HB2' ' A' ' 82' ' ' ALA . 39.3 t -136.26 102.65 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 C-N-CA 123.615 0.766 . . . . 0.0 109.982 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.566 ' SG ' ' HA ' ' A' ' 78' ' ' TRP . 80.2 m -111.18 107.39 16.71 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 174.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.483 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -138.57 150.4 46.28 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -172.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 20.7 tt0 -116.96 130.24 56.57 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.775 0.322 . . . . 0.0 111.246 -175.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.421 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 37.6 mtm -116.33 154.24 30.56 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.409 173.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.498 HG22 ' HB3' ' A' ' 95' ' ' PRO . 9.2 t -92.91 156.22 17.08 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.755 0.822 . . . . 0.0 110.517 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.436 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 37.1 tt0 -54.38 -32.69 57.63 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.198 0.599 . . . . 0.0 112.313 -175.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -48.99 -53.17 21.05 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.622 1.169 . . . . 0.0 112.351 -176.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.463 ' HA ' ' HD2' ' A' ' 52' ' ' PHE . 53.8 t80 -71.05 -40.6 71.58 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 177.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 45' ' ' MET . 8.9 mp -63.78 -24.52 67.79 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.827 0.451 . . . . 0.0 111.36 -178.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.436 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 92.8 mt -71.28 -45.87 62.15 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.924 0.889 . . . . 0.0 110.939 170.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.463 ' HD2' ' HA ' ' A' ' 49' ' ' PHE . 25.9 m-85 -58.35 -31.76 67.9 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 123.121 0.568 . . . . 0.0 111.258 174.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 58.5 m . . . . . 0 CA--C 1.548 0.884 0 CA-C-N 115.542 -0.753 . . . . 0.0 110.979 173.533 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.81 0 CA-C-O 120.648 0.261 . . . . 0.0 111.592 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.75 -2.61 70.03 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 114.41 0.524 . . . . 0.0 114.41 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -97.09 123.06 40.74 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.079 0.551 . . . . 0.0 110.539 173.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.48 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.1 OUTLIER -114.89 91.22 3.55 Favored 'General case' 0 CA--C 1.574 1.88 0 CA-C-O 121.919 0.866 . . . . 0.0 110.437 176.643 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.566 ' HA ' ' SG ' ' A' ' 42' ' ' CYS . 75.0 t90 -172.28 124.49 0.5 Allowed 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.318 0.647 . . . . 0.0 110.098 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 86.9 m 50.59 26.13 2.31 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.483 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -66.31 118.52 10.1 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 6.4 p -61.98 105.92 0.64 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 122.993 0.517 . . . . 0.0 110.564 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.737 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -55.16 -23.61 22.37 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.953 1.301 . . . . 0.0 113.775 -176.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.7 m -58.92 -38.77 79.7 Favored 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 123.503 0.721 . . . . 0.0 112.425 173.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.3 mmm-85 -74.97 -36.12 62.05 Favored 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 123.726 0.81 . . . . 0.0 112.433 178.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.567 ' HE1' HD23 ' A' ' 115' ' ' LEU . 7.7 t-105 -64.88 -45.8 84.47 Favored 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 173.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -57.94 -43.89 86.6 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.85 0.86 . . . . 0.0 110.792 173.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -55.28 -38.32 68.44 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.515 1.126 . . . . 0.0 112.024 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.34 94.03 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 174.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -68.26 -40.25 81.95 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 122.586 0.354 . . . . 0.0 111.48 174.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -63.48 -33.34 75.35 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.016 0.926 . . . . 0.0 111.785 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.29 -15.97 25.24 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 123.843 0.857 . . . . 0.0 112.138 175.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.87 -20.93 37.5 Favored Glycine 0 CA--C 1.542 1.779 0 N-CA-C 115.202 0.841 . . . . 0.0 115.202 175.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -89.79 33.08 0.86 Allowed 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 118.054 0.927 . . . . 0.0 113.023 -174.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.22 112.79 4.54 Favored Pre-proline 0 CA--C 1.569 1.679 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.498 ' HB3' HG22 ' A' ' 46' ' ' THR . 57.4 Cg_exo -59.83 171.51 2.8 Favored 'Trans proline' 0 CA--C 1.568 2.182 0 C-N-CA 123.947 3.098 . . . . 0.0 114.825 172.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -80.1 113.15 2.92 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.719 2.279 . . . . 0.0 111.983 168.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 9.7 p -99.25 156.78 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 123.884 0.873 . . . . 0.0 110.642 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.516 HG21 ' HB3' ' A' ' 101' ' ' SER . 33.3 m -81.44 164.32 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.096 0 CA-C-O 121.608 0.718 . . . . 0.0 112.228 173.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 83.5 mt -112.55 -13.78 13.28 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.973 0.909 . . . . 0.0 110.056 163.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -71.6 -70.47 0.32 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.735 0.814 . . . . 0.0 111.208 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.516 ' HB3' HG21 ' A' ' 98' ' ' VAL . 34.6 t -66.26 -31.55 72.43 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.219 0.608 . . . . 0.0 112.061 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 76.2 m -62.67 127.38 31.04 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.61 0.764 . . . . 0.0 111.938 175.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -98.97 164.27 12.25 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.891 0.877 . . . . 0.0 110.842 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.457 ' HD3' HD22 ' A' ' 107' ' ' LEU . 3.0 tppp? -53.5 -32.83 52.01 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 125.422 1.489 . . . . 0.0 113.595 176.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 40' ' ' THR . 56.7 m -60.5 -26.06 66.54 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 178.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.68 -33.45 72.87 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.393 0.677 . . . . 0.0 112.667 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.457 HD22 ' HD3' ' A' ' 104' ' ' LYS . 8.8 mp -61.65 -24.46 66.75 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.923 0.889 . . . . 0.0 112.264 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -74.34 -11.49 60.27 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.978 0.911 . . . . 0.0 112.81 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -116.3 -48.99 2.69 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.041 0.937 . . . . 0.0 111.708 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.481 HG21 ' CD1' ' A' ' 85' ' ' TRP . 14.8 p -113.25 -24.33 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -169.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 46.2 t 75.2 148.17 0.1 Allowed 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 125.112 1.365 . . . . 0.0 112.607 -173.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.494 ' HA ' HD12 ' A' ' 115' ' ' LEU . 3.8 tt -58.59 -39.05 79.29 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.487 1.115 . . . . 0.0 112.149 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.72 -38.83 70.28 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.278 0.631 . . . . 0.0 112.686 -176.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -67.17 -44.74 78.96 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.589 0.756 . . . . 0.0 110.373 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.567 HD23 ' HE1' ' A' ' 85' ' ' TRP . 63.8 mt -58.99 -46.86 87.09 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.814 0.816 . . . . 0.0 110.114 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -74.98 -29.96 61.05 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 114.131 -1.395 . . . . 0.0 112.828 -176.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.91 -19.31 60.34 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.341 170.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -123.33 6.49 9.05 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.788 0.835 . . . . 0.0 112.489 178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.431 0 C-N-CA 123.374 0.669 . . . . 0.0 111.296 177.101 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.4 p . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 121.313 0.578 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.422 HG11 ' N ' ' A' ' 82' ' ' ALA . 28.6 t -123.8 103.47 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.434 0.694 . . . . 0.0 110.126 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 80.8 m -113.78 108.17 16.72 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 173.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -142.28 152.55 43.12 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.084 0.953 . . . . 0.0 109.384 -167.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.463 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 27.0 tt0 -122.74 126.8 48.21 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.548 ' HB2' HD11 ' A' ' 50' ' ' LEU . 18.7 mtm -119.89 136.67 54.41 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.617 0.767 . . . . 0.0 109.509 173.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 6.2 t -98.68 160.73 14.07 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 123.005 0.522 . . . . 0.0 111.764 -172.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -53.13 -35.38 59.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.345 1.058 . . . . 0.0 113.051 -171.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -55.17 -46.68 75.78 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 122.266 1.031 . . . . 0.0 110.529 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -79.6 -35.82 38.99 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.949 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.548 HD11 ' HB2' ' A' ' 45' ' ' MET . 10.5 mp -68.57 -36.89 79.36 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 117.709 0.231 . . . . 0.0 111.589 178.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.9 mt -64.02 -31.7 72.99 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.312 0.645 . . . . 0.0 111.579 177.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.542 ' HE2' ' HB1' ' A' ' 91' ' ' ALA . 87.2 t80 -61.71 -46.77 88.26 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.621 0.368 . . . . 0.0 110.871 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 45.2 m . . . . . 0 N--CA 1.483 1.221 0 C-N-CA 123.298 0.639 . . . . 0.0 112.386 -178.138 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.977 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.59 38.71 4.9 Favored Glycine 0 N--CA 1.475 1.251 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.998 -177.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -122.73 107.59 12.09 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.385 1.074 . . . . 0.0 110.681 -176.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.463 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 16.4 ptt-85 -84.06 89.98 7.37 Favored 'General case' 0 CA--C 1.555 1.172 0 CA-C-O 122.027 0.918 . . . . 0.0 111.559 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -138.16 -163.77 1.51 Allowed 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 125.251 1.421 . . . . 0.0 108.844 175.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 26.0 p -55.9 81.09 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 122.167 0.984 . . . . 0.0 111.246 169.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -85.28 -25.84 26.99 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.919 1.288 . . . . 0.0 110.118 -175.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 52.4 t 68.02 123.36 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.041 1.336 . . . . 0.0 111.148 -173.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.422 ' N ' HG11 ' A' ' 41' ' ' VAL . . . -55.69 -24.47 34.52 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.79 0.836 . . . . 0.0 112.658 -177.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.4 t -54.12 -47.08 72.21 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.985 0.914 . . . . 0.0 112.693 173.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -41.55 85.42 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 123.531 0.732 . . . . 0.0 112.536 -178.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.47 ' NE1' HG21 ' A' ' 110' ' ' VAL . 9.8 t-105 -71.35 -43.69 66.49 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 124.043 0.937 . . . . 0.0 110.535 -177.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -65.77 -37.66 86.92 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.936 0.895 . . . . 0.0 111.633 175.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.72 -44.16 97.46 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.54 0.736 . . . . 0.0 111.06 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.51 -30.1 71.13 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.46 0.704 . . . . 0.0 111.461 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.481 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 86.8 t80 -68.77 -46.4 68.87 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 123.01 0.524 . . . . 0.0 111.299 174.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -71.79 -16.6 62.19 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.459 0.704 . . . . 0.0 112.242 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.542 ' HB1' ' HE2' ' A' ' 52' ' ' PHE . . . -75.21 -2.7 29.14 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 123.7 0.8 . . . . 0.0 111.589 168.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 84.61 15.65 67.83 Favored Glycine 0 C--N 1.355 1.623 0 C-N-CA 123.63 0.634 . . . . 0.0 113.72 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.2 mmm -118.81 -79.04 0.59 Allowed 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.142 0.577 . . . . 0.0 112.057 -171.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.481 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 63.99 102.26 0.04 OUTLIER Pre-proline 0 N--CA 1.493 1.683 0 C-N-CA 125.0 1.32 . . . . 0.0 113.8 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.404 ' HG3' ' HB3' ' A' ' 45' ' ' MET . 59.6 Cg_endo -67.94 168.98 17.32 Favored 'Trans proline' 0 N--CA 1.504 2.131 0 C-N-CA 123.84 3.027 . . . . 0.0 114.954 177.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.99 109.69 1.77 Allowed 'Trans proline' 0 C--N 1.379 2.177 0 C-N-CA 122.658 2.239 . . . . 0.0 112.197 168.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.7 p -95.2 152.31 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.222 0.609 . . . . 0.0 110.592 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.5 p -90.75 105.42 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.422 0 CA-C-O 121.734 0.778 . . . . 0.0 110.937 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.519 HD21 ' HA ' ' A' ' 116' ' ' GLN . 5.8 mp -69.32 -40.54 77.55 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.737 1.215 . . . . 0.0 112.262 -171.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -68.62 -27.54 66.11 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.367 0.667 . . . . 0.0 111.86 -176.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 30.6 t -84.09 -29.64 26.63 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.198 0.599 . . . . 0.0 110.685 174.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 90.6 m -74.63 101.49 4.26 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.17 0.588 . . . . 0.0 110.414 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -67.97 156.6 36.92 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.56 0.744 . . . . 0.0 111.126 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.606 ' HA ' HD13 ' A' ' 107' ' ' LEU . 0.6 OUTLIER -63.12 -14.32 47.18 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.092 0.957 . . . . 0.0 113.129 -174.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 40.4 t -57.16 -39.22 74.83 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.226 0.61 . . . . 0.0 111.814 171.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.43 -22.37 61.11 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.916 0.886 . . . . 0.0 112.877 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.606 HD13 ' HA ' ' A' ' 104' ' ' LYS . 7.2 mp -63.97 -22.4 66.91 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 123.93 0.892 . . . . 0.0 112.199 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -78.55 -15.08 58.98 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.251 0.62 . . . . 0.0 111.268 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -110.97 -17.06 13.38 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.621 1.168 . . . . 0.0 113.334 -175.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.47 HG21 ' NE1' ' A' ' 85' ' ' TRP . 7.4 p -144.52 -23.76 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.0 t 80.34 139.74 0.07 Allowed 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 125.461 1.504 . . . . 0.0 112.851 -176.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.82 -38.19 87.26 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.535 1.134 . . . . 0.0 112.298 173.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.87 -32.43 69.46 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.153 0.581 . . . . 0.0 112.303 -175.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.78 -39.34 76.68 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.894 174.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.425 ' HB3' ' HG ' ' A' ' 99' ' ' LEU . 64.5 mt -69.16 -45.39 70.17 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.586 0.754 . . . . 0.0 110.298 -172.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . 0.519 ' HA ' HD21 ' A' ' 99' ' ' LEU . 61.1 mm-40 -62.64 -43.74 98.04 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.621 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -61.46 -29.83 70.21 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 115.264 -0.88 . . . . 0.0 113.216 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -91.67 -17.37 25.59 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 121.253 0.549 . . . . 0.0 111.002 168.02 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.0 p . . . . . 0 CA--C 1.563 1.447 0 CA-C-O 121.243 0.544 . . . . 0.0 112.16 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.1 t -131.53 137.08 56.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.282 0.633 . . . . 0.0 110.261 174.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 74.7 m -131.03 111.24 11.84 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.775 0.83 . . . . 0.0 110.051 174.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.549 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -141.28 151.92 44.06 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.826 0.851 . . . . 0.0 109.54 -172.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.619 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 23.8 tt0 -119.86 108.35 14.26 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 122.245 -0.284 . . . . 0.0 111.642 -176.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.553 ' SD ' ' HG3' ' A' ' 84' ' ' ARG . 56.2 mtp -93.38 130.02 39.32 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.053 0.541 . . . . 0.0 110.228 170.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.8 p -83.3 167.71 17.35 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.568 0.747 . . . . 0.0 109.578 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -62.75 -37.01 84.9 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 118.403 0.547 . . . . 0.0 110.842 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -54.31 -55.53 27.49 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 124.018 0.927 . . . . 0.0 111.544 176.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -78.13 -29.98 49.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.796 -176.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.11 -38.87 60.98 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.471 0.708 . . . . 0.0 110.237 -177.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 28.1 mt -62.91 -47.68 82.21 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.634 0.774 . . . . 0.0 110.778 169.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -65.01 -42.05 94.79 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -174.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 N--CA 1.492 1.665 0 C-N-CA 123.263 0.625 . . . . 0.0 110.773 177.559 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.394 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 67.57 40.9 90.68 Favored Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.627 -0.589 . . . . 0.0 111.627 -168.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -138.27 97.42 3.38 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 124.152 0.981 . . . . 0.0 109.013 -174.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.619 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 39.0 ptt85 -89.14 85.33 6.63 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.709 0.766 . . . . 0.0 112.716 -174.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 -159.26 120.42 3.27 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.474 0.71 . . . . 0.0 110.122 -173.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.0 t 62.47 9.83 3.63 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 170.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.549 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -67.6 110.63 3.78 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 44.1 t -61.44 132.41 53.34 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.372 0.669 . . . . 0.0 111.199 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.42 -22.81 62.0 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.6 m -58.27 -41.58 84.64 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 118.362 0.528 . . . . 0.0 112.04 172.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.553 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 6.9 tpm_? -69.2 -41.49 77.04 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.334 1.054 . . . . 0.0 111.841 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.463 ' NE1' HG11 ' A' ' 110' ' ' VAL . 0.5 OUTLIER -74.25 -54.6 7.38 Favored 'General case' 0 CA--C 1.563 1.457 0 C-N-CA 123.6 0.76 . . . . 0.0 110.841 179.571 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.492 ' HB2' HG12 ' A' ' 110' ' ' VAL . 32.4 tp60 -49.95 -40.68 44.54 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 177.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -61.79 -41.1 97.3 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 120.68 0.276 . . . . 0.0 111.049 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.5 70.6 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.927 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.69 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 54.0 t80 -67.03 -43.45 82.74 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.75 0.82 . . . . 0.0 110.782 171.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -69.4 -31.59 70.06 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.167 0.587 . . . . 0.0 112.466 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -78.96 -11.51 60.01 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.654 0.782 . . . . 0.0 111.577 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 107.1 -16.79 38.62 Favored Glycine 0 C--N 1.352 1.439 0 N-CA-C 114.934 0.734 . . . . 0.0 114.934 170.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -73.97 -70.43 0.39 Allowed 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 117.918 0.859 . . . . 0.0 111.021 -177.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.69 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 60.52 97.98 0.04 OUTLIER Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 124.745 1.218 . . . . 0.0 113.291 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.445 ' HB2' ' O ' ' A' ' 44' ' ' GLU . 94.5 Cg_endo -71.28 168.97 21.89 Favored 'Trans proline' 0 CA--C 1.568 2.182 0 C-N-CA 123.391 2.727 . . . . 0.0 113.563 175.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -66.46 118.64 5.69 Favored 'Trans proline' 0 C--N 1.381 2.276 0 C-N-CA 122.421 2.081 . . . . 0.0 112.784 176.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.602 HG13 ' HB2' ' A' ' 119' ' ' ALA . 7.7 p -105.97 158.27 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 123.497 0.719 . . . . 0.0 109.323 173.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.534 HG11 ' HD2' ' A' ' 77' ' ' ARG . 3.4 p -115.65 108.24 24.76 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 O-C-N 121.675 -0.641 . . . . 0.0 112.508 -170.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.442 ' HG ' ' HB1' ' A' ' 119' ' ' ALA . 97.0 mt -69.07 -28.91 66.95 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -83.67 40.0 0.71 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.607 0.763 . . . . 0.0 111.748 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.45 ' HB3' HG13 ' A' ' 98' ' ' VAL . 22.4 t -170.12 -24.67 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 124.521 1.129 . . . . 0.0 110.852 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.401 ' OG1' ' HA ' ' A' ' 99' ' ' LEU . 33.6 p -74.77 -176.84 3.0 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.729 0.776 . . . . 0.0 112.186 172.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -148.76 171.85 15.56 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.03 -177.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.525 ' HA ' HD13 ' A' ' 107' ' ' LEU . 0.5 OUTLIER -62.74 -17.72 61.38 Favored 'General case' 0 CA--C 1.564 1.512 0 C-N-CA 124.256 1.022 . . . . 0.0 110.98 167.888 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.2 m -57.56 -36.18 71.33 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.495 1.118 . . . . 0.0 112.255 169.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.456 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -63.49 -36.36 83.51 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.948 0.499 . . . . 0.0 111.236 176.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.5 mp -68.05 5.75 0.86 Allowed 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 124.906 1.282 . . . . 0.0 113.584 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -86.86 -23.72 25.16 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.526 0.73 . . . . 0.0 110.182 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -107.71 -50.92 2.98 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.717 1.207 . . . . 0.0 108.758 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.492 HG12 ' HB2' ' A' ' 86' ' ' GLN . 33.8 m -97.06 -172.67 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 CA-C-O 122.289 1.042 . . . . 0.0 111.919 176.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.1 t -113.97 158.52 21.04 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.347 158.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.509 ' HA ' HD12 ' A' ' 115' ' ' LEU . 2.5 tt -55.95 -34.98 66.16 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 122.518 0.327 . . . . 0.0 110.761 170.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.35 73.72 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.185 0.594 . . . . 0.0 112.308 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -73.09 -33.91 65.88 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 120.841 0.353 . . . . 0.0 110.183 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 112' ' ' LEU . 87.7 mt -68.35 -56.88 6.99 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 123.73 0.812 . . . . 0.0 110.634 178.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . 0.429 ' HG2' HD11 ' A' ' 99' ' ' LEU . 7.1 mt-30 -64.62 -30.94 71.96 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.418 1.087 . . . . 0.0 112.315 -170.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -52.3 -30.42 28.1 Favored 'General case' 0 CA--C 1.563 1.443 0 C-N-CA 123.89 0.876 . . . . 0.0 112.87 171.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -135.72 27.7 3.31 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 123.886 0.874 . . . . 0.0 112.488 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.602 ' HB2' HG13 ' A' ' 97' ' ' VAL . . . . . . . . 0 N--CA 1.497 1.89 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -177.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 40.7 p . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 121.325 0.583 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.435 HG11 ' HB2' ' A' ' 82' ' ' ALA . 21.4 t -135.16 102.22 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 C-N-CA 123.974 0.91 . . . . 0.0 109.334 171.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 61.6 m -108.03 104.3 13.72 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 170.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.427 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.73 144.01 32.5 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.325 1.05 . . . . 0.0 109.778 -173.449 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.503 ' HG3' ' HB3' ' A' ' 77' ' ' ARG . 1.7 mp0 -102.63 107.5 18.43 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 122.165 -0.335 . . . . 0.0 110.611 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.596 ' SD ' HD21 ' A' ' 80' ' ' LEU . 63.8 mtp -91.06 137.75 32.13 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 169.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.7 p -82.77 159.51 22.49 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 121.339 0.59 . . . . 0.0 111.713 -174.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -60.85 -28.6 68.95 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.54 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -50.98 -54.4 24.78 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.975 0.91 . . . . 0.0 112.096 174.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -74.86 -36.43 62.33 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.46 -26.8 65.67 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -78.59 -34.39 46.83 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.69 0.796 . . . . 0.0 110.877 168.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -62.31 -31.49 72.11 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 122.552 0.341 . . . . 0.0 110.631 170.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.3 m . . . . . 0 N--CA 1.485 1.297 0 C-N-CA 123.412 0.685 . . . . 0.0 110.757 175.932 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.373 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 83.53 -7.82 67.44 Favored Glycine 0 CA--C 1.543 1.809 0 N-CA-C 114.973 0.749 . . . . 0.0 114.973 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -113.02 148.18 35.66 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.33 0.652 . . . . 0.0 111.073 -178.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.503 ' HB3' ' HG3' ' A' ' 44' ' ' GLU . 27.1 ptt180 -111.12 101.76 10.26 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.544 0.738 . . . . 0.0 111.282 -177.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -163.41 118.83 1.68 Allowed 'General case' 0 N--CA 1.483 1.203 0 O-C-N 121.712 -0.617 . . . . 0.0 111.599 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.6 t 51.61 27.96 4.36 Favored 'General case' 0 N--CA 1.5 2.033 0 C-N-CA 123.93 0.892 . . . . 0.0 112.391 174.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.596 HD21 ' SD ' ' A' ' 45' ' ' MET . 3.1 tm? -66.3 126.69 29.55 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.939 0.895 . . . . 0.0 110.56 -171.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.418 ' SG ' ' HB2' ' A' ' 83' ' ' SER . 43.4 t -64.16 101.3 0.4 Allowed 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 122.924 0.49 . . . . 0.0 110.863 177.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.435 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -56.86 -24.74 53.79 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.86 0.864 . . . . 0.0 113.018 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.418 ' HB2' ' SG ' ' A' ' 81' ' ' CYS . 54.4 m -61.61 -48.88 78.9 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.851 0.46 . . . . 0.0 111.296 171.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -59.35 -39.01 81.83 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 122.707 0.403 . . . . 0.0 112.061 179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.748 ' HE1' HD23 ' A' ' 115' ' ' LEU . 13.1 t-105 -66.63 -52.71 42.13 Favored 'General case' 0 CA--C 1.569 1.689 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.132 174.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.467 ' HB2' HG12 ' A' ' 110' ' ' VAL . 34.2 tp60 -49.54 -47.28 49.17 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 176.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -35.44 77.52 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.576 0.75 . . . . 0.0 111.903 177.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.407 ' HB1' ' HA ' ' A' ' 94' ' ' ALA . . . -61.9 -39.12 90.9 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.097 0.559 . . . . 0.0 111.89 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.603 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 68.8 t80 -60.42 -51.73 68.24 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.164 0.507 . . . . 0.0 110.771 175.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -71.6 -19.49 62.12 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.476 -177.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.28 -11.45 46.44 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.692 0.797 . . . . 0.0 112.36 175.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.96 10.4 85.12 Favored Glycine 0 CA--C 1.542 1.757 0 N-CA-C 114.091 0.396 . . . . 0.0 114.091 -176.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 94.2 mmm -112.83 27.98 9.17 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.346 1.058 . . . . 0.0 110.725 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.603 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -67.76 117.45 48.15 Favored Pre-proline 0 CA--C 1.558 1.276 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 -178.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 94' ' ' ALA . 52.6 Cg_endo -67.05 174.81 6.35 Favored 'Trans proline' 0 CA--C 1.566 2.093 0 C-N-CA 123.074 2.516 . . . . 0.0 113.079 168.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.1 145.62 55.7 Favored 'Trans proline' 0 C--N 1.376 1.981 0 C-N-CA 121.522 1.481 . . . . 0.0 112.169 166.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.402 HG23 ' HB1' ' A' ' 43' ' ' ALA . 11.8 p -131.62 153.37 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.735 0.814 . . . . 0.0 108.99 174.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.532 HG21 ' HB3' ' A' ' 101' ' ' SER . 30.8 m -85.63 165.84 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-O 121.144 0.497 . . . . 0.0 111.302 173.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 86.4 mt -107.13 -26.06 11.28 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.609 0.764 . . . . 0.0 110.676 169.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -74.39 -60.33 2.32 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.503 0.721 . . . . 0.0 111.479 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.532 ' HB3' HG21 ' A' ' 98' ' ' VAL . 40.8 t -77.35 -25.33 50.94 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 179.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.492 ' H ' HG23 ' A' ' 98' ' ' VAL . 88.6 m -73.83 105.39 5.09 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 172.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -78.26 160.61 27.81 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.454 -175.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.535 ' HA ' HD13 ' A' ' 107' ' ' LEU . 27.9 mmtp -71.66 -12.85 61.54 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -169.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 16.6 t -61.94 -25.54 67.65 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 122.983 0.513 . . . . 0.0 111.369 170.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.446 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -57.02 -33.99 67.73 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.626 0.77 . . . . 0.0 112.888 172.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.535 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.4 mp -65.73 5.64 0.43 Allowed 'General case' 0 N--CA 1.503 2.224 0 C-N-CA 124.813 1.245 . . . . 0.0 113.588 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 46.2 mtp180 -94.57 -19.15 20.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.714 0.805 . . . . 0.0 110.28 175.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 34.7 m-85 -106.94 -51.4 2.93 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.099 1.359 . . . . 0.0 108.673 178.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.467 HG12 ' HB2' ' A' ' 86' ' ' GLN . 33.0 m -92.55 -170.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.017 170.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.3 t -120.27 163.46 17.76 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 114.638 -1.164 . . . . 0.0 108.103 155.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.7 tt -56.79 -31.87 65.1 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.571 0.349 . . . . 0.0 111.238 173.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.2 -41.44 79.36 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.702 0.801 . . . . 0.0 112.756 178.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -70.09 -33.54 72.01 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.192 0.597 . . . . 0.0 110.519 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.748 HD23 ' HE1' ' A' ' 85' ' ' TRP . 80.4 mt -67.69 -54.88 15.89 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.639 178.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -63.45 -37.07 85.89 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.341 1.056 . . . . 0.0 112.056 -175.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.78 -21.94 12.71 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -130.12 21.5 5.31 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.6 0.76 . . . . 0.0 111.681 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.552 0 C-N-CA 123.837 0.855 . . . . 0.0 111.926 176.742 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.519 ' HB ' ' HB3' ' A' ' 105' ' ' SER . 1.7 m . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.531 HG22 ' HA ' ' A' ' 106' ' ' ALA . 34.5 t -138.41 100.4 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.978 0 C-N-CA 124.662 1.185 . . . . 0.0 110.206 -174.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 62.8 m -101.14 103.63 14.7 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 166.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.429 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -134.55 147.48 50.29 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 -176.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.436 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 26.1 tt0 -120.29 109.55 15.52 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.213 0.53 . . . . 0.0 111.258 -169.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.588 ' HB2' HD11 ' A' ' 50' ' ' LEU . 73.6 mmm -93.94 150.93 19.93 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.22 1.008 . . . . 0.0 110.656 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 70.2 p -82.94 155.88 23.79 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 171.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.565 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 24.5 tt0 -58.98 -27.37 65.33 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.837 0.455 . . . . 0.0 112.015 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -49.06 -38.4 24.06 Favored 'General case' 0 CA--C 1.566 1.591 0 C-N-CA 123.923 0.889 . . . . 0.0 111.816 170.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -73.56 -53.03 11.5 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 172.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.0 mp -66.76 -25.51 66.53 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -170.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.565 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 92.1 mt -73.57 -40.5 63.87 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.891 0.876 . . . . 0.0 110.76 171.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -60.71 -46.73 89.26 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.312 0.645 . . . . 0.0 110.958 174.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.1 t . . . . . 0 N--CA 1.481 1.094 0 C-N-CA 123.627 0.771 . . . . 0.0 111.805 -179.638 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.94 0 CA-C-O 121.18 0.514 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 116.16 31.29 1.9 Allowed Glycine 0 CA--C 1.539 1.556 0 CA-C-N 115.67 -0.695 . . . . 0.0 113.776 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -122.15 113.78 19.97 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-N 117.28 0.54 . . . . 0.0 110.592 169.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.436 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 13.0 ptp180 -69.8 89.82 0.58 Allowed 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 121.935 0.874 . . . . 0.0 111.178 177.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 26.4 t90 -177.61 140.81 0.27 Allowed 'General case' 0 N--CA 1.491 1.612 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.976 -171.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 44.9 t 50.79 31.85 6.47 Favored 'General case' 0 N--CA 1.508 2.459 0 C-N-CA 124.773 1.229 . . . . 0.0 113.702 167.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.462 HD22 ' HD2' ' A' ' 84' ' ' ARG . 3.0 tm? -81.62 -33.29 31.54 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 118.847 -0.597 . . . . 0.0 111.889 -171.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 37.6 t 65.12 121.8 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 123.463 0.705 . . . . 0.0 111.58 -175.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.513 ' H ' HG21 ' A' ' 41' ' ' VAL . . . -61.23 -29.88 70.1 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -170.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.5 m -57.76 -33.5 68.58 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.668 0.787 . . . . 0.0 112.551 176.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.462 ' HD2' HD22 ' A' ' 80' ' ' LEU . 30.2 ttm180 -73.43 -45.43 54.51 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.791 0.836 . . . . 0.0 111.324 -174.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.552 ' HE1' HD23 ' A' ' 115' ' ' LEU . 1.6 t-105 -74.23 -52.08 13.44 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.55 0.74 . . . . 0.0 111.277 176.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.435 ' OE1' HG12 ' A' ' 110' ' ' VAL . 34.2 tp60 -51.67 -37.73 51.86 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.044 0.938 . . . . 0.0 112.948 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -62.72 -42.74 99.81 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.768 0.427 . . . . 0.0 111.395 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.71 -33.8 76.45 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.338 0.655 . . . . 0.0 111.913 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -61.17 -51.4 69.22 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.51 0.724 . . . . 0.0 111.041 174.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.72 -25.56 63.91 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.411 0.685 . . . . 0.0 112.266 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.38 -14.39 58.99 Favored 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 123.54 0.736 . . . . 0.0 111.699 171.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.73 -20.18 29.31 Favored Glycine 0 C--N 1.353 1.48 0 N-CA-C 114.448 0.539 . . . . 0.0 114.448 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 4.5 ppp? -84.56 5.18 28.76 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -171.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.462 ' HB1' ' CZ3' ' A' ' 85' ' ' TRP . . . -54.14 131.99 60.02 Favored Pre-proline 0 CA--C 1.564 1.518 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.9 174.89 10.49 Favored 'Trans proline' 0 CA--C 1.565 2.055 0 C-N-CA 123.484 2.789 . . . . 0.0 113.585 172.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.95 124.46 13.58 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.151 1.901 . . . . 0.0 112.446 166.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.09 137.86 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.581 0.752 . . . . 0.0 110.597 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.49 HG13 ' HB3' ' A' ' 101' ' ' SER . 4.5 p -68.44 103.4 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.572 1.812 0 CA-C-O 121.902 0.858 . . . . 0.0 112.066 179.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 86.7 mt -58.41 -40.89 83.67 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 124.845 1.258 . . . . 0.0 112.694 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -78.52 7.04 7.31 Favored 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -175.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.49 ' HB3' HG13 ' A' ' 98' ' ' VAL . 40.9 t -118.42 -25.31 6.55 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 122.952 0.501 . . . . 0.0 111.973 173.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.2 p -69.16 115.21 8.19 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.583 0.353 . . . . 0.0 111.14 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.6 mp0 -64.44 160.8 18.4 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.007 0.523 . . . . 0.0 111.978 175.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.418 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 3.3 tmtp? -66.06 -27.63 68.23 Favored 'General case' 0 CA--C 1.561 1.402 0 CA-C-O 121.191 0.52 . . . . 0.0 109.754 174.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.519 ' HB3' ' HB ' ' A' ' 40' ' ' THR . 45.3 t -60.12 -28.76 68.13 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.248 0.619 . . . . 0.0 111.794 173.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.531 ' HA ' HG22 ' A' ' 41' ' ' VAL . . . -65.2 -44.21 89.08 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 122.813 0.445 . . . . 0.0 111.282 171.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.427 ' HA ' HG23 ' A' ' 110' ' ' VAL . 9.5 mp -64.45 6.19 0.22 Allowed 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 125.463 1.505 . . . . 0.0 113.741 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -95.99 -14.71 22.8 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.475 0.71 . . . . 0.0 110.459 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -114.39 -41.21 3.49 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.664 1.186 . . . . 0.0 108.469 178.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.532 HG21 HD21 ' A' ' 115' ' ' LEU . 1.7 m -92.99 -168.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.861 0.839 . . . . 0.0 110.739 164.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.3 t -131.01 156.01 45.85 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.949 1.3 . . . . 0.0 107.886 160.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 tt -49.28 -39.21 29.9 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.995 0.518 . . . . 0.0 111.625 170.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.1 77.05 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.206 0.602 . . . . 0.0 112.495 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -68.43 -32.86 73.18 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.792 0.437 . . . . 0.0 111.025 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.552 HD23 ' HE1' ' A' ' 85' ' ' TRP . 29.5 mt -73.26 -55.64 6.16 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.902 -178.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -66.0 -24.31 66.75 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.78 1.232 . . . . 0.0 112.993 -176.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -53.21 -34.27 56.35 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 174.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 69.3 m-70 -115.19 -23.02 9.16 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.365 0.666 . . . . 0.0 112.415 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.256 0 C-N-CA 123.321 0.648 . . . . 0.0 112.157 -179.64 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 103' ' ' GLU . 4.9 t . . . . . 0 N--CA 1.484 1.243 0 CA-C-O 120.983 0.42 . . . . 0.0 110.695 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.6 t -138.34 111.89 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 C-N-CA 123.255 0.622 . . . . 0.0 110.353 -178.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 72.2 m -101.42 106.41 17.55 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 171.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.546 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -139.53 147.92 41.9 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.36 0.664 . . . . 0.0 109.689 -175.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -106.61 112.79 25.94 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.461 0.304 . . . . 0.0 111.375 -172.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.477 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 29.7 mtm -110.0 137.68 47.43 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.044 170.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.1 p -83.7 167.98 16.69 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.602 0.761 . . . . 0.0 111.689 -171.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.404 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 28.4 tt0 -61.12 -30.37 70.33 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.506 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -49.56 -55.33 13.85 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.962 0.905 . . . . 0.0 111.509 174.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -76.22 -37.6 57.53 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' A' ' 45' ' ' MET . 10.9 mp -67.41 -33.74 75.8 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 118.351 0.523 . . . . 0.0 111.706 -177.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.404 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 68.6 mt -72.61 -27.88 62.43 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.239 0.616 . . . . 0.0 111.245 170.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -73.83 -34.07 64.41 Favored 'General case' 0 CA--C 1.563 1.47 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 172.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 73.3 m . . . . . 0 N--CA 1.494 1.771 0 C-N-CA 123.312 0.645 . . . . 0.0 112.599 -175.362 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.047 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.79 -1.38 58.09 Favored Glycine 0 N--CA 1.475 1.272 0 CA-C-N 115.704 -0.68 . . . . 0.0 113.883 177.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.03 104.42 6.55 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.184 0.516 . . . . 0.0 111.675 178.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.572 ' HD3' HG11 ' A' ' 98' ' ' VAL . 13.7 ptt180 -81.19 91.65 6.2 Favored 'General case' 0 CA--C 1.557 1.221 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.03 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -168.51 120.88 0.82 Allowed 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.232 0.613 . . . . 0.0 110.271 176.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 48.5 t 51.62 25.23 2.69 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 124.166 0.986 . . . . 0.0 112.648 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.546 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.4 tm? -66.86 123.4 20.05 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.081 0.952 . . . . 0.0 109.536 -177.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.444 ' SG ' ' HB3' ' A' ' 83' ' ' SER . 42.6 t -59.01 102.35 0.12 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.224 0.609 . . . . 0.0 110.924 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.96 -26.89 62.89 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.922 0.889 . . . . 0.0 112.223 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.444 ' HB3' ' SG ' ' A' ' 81' ' ' CYS . 45.7 t -67.25 -41.46 85.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.566 0.746 . . . . 0.0 111.483 172.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 56.4 ttm-85 -73.89 -31.62 63.2 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.004 0.522 . . . . 0.0 111.843 179.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.624 ' HE1' HD23 ' A' ' 115' ' ' LEU . 6.0 t-105 -64.45 -42.1 96.16 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 169.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.433 HE21 ' HG2' ' A' ' 90' ' ' GLU . 22.5 tp60 -58.18 -38.08 76.0 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.708 0.403 . . . . 0.0 110.85 174.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 83' ' ' SER . 41.6 mm-40 -62.18 -39.13 91.66 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.893 0.477 . . . . 0.0 111.774 176.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.53 -41.23 96.51 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.152 0.501 . . . . 0.0 111.393 174.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.759 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 40.2 t80 -67.41 -42.59 82.99 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.41 -176.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.433 ' HG2' HE21 ' A' ' 86' ' ' GLN . 14.4 mm-40 -77.03 -32.24 56.9 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.324 0.649 . . . . 0.0 111.988 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.88 -22.93 62.22 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.028 0.531 . . . . 0.0 111.74 176.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 106.33 -11.01 43.44 Favored Glycine 0 N--CA 1.476 1.328 0 CA-C-O 119.717 -0.491 . . . . 0.0 114.275 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . 0.414 ' N ' ' SD ' ' A' ' 93' ' ' MET . 1.1 mpt? -66.79 -66.91 0.49 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 117.41 0.605 . . . . 0.0 109.947 176.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.759 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 48.14 87.34 0.13 Allowed Pre-proline 0 CA--C 1.558 1.269 0 C-N-CA 125.135 1.374 . . . . 0.0 114.018 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -64.85 158.22 52.23 Favored 'Trans proline' 0 CA--C 1.566 2.076 0 C-N-CA 123.18 2.586 . . . . 0.0 113.409 172.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -68.29 109.44 2.0 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.362 2.042 . . . . 0.0 112.35 173.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.7 p -95.99 137.01 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 123.672 0.789 . . . . 0.0 110.916 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.572 HG11 ' HD3' ' A' ' 77' ' ' ARG . 5.5 p -77.34 107.77 9.4 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.741 0 C-N-CA 123.953 0.901 . . . . 0.0 113.076 -174.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 98.6 mt -67.79 -36.81 81.1 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.823 0.849 . . . . 0.0 112.52 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -78.43 20.51 0.41 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.624 0.77 . . . . 0.0 112.769 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.0 t -142.79 -44.23 0.31 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.688 0.795 . . . . 0.0 111.324 175.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.7 m -56.88 121.49 10.02 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 123.862 0.865 . . . . 0.0 112.737 -173.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 40' ' ' THR . 1.9 mp0 -74.14 166.8 22.79 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.034 0.933 . . . . 0.0 113.071 -173.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.402 ' HA ' HD13 ' A' ' 107' ' ' LEU . 32.9 mmtp -68.59 -13.42 62.33 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.101 0.96 . . . . 0.0 113.034 -177.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.5 t -57.35 -48.68 78.38 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 122.971 0.509 . . . . 0.0 110.613 172.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.58 -32.49 63.09 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.536 0.734 . . . . 0.0 112.82 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.455 ' HG ' ' HB2' ' A' ' 112' ' ' LEU . 8.6 mp -66.16 -22.81 66.38 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.007 0.523 . . . . 0.0 112.371 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.2 mtt85 -89.32 -7.49 55.23 Favored 'General case' 0 CA--C 1.561 1.393 0 C-N-CA 123.686 0.794 . . . . 0.0 112.78 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -117.9 -57.97 2.05 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 123.331 0.652 . . . . 0.0 112.057 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.45 HG21 ' CD1' ' A' ' 85' ' ' TRP . 13.3 p -98.66 -25.75 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 C-N-CA 123.589 0.756 . . . . 0.0 111.767 -176.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 46.8 t 77.58 149.46 0.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 125.689 1.596 . . . . 0.0 112.394 -173.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.555 ' HA ' HD12 ' A' ' 115' ' ' LEU . 4.6 tt -61.31 -37.12 82.08 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.713 1.205 . . . . 0.0 113.021 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.47 -34.8 76.08 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -173.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.35 -34.0 72.12 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.103 0.961 . . . . 0.0 111.481 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.624 HD23 ' HE1' ' A' ' 85' ' ' TRP . 57.4 mt -69.15 -48.01 63.45 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 121.943 0.877 . . . . 0.0 110.434 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -70.26 -37.87 74.99 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.848 -175.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -57.69 -16.74 11.79 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -132.35 39.12 3.42 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.392 0.677 . . . . 0.0 111.56 173.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.193 0 C-N-CA 123.175 0.59 . . . . 0.0 111.294 170.471 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.8 p . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 121.462 0.649 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.646 HG11 ' HB2' ' A' ' 82' ' ' ALA . 18.6 t -127.23 127.81 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.686 0.794 . . . . 0.0 109.954 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.409 ' SG ' ' HA ' ' A' ' 78' ' ' TRP . 93.6 m -136.39 108.86 7.38 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 168.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.577 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -140.43 150.77 44.25 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.123 0.969 . . . . 0.0 109.22 -170.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.448 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 20.2 tt0 -114.76 124.5 51.94 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.984 0.421 . . . . 0.0 111.812 -177.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.417 ' HE3' ' HB3' ' A' ' 45' ' ' MET . 67.1 mmm -108.21 138.46 44.45 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.079 0.951 . . . . 0.0 109.775 175.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 7.0 t -85.5 156.44 20.78 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.865 0.466 . . . . 0.0 110.398 174.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.541 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 37.6 tt0 -61.25 -29.29 69.75 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.065 0.546 . . . . 0.0 111.624 -175.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -48.3 -45.92 35.54 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 124.327 1.051 . . . . 0.0 111.845 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -76.93 -39.96 48.85 Favored 'General case' 0 CA--C 1.558 1.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.274 174.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.28 -26.1 68.34 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.541 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 95.9 mt -74.27 -47.47 34.72 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.691 0.796 . . . . 0.0 109.763 172.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -58.4 -31.77 68.01 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.642 0.777 . . . . 0.0 111.9 174.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.488 1.465 0 C-N-CA 123.535 0.734 . . . . 0.0 110.857 177.307 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.78 0 CA-C-O 120.332 0.111 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 109.86 -10.46 32.14 Favored Glycine 0 N--CA 1.477 1.429 0 CA-C-N 116.743 -0.208 . . . . 0.0 113.521 -174.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -85.61 83.98 7.73 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.306 0.642 . . . . 0.0 111.211 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.448 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -85.04 86.28 7.4 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-O 121.236 0.541 . . . . 0.0 111.57 179.592 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.409 ' HA ' ' SG ' ' A' ' 42' ' ' CYS . 42.3 t90 179.32 122.62 0.05 Allowed 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.916 0.886 . . . . 0.0 109.449 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 84.9 m 57.9 25.81 12.56 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 124.138 0.975 . . . . 0.0 113.209 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.577 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.8 tm? -66.38 124.16 21.97 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.389 0.676 . . . . 0.0 109.423 175.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 59.0 m -61.39 105.68 0.54 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.309 0.644 . . . . 0.0 109.506 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.646 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -59.22 -23.63 62.47 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -169.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.9 m -63.77 -30.19 71.31 Favored 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 123.325 0.65 . . . . 0.0 112.347 175.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -57.3 -47.43 81.5 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 124.304 1.041 . . . . 0.0 110.291 171.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.72 ' HE1' HD23 ' A' ' 115' ' ' LEU . 13.5 t-105 -71.74 -41.26 68.68 Favored 'General case' 0 CA--C 1.565 1.532 0 CA-C-N 114.325 -1.307 . . . . 0.0 111.964 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -63.4 -48.08 79.32 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.959 0.904 . . . . 0.0 111.114 -177.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.73 -28.59 67.77 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.348 0.659 . . . . 0.0 111.57 178.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.55 -41.06 96.57 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.208 0.603 . . . . 0.0 111.67 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.764 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 84.9 t80 -67.09 -48.36 68.41 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.977 176.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.28 -25.19 67.94 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.67 0.788 . . . . 0.0 112.354 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.55 -22.62 50.76 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.639 0.775 . . . . 0.0 111.78 175.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.92 -4.74 42.12 Favored Glycine 0 C--N 1.351 1.402 0 N-CA-C 114.259 0.464 . . . . 0.0 114.259 176.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . 0.443 ' N ' ' SD ' ' A' ' 93' ' ' MET . 1.5 mpt? -84.57 -73.62 0.42 Allowed 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 117.314 0.557 . . . . 0.0 109.963 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.764 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 58.07 95.17 0.05 OUTLIER Pre-proline 0 CA--C 1.565 1.541 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 178.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -55.62 161.58 7.6 Favored 'Trans proline' 0 CA--C 1.564 1.981 0 C-N-CA 123.748 2.965 . . . . 0.0 114.972 169.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.01 117.42 5.09 Favored 'Trans proline' 0 C--N 1.372 1.795 0 C-N-CA 122.332 2.021 . . . . 0.0 111.759 169.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.491 HG11 ' HA ' ' A' ' 115' ' ' LEU . 14.2 p -99.68 159.71 3.54 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 123.691 0.796 . . . . 0.0 110.609 -177.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 m -92.67 99.98 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 124.215 1.006 . . . . 0.0 112.346 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.608 HD11 ' HG2' ' A' ' 116' ' ' GLN . 4.7 mt -74.23 -16.81 60.95 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.305 -0.872 . . . . 0.0 111.717 170.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -74.42 -12.31 60.47 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 123.817 0.847 . . . . 0.0 112.205 174.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.9 t -128.37 -40.53 1.61 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.016 0.526 . . . . 0.0 112.079 -175.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 55.0 p -55.34 99.3 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 CA-C-O 121.172 0.51 . . . . 0.0 111.838 171.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.544 ' HG3' ' H ' ' A' ' 105' ' ' SER . 12.7 tp10 -66.17 154.6 39.3 Favored 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 123.937 0.895 . . . . 0.0 110.781 172.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -56.54 -23.27 38.82 Favored 'General case' 0 CA--C 1.565 1.525 0 C-N-CA 124.237 1.015 . . . . 0.0 112.055 177.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.544 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 25.1 m -58.2 -27.66 64.1 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.99 0.916 . . . . 0.0 112.649 176.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.492 ' HA ' HG22 ' A' ' 41' ' ' VAL . . . -61.78 -23.43 66.18 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.229 1.012 . . . . 0.0 113.045 178.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.411 HD21 ' HB2' ' A' ' 112' ' ' LEU . 9.6 mp -67.37 -3.7 8.97 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -178.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -70.88 -33.38 70.54 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 122.059 -0.401 . . . . 0.0 111.533 167.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.574 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 49.5 m-85 -112.43 -23.43 10.32 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.054 0.942 . . . . 0.0 111.582 -171.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.496 ' HB ' ' HB1' ' A' ' 82' ' ' ALA . 4.9 p -129.69 -178.43 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.456 0 C-N-CA 123.832 0.853 . . . . 0.0 109.613 177.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . 0.472 ' H ' HG22 ' A' ' 110' ' ' VAL . 27.2 p -109.89 164.2 12.81 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.494 -0.754 . . . . 0.0 110.739 170.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.411 ' HB2' HD21 ' A' ' 107' ' ' LEU . 4.6 tt -66.02 -39.45 90.23 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.433 0.693 . . . . 0.0 111.075 171.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.5 -33.83 74.46 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.437 0.695 . . . . 0.0 112.282 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.93 -50.22 73.27 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.269 0.628 . . . . 0.0 111.074 169.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.72 HD23 ' HE1' ' A' ' 85' ' ' TRP . 20.2 mt -65.8 -48.77 70.62 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.077 -172.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . 0.608 ' HG2' HD11 ' A' ' 99' ' ' LEU . 7.0 mt-30 -71.49 -26.81 62.84 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.1 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -61.35 -35.76 78.32 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 173.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -126.47 27.71 6.1 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.338 0.655 . . . . 0.0 112.215 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.232 0 C-N-CA 124.157 0.983 . . . . 0.0 110.643 172.258 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 26.1 p . . . . . 0 N--CA 1.499 1.987 0 CA-C-O 121.533 0.683 . . . . 0.0 111.778 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.6 t -136.8 107.45 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 C-N-CA 124.659 1.184 . . . . 0.0 109.102 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 93.5 m -113.28 110.72 20.84 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.702 -0.624 . . . . 0.0 111.271 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.54 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -139.12 149.9 45.04 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.934 1.294 . . . . 0.0 108.392 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.591 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 22.1 tt0 -121.53 114.88 21.84 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.139 0.495 . . . . 0.0 111.447 -178.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.433 ' HB2' HD11 ' A' ' 50' ' ' LEU . 72.2 mmm -89.0 142.82 27.31 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.216 1.006 . . . . 0.0 111.205 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 51.9 p -86.58 151.3 23.57 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.059 0.544 . . . . 0.0 109.641 178.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -54.87 -33.49 61.93 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 123.218 0.607 . . . . 0.0 112.465 -174.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -49.12 -46.95 45.71 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 125.231 1.412 . . . . 0.0 111.911 174.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -77.89 -33.99 51.7 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.433 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.2 mp -71.25 -31.79 67.95 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 120.869 0.366 . . . . 0.0 110.448 174.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 48.7 mt -75.54 -29.9 59.56 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.028 0.931 . . . . 0.0 111.52 174.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -65.03 -49.28 70.77 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.3 t . . . . . 0 N--CA 1.492 1.629 0 C-N-CA 123.563 0.745 . . . . 0.0 110.805 175.985 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.924 0 CA-C-O 120.661 0.267 . . . . 0.0 111.558 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.49 22.31 14.73 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 114.164 0.425 . . . . 0.0 114.164 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -114.45 96.22 5.65 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.199 0.599 . . . . 0.0 110.129 169.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.591 ' HB2' ' HB2' ' A' ' 44' ' ' GLU . 56.2 ttp180 -92.26 85.8 5.54 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 174.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 6.7 m-90 -167.4 119.48 0.91 Allowed 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 124.195 0.998 . . . . 0.0 109.071 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 31.1 p 44.93 33.76 1.08 Allowed 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.651 1.18 . . . . 0.0 113.143 175.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.54 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.0 tm? -63.28 118.08 7.51 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.161 0.984 . . . . 0.0 110.117 -176.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 41.4 t -53.1 119.22 4.45 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.593 0.757 . . . . 0.0 110.552 175.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.66 -31.59 26.17 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.834 0.853 . . . . 0.0 112.848 -174.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 73.1 m -57.27 -36.89 71.57 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 176.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.436 ' HG2' HD21 ' A' ' 80' ' ' LEU . 11.3 tpp180 -59.83 -53.35 58.94 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.194 0.597 . . . . 0.0 111.83 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.533 ' CD1' HG21 ' A' ' 110' ' ' VAL . 2.8 t-105 -75.26 -51.51 13.11 Favored 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 123.597 0.759 . . . . 0.0 111.007 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.588 ' HB2' HG23 ' A' ' 110' ' ' VAL . 47.0 tp60 -61.65 -42.25 98.64 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.603 0.761 . . . . 0.0 112.928 -172.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -69.86 -30.37 67.82 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 117.706 0.23 . . . . 0.0 111.594 -178.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.99 -34.85 78.41 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 122.92 0.488 . . . . 0.0 110.755 170.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.608 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 80.6 t80 -72.55 -43.49 63.39 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.998 0.919 . . . . 0.0 111.462 176.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 86' ' ' GLN . 49.8 mt-10 -66.52 -38.27 86.84 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.858 0.863 . . . . 0.0 111.404 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.13 -20.41 62.32 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.751 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 122.94 -20.87 7.57 Favored Glycine 0 C--N 1.357 1.738 0 N-CA-C 115.179 0.831 . . . . 0.0 115.179 170.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -81.76 -79.97 0.16 Allowed 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 117.721 0.761 . . . . 0.0 111.751 -171.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.608 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 65.91 124.51 0.03 OUTLIER Pre-proline 0 N--CA 1.499 1.999 0 C-N-CA 125.022 1.329 . . . . 0.0 114.409 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -77.39 172.08 16.55 Favored 'Trans proline' 0 CA--C 1.567 2.14 0 C-N-CA 122.959 2.439 . . . . 0.0 113.011 172.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.35 108.27 2.16 Favored 'Trans proline' 0 CA--C 1.565 2.058 0 C-N-CA 122.106 1.87 . . . . 0.0 112.324 169.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.6 p -96.65 151.14 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 123.576 0.75 . . . . 0.0 110.633 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.6 HG21 ' HB3' ' A' ' 101' ' ' SER . 19.2 m -75.84 162.75 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 CA-C-O 121.559 0.695 . . . . 0.0 111.637 173.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 96.3 mt -118.9 -9.42 10.1 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.782 0.833 . . . . 0.0 110.631 168.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -87.15 -47.57 8.77 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.95 0.9 . . . . 0.0 110.341 -171.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.6 ' HB3' HG21 ' A' ' 98' ' ' VAL . 42.3 t -85.71 -32.48 21.9 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.969 179.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 19.4 m -59.61 114.6 2.81 Favored 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 122.657 0.383 . . . . 0.0 111.64 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -79.34 168.24 19.78 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.552 0.741 . . . . 0.0 112.864 -173.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -67.96 -25.23 65.34 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.998 0.919 . . . . 0.0 112.146 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 43.7 t -62.4 -32.98 73.89 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 122.664 0.386 . . . . 0.0 111.633 177.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.16 -34.89 70.79 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.707 0.803 . . . . 0.0 112.057 174.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.6 ' HG ' ' HB2' ' A' ' 112' ' ' LEU . 6.9 mp -64.57 -10.26 24.9 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.937 0.895 . . . . 0.0 113.388 -175.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 65.0 mtp85 -94.78 -28.5 15.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.494 0.717 . . . . 0.0 111.927 173.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -96.47 -53.81 3.47 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.145 0.578 . . . . 0.0 111.148 -173.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.588 HG23 ' HB2' ' A' ' 86' ' ' GLN . 14.0 p -100.13 -24.06 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 C-N-CA 123.91 0.884 . . . . 0.0 111.567 -178.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 43.4 t 69.53 147.32 0.06 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.102 1.361 . . . . 0.0 112.636 -173.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.6 ' HB2' ' HG ' ' A' ' 107' ' ' LEU . 5.8 tt -61.23 -40.78 95.28 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.168 178.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.17 -38.81 84.33 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.138 0.575 . . . . 0.0 112.127 -172.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -69.12 -33.19 73.07 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.524 0.729 . . . . 0.0 111.036 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.516 HD23 ' HE1' ' A' ' 85' ' ' TRP . 39.9 mt -66.03 -55.82 14.72 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 121.95 0.881 . . . . 0.0 109.916 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -68.55 -24.77 64.67 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 113.896 -1.502 . . . . 0.0 113.146 -173.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.53 -23.36 64.52 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 113.151 0.796 . . . . 0.0 113.151 175.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 11.1 m80 -116.53 -16.56 10.77 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 123.303 0.641 . . . . 0.0 112.57 174.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.222 0 C-N-CA 122.659 0.384 . . . . 0.0 110.419 170.455 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.497 HG23 ' HG2' ' A' ' 103' ' ' GLU . 3.5 t . . . . . 0 N--CA 1.486 1.34 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.758 HG21 ' HB2' ' A' ' 82' ' ' ALA . 40.1 t -120.89 111.27 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 123.189 0.596 . . . . 0.0 110.329 -175.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 82.5 m -105.97 107.54 18.6 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.58 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.6 151.31 41.38 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.911 0.884 . . . . 0.0 109.272 -176.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -126.95 115.3 19.05 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 122.458 0.303 . . . . 0.0 110.244 -173.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 63.9 mmm -98.91 152.77 19.4 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.217 0.607 . . . . 0.0 111.671 -174.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.679 HG22 ' HB3' ' A' ' 95' ' ' PRO . 6.8 t -89.11 157.48 18.29 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.468 0.707 . . . . 0.0 110.635 175.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 61.2 tt0 -53.57 -32.18 49.8 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.897 0.879 . . . . 0.0 112.419 -177.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -51.4 -44.88 62.32 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.143 0.977 . . . . 0.0 111.456 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -74.31 -47.42 34.77 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 177.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -65.28 -32.88 74.76 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.294 0.497 . . . . 0.0 111.543 -174.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.6 mt -76.63 -31.85 57.65 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.118 0.567 . . . . 0.0 112.139 173.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -57.62 -48.77 78.53 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 123.053 0.541 . . . . 0.0 110.666 171.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 CA--C 1.55 0.951 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.601 -179.514 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.201 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 79.23 35.99 28.6 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-N 115.085 -0.961 . . . . 0.0 113.347 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -118.31 98.9 6.52 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.506 0.723 . . . . 0.0 111.216 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -76.74 87.39 3.36 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 166.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -175.39 127.17 0.26 Allowed 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.944 -173.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 39.4 t 59.12 16.09 4.56 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.859 1.264 . . . . 0.0 113.776 171.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.58 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -75.05 108.83 8.04 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -175.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 62.2 m -65.1 135.31 55.37 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.449 0.7 . . . . 0.0 111.14 178.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.758 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -51.32 -49.37 61.48 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.187 0.995 . . . . 0.0 113.31 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.6 m -57.3 -29.52 63.98 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.931 0.892 . . . . 0.0 112.943 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -70.06 -51.55 31.03 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.431 0.692 . . . . 0.0 110.767 -177.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 3.8 t-105 -62.93 -41.32 99.45 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 123.665 0.786 . . . . 0.0 110.802 172.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.409 ' HA ' HE21 ' A' ' 86' ' ' GLN . 0.0 OUTLIER -58.52 -41.77 86.18 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.374 1.069 . . . . 0.0 111.997 -176.357 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -62.43 -37.33 85.43 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.722 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.7 -39.01 89.94 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.285 0.634 . . . . 0.0 111.65 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.565 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 75.4 t80 -68.23 -51.82 41.05 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.1 0.56 . . . . 0.0 111.23 175.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.86 -19.15 65.68 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.438 0.695 . . . . 0.0 112.42 -174.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.85 -26.97 21.35 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 123.153 0.581 . . . . 0.0 111.529 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 129.18 -21.76 5.15 Favored Glycine 0 N--CA 1.482 1.751 0 N-CA-C 115.697 1.039 . . . . 0.0 115.697 171.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -72.42 -67.89 0.51 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 118.17 0.985 . . . . 0.0 111.456 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.565 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 54.87 81.07 0.27 Allowed Pre-proline 0 CA--C 1.564 1.496 0 C-N-CA 124.641 1.176 . . . . 0.0 113.139 -177.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.679 ' HB3' HG22 ' A' ' 46' ' ' THR . 93.9 Cg_exo -53.4 163.95 2.26 Favored 'Trans proline' 0 N--CA 1.504 2.105 0 C-N-CA 124.352 3.368 . . . . 0.0 115.804 173.418 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -63.86 103.53 0.42 Allowed 'Trans proline' 0 C--N 1.384 2.429 0 C-N-CA 122.927 2.418 . . . . 0.0 112.667 174.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.6 p -94.26 138.01 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 123.299 0.64 . . . . 0.0 109.949 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 7.5 p -79.13 89.11 1.3 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-O 121.852 0.834 . . . . 0.0 112.862 -171.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.461 HD21 ' HB3' ' A' ' 115' ' ' LEU . 2.8 mm? -60.65 -34.37 74.2 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 124.628 1.171 . . . . 0.0 113.544 -177.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -71.33 -12.24 61.33 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 179.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 50.4 m -128.54 -7.11 5.18 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.248 0.619 . . . . 0.0 112.576 -176.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 99.5 m -72.62 120.96 18.97 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 122.552 0.341 . . . . 0.0 110.156 175.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.592 ' HG3' ' H ' ' A' ' 105' ' ' SER . 13.8 tp10 -64.55 149.71 48.21 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 123.131 0.572 . . . . 0.0 111.587 178.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -68.0 -34.18 76.02 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.369 0.667 . . . . 0.0 110.865 177.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.592 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 84.9 p -61.96 -23.86 66.64 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 122.902 0.481 . . . . 0.0 111.987 175.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.02 -36.06 74.33 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.044 0.538 . . . . 0.0 112.356 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.1 mp -55.73 -13.7 1.85 Allowed 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 124.978 1.311 . . . . 0.0 113.431 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -61.95 -34.48 76.2 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.422 1.089 . . . . 0.0 112.376 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -109.76 -21.82 12.21 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.578 1.151 . . . . 0.0 110.247 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.461 HG11 HD21 ' A' ' 115' ' ' LEU . 48.7 t -109.67 -51.67 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 CA-C-N 114.048 -1.433 . . . . 0.0 112.715 -159.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 26.6 m 71.26 140.86 0.05 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 125.746 1.618 . . . . 0.0 112.79 -168.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.42 -39.8 92.1 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.274 1.03 . . . . 0.0 113.372 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.6 -32.5 70.45 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.86 0.464 . . . . 0.0 111.73 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.89 -36.95 85.01 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 124.382 1.073 . . . . 0.0 111.185 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.461 ' HB3' HD21 ' A' ' 99' ' ' LEU . 71.5 mt -75.0 -51.58 13.24 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.637 1.175 . . . . 0.0 110.874 -177.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -70.78 -23.06 62.33 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 114.4 -1.273 . . . . 0.0 112.321 -175.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -50.07 -28.68 7.5 Favored 'General case' 0 CA--C 1.562 1.412 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 171.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -128.73 22.63 5.85 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.507 0.723 . . . . 0.0 112.261 175.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.314 0 C-N-CA 123.239 0.615 . . . . 0.0 110.577 174.0 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.415 ' O ' ' HB3' ' A' ' 105' ' ' SER . 65.8 p . . . . . 0 CA--C 1.559 1.3 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.538 HG11 ' HB2' ' A' ' 82' ' ' ALA . 46.5 t -137.89 117.96 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.746 -0.596 . . . . 0.0 111.126 176.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 57.8 m -116.74 108.22 15.62 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 168.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.637 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -137.69 148.23 45.52 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -176.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.5 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 28.0 tt0 -115.49 116.56 28.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.843 0.354 . . . . 0.0 111.77 -171.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 52.5 mmm -103.5 123.41 46.85 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.272 175.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 79.3 p -81.39 167.04 19.87 Favored 'General case' 0 C--O 1.246 0.895 0 C-N-CA 123.13 0.572 . . . . 0.0 110.549 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -58.03 -29.57 65.45 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.382 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -49.64 -56.13 11.17 Favored 'General case' 0 CA--C 1.567 1.622 0 C-N-CA 124.826 1.25 . . . . 0.0 112.377 177.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -70.55 -38.81 74.21 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 176.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.9 mp -66.34 -25.09 66.66 Favored 'General case' 0 CA--C 1.566 1.569 0 O-C-N 122.129 -0.357 . . . . 0.0 111.481 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 39.3 mt -75.13 -35.44 61.68 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.227 1.011 . . . . 0.0 110.555 172.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -60.64 -51.34 69.81 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.95 0.5 . . . . 0.0 110.286 171.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.9 m . . . . . 0 N--CA 1.483 1.191 0 C-N-CA 124.193 0.997 . . . . 0.0 111.646 177.084 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.827 0 CA-C-O 120.945 0.402 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 108.27 27.66 4.95 Favored Glycine 0 CA--C 1.535 1.333 0 CA-C-N 115.814 -0.63 . . . . 0.0 113.581 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -105.47 111.18 23.79 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.186 0.594 . . . . 0.0 111.237 171.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.5 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 11.9 ptt85 -83.1 88.05 6.9 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 165.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.4 t-105 -172.46 121.1 0.42 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.289 -173.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 43.4 t 54.56 19.24 2.32 Favored 'General case' 0 N--CA 1.499 1.978 0 C-N-CA 124.702 1.201 . . . . 0.0 113.708 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.637 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -71.4 124.11 23.85 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.36 0.664 . . . . 0.0 109.772 -175.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 52.0 t -62.14 110.5 1.62 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.177 0.591 . . . . 0.0 110.162 174.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.538 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -57.22 -26.7 61.13 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 113.885 1.069 . . . . 0.0 113.885 -171.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 78.6 p -68.64 -30.47 69.19 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.132 0.573 . . . . 0.0 112.228 176.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -72.85 -31.36 64.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.576 0.75 . . . . 0.0 111.027 175.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.528 ' HD1' HG11 ' A' ' 110' ' ' VAL . 8.8 t-105 -67.29 -53.97 24.99 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.259 0.624 . . . . 0.0 110.114 171.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.453 HE21 ' HG3' ' A' ' 90' ' ' GLU . 18.2 tp60 -56.88 -34.97 68.39 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.865 0.866 . . . . 0.0 112.263 177.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -52.41 -39.02 60.44 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.674 0.79 . . . . 0.0 111.826 175.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.06 -36.31 81.75 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.443 0.697 . . . . 0.0 112.727 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -67.42 -46.46 73.1 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 120.913 0.387 . . . . 0.0 110.391 173.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.453 ' HG3' HE21 ' A' ' 86' ' ' GLN . 42.1 mt-10 -66.2 -19.62 65.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.834 0.854 . . . . 0.0 111.827 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.08 -25.77 31.73 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.208 1.003 . . . . 0.0 111.708 171.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 111.17 -12.88 28.8 Favored Glycine 0 CA--C 1.537 1.465 0 CA-C-N 116.235 -0.439 . . . . 0.0 114.052 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 58.8 mtp -89.17 -81.61 0.27 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.725 0.81 . . . . 0.0 111.659 -174.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 59.86 99.5 0.04 OUTLIER Pre-proline 0 CA--C 1.564 1.505 0 C-N-CA 125.184 1.394 . . . . 0.0 114.226 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -57.18 166.47 4.26 Favored 'Trans proline' 0 CA--C 1.567 2.172 0 C-N-CA 124.098 3.199 . . . . 0.0 114.655 171.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.58 129.27 20.81 Favored 'Trans proline' 0 CA--C 1.567 2.144 0 C-N-CA 122.168 1.912 . . . . 0.0 112.996 171.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.8 p -116.61 151.39 18.42 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.158 0 C-N-CA 123.945 0.898 . . . . 0.0 111.096 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.6 m -88.33 97.61 6.94 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 124.262 1.025 . . . . 0.0 113.5 -171.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 22.8 mt -59.97 -24.33 64.33 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.134 -0.979 . . . . 0.0 112.305 172.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -67.81 -32.38 72.89 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 124.144 0.977 . . . . 0.0 112.738 178.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.8 t -115.4 -45.69 2.91 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -174.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.1 m -48.12 112.75 0.62 Allowed 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 123.571 0.748 . . . . 0.0 112.398 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -83.5 175.42 9.81 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -169.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.636 ' HA ' HD13 ' A' ' 107' ' ' LEU . 14.7 mmmm -67.76 -21.09 65.28 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 124.043 0.937 . . . . 0.0 113.197 -175.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.415 ' HB3' ' O ' ' A' ' 40' ' ' THR . 31.3 t -68.54 -29.72 68.36 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 176.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.2 -31.19 70.95 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.05 0.54 . . . . 0.0 112.453 176.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.636 HD13 ' HA ' ' A' ' 104' ' ' LYS . 8.1 mp -61.38 -28.03 68.95 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 124.019 0.928 . . . . 0.0 111.935 176.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -74.5 -5.78 44.66 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.889 0.876 . . . . 0.0 112.624 -177.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -120.92 -45.67 2.37 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.031 0.932 . . . . 0.0 110.721 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.528 HG11 ' HD1' ' A' ' 85' ' ' TRP . 0.6 OUTLIER -103.6 -35.38 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 C-N-CA 122.917 0.487 . . . . 0.0 111.9 -172.777 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . 0.406 ' O ' HG23 ' A' ' 110' ' ' VAL . 39.3 t 77.05 134.68 0.06 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.616 1.567 . . . . 0.0 110.849 -166.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 tt -44.93 -28.16 0.63 Allowed 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 124.734 1.214 . . . . 0.0 113.827 -177.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.73 -37.26 70.74 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.613 0.765 . . . . 0.0 113.0 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -72.85 -40.98 65.25 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 120.891 0.377 . . . . 0.0 110.813 177.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.517 HD23 ' HE1' ' A' ' 85' ' ' TRP . 67.7 mt -57.6 -46.46 84.03 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.601 0.76 . . . . 0.0 111.74 177.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -76.06 -34.35 59.59 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.699 0.8 . . . . 0.0 112.409 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -57.72 -28.05 63.52 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.174 0.589 . . . . 0.0 112.435 173.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -126.48 26.62 6.31 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.789 0.836 . . . . 0.0 111.938 -177.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.025 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.055 172.207 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.87 0.367 . . . . 0.0 111.076 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.452 HG11 ' HB2' ' A' ' 82' ' ' ALA . 48.5 t -129.85 101.4 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 123.65 0.78 . . . . 0.0 109.311 176.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 75.5 m -96.96 105.68 17.87 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.674 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -138.58 137.31 36.87 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.82 0.848 . . . . 0.0 108.954 -177.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.471 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 14.4 tt0 -117.78 108.83 15.84 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.124 0.487 . . . . 0.0 110.977 -168.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.477 ' HB2' HD11 ' A' ' 50' ' ' LEU . 59.3 mmm -91.55 132.6 36.18 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.817 0.847 . . . . 0.0 109.359 -179.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.655 HG22 ' HB3' ' A' ' 95' ' ' PRO . 8.0 t -80.12 155.29 27.56 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 175.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.467 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 37.1 tt0 -51.83 -31.23 26.66 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 118.902 -0.571 . . . . 0.0 112.291 -174.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -49.86 -43.79 49.3 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.802 0.841 . . . . 0.0 112.427 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -71.57 -38.21 70.96 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.593 0.357 . . . . 0.0 111.804 175.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.477 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.0 mp -71.04 -21.54 62.25 Favored 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 122.491 0.317 . . . . 0.0 111.742 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 47' ' ' GLU . 90.4 mt -72.72 -31.61 65.11 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 124.177 0.991 . . . . 0.0 109.565 169.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -74.86 -31.42 61.63 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 123.49 0.716 . . . . 0.0 111.465 168.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.9 m . . . . . 0 N--CA 1.488 1.468 0 C-N-CA 123.387 0.675 . . . . 0.0 111.781 -179.298 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.096 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 77.01 28.59 58.38 Favored Glycine 0 C--N 1.349 1.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 113.971 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -131.51 102.94 6.14 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 123.601 0.761 . . . . 0.0 110.905 178.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.471 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 11.5 ptt180 -85.57 88.88 7.58 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.881 0.848 . . . . 0.0 111.905 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -160.05 119.73 2.86 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.144 0.977 . . . . 0.0 109.353 -177.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 85.9 m 57.98 20.65 6.97 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.157 0.983 . . . . 0.0 113.179 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.674 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.5 tm? -68.02 115.97 8.12 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 48.4 m -63.32 114.79 4.04 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 123.649 0.593 . . . . 0.0 109.434 177.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.584 ' HB1' HG13 ' A' ' 110' ' ' VAL . . . -51.83 -35.51 44.75 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.822 0.849 . . . . 0.0 112.695 -176.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.7 m -57.55 -34.95 69.69 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.855 0.862 . . . . 0.0 112.688 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -74.69 -29.5 61.24 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 177.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -67.83 -51.74 44.93 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 169.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.74 ' HB2' HG12 ' A' ' 110' ' ' VAL . 13.3 tp60 -49.9 -35.6 24.25 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.891 0.876 . . . . 0.0 112.79 171.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -56.02 -44.01 78.32 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.934 0.894 . . . . 0.0 111.974 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.72 83.57 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.917 0.887 . . . . 0.0 113.095 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.37 -47.08 87.5 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.313 0.577 . . . . 0.0 110.69 173.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -69.49 -28.39 66.02 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.123 0.969 . . . . 0.0 112.114 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.7 -25.79 49.66 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.279 0.632 . . . . 0.0 111.308 174.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.76 29.82 25.43 Favored Glycine 0 CA--C 1.537 1.444 0 CA-C-N 116.101 -0.499 . . . . 0.0 113.822 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 23.1 ptm -139.6 25.26 2.4 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.209 0.604 . . . . 0.0 111.83 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -40.13 112.6 0.85 Allowed Pre-proline 0 CA--C 1.572 1.802 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 177.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.655 ' HB3' HG22 ' A' ' 46' ' ' THR . 54.3 Cg_exo -60.48 161.61 20.08 Favored 'Trans proline' 0 C--N 1.382 2.296 0 C-N-CA 123.745 2.963 . . . . 0.0 114.157 168.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -73.83 115.1 4.21 Favored 'Trans proline' 0 C--N 1.374 1.9 0 C-N-CA 122.138 1.892 . . . . 0.0 111.237 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 9.0 p -97.17 164.55 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-O 121.394 0.616 . . . . 0.0 109.846 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p -107.86 96.9 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.325 0 C-N-CA 123.882 0.873 . . . . 0.0 110.448 -178.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 25.6 mt -52.27 -41.17 62.63 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 124.248 1.019 . . . . 0.0 113.165 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -74.14 -1.27 19.57 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -176.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.8 t -122.5 -26.18 4.62 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.516 0.726 . . . . 0.0 111.154 172.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 30.4 m -76.3 104.07 6.64 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.19 0.596 . . . . 0.0 109.922 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -65.8 152.32 44.63 Favored 'General case' 0 CA--C 1.564 1.518 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.612 -175.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.16 -14.58 56.05 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 125.155 1.382 . . . . 0.0 112.551 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 54.9 m -55.82 -31.14 62.42 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.996 0.918 . . . . 0.0 111.259 169.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.432 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -56.32 -41.24 75.68 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.741 0.817 . . . . 0.0 112.004 175.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.7 -13.81 6.91 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 124.216 1.006 . . . . 0.0 113.502 -177.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -86.62 -8.7 57.25 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.469 0.708 . . . . 0.0 111.483 -179.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.507 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 44.8 m-85 -123.24 -45.41 2.1 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.826 1.251 . . . . 0.0 109.306 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.74 HG12 ' HB2' ' A' ' 86' ' ' GLN . 13.9 m -85.81 -167.81 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 CA-C-O 122.135 0.969 . . . . 0.0 111.608 167.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 43.9 t -115.03 150.85 35.23 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 114.323 -1.308 . . . . 0.0 108.713 156.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.1 tt -48.69 -39.28 23.91 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.079 0.552 . . . . 0.0 111.629 173.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.93 -31.49 65.0 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.15 0.98 . . . . 0.0 113.248 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -64.4 -46.05 85.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.043 0.537 . . . . 0.0 111.058 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.653 HD21 HG21 ' A' ' 110' ' ' VAL . 8.1 mt -66.17 -48.85 69.39 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.815 0.817 . . . . 0.0 109.83 -175.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -74.04 -24.84 59.6 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.26 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.95 -34.05 62.9 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 123.62 0.768 . . . . 0.0 112.704 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.28 33.62 3.06 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.1 0.56 . . . . 0.0 111.546 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.959 0 C-N-CA 123.227 0.611 . . . . 0.0 110.147 171.871 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.044 0.449 . . . . 0.0 111.459 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.585 HG11 ' HB2' ' A' ' 82' ' ' ALA . 40.9 t -128.13 120.51 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 169.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 81.5 m -116.61 109.14 16.83 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-O 121.192 0.52 . . . . 0.0 109.86 173.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.622 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -132.06 150.38 52.17 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.332 1.053 . . . . 0.0 108.512 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -117.58 109.18 16.37 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.968 0.413 . . . . 0.0 110.236 -176.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.553 ' HE1' ' HE3' ' A' ' 85' ' ' TRP . 60.5 mmm -84.97 131.42 34.48 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.481 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 5.4 t -81.95 153.71 26.13 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 174.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -49.06 -30.04 5.84 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.489 1.116 . . . . 0.0 113.106 -175.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -49.62 -48.41 49.06 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.65 1.18 . . . . 0.0 112.293 175.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.455 ' HB2' ' HG3' ' A' ' 95' ' ' PRO . 59.8 t80 -68.95 -41.35 78.15 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.034 0.533 . . . . 0.0 112.04 176.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.463 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.3 mp -70.94 -29.45 65.47 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 122.592 0.357 . . . . 0.0 111.713 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 67.9 mt -76.38 -32.86 58.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.695 0.798 . . . . 0.0 110.527 171.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -68.27 -32.19 72.18 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.08 0.552 . . . . 0.0 111.08 171.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 70.0 m . . . . . 0 N--CA 1.483 1.215 0 C-N-CA 123.327 0.651 . . . . 0.0 110.658 179.254 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.892 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 102.34 14.73 27.36 Favored Glycine 0 CA--C 1.536 1.347 0 N-CA-C 114.456 0.543 . . . . 0.0 114.456 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -122.55 103.8 8.94 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 117.783 0.791 . . . . 0.0 111.815 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.411 ' HB3' HG11 ' A' ' 98' ' ' VAL . 0.0 OUTLIER -86.75 91.98 8.8 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.365 0.603 . . . . 0.0 111.324 168.712 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -166.71 121.01 1.07 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.278 0.631 . . . . 0.0 109.323 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 73.4 m 52.78 24.81 3.44 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 175.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.622 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.3 tm? -72.29 105.25 3.98 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 175.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 49.5 t -55.72 120.66 7.64 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 123.551 0.532 . . . . 0.0 110.567 175.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.585 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -56.84 -22.72 38.7 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.842 0.857 . . . . 0.0 113.131 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 64.6 m -54.1 -39.98 66.88 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.078 0.551 . . . . 0.0 112.348 170.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -66.84 -44.56 80.75 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.92 0.888 . . . . 0.0 111.552 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.652 ' HE1' HD23 ' A' ' 115' ' ' LEU . 5.3 t-105 -70.53 -54.02 13.82 Favored 'General case' 0 CA--C 1.566 1.559 0 C-N-CA 123.215 0.606 . . . . 0.0 110.99 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.699 ' HB2' HG12 ' A' ' 110' ' ' VAL . 6.5 tp60 -49.64 -42.51 45.33 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.31 0.644 . . . . 0.0 112.303 175.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.23 -32.7 62.49 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 123.56 0.744 . . . . 0.0 112.752 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.93 -43.12 91.13 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.111 0.564 . . . . 0.0 111.839 175.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -69.83 -41.24 75.22 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.483 0.713 . . . . 0.0 111.232 176.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 9.4 mm-40 -65.35 -23.71 67.06 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.458 0.703 . . . . 0.0 111.372 178.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.05 -25.63 29.7 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.865 0.866 . . . . 0.0 111.523 172.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 117.7 -12.92 13.36 Favored Glycine 0 N--CA 1.48 1.572 0 N-CA-C 114.187 0.435 . . . . 0.0 114.187 177.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 91.1 mmm -83.92 -80.84 0.18 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.336 0.654 . . . . 0.0 111.773 -176.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.46 92.17 0.07 OUTLIER Pre-proline 0 N--CA 1.487 1.422 0 C-N-CA 124.664 1.185 . . . . 0.0 113.043 -174.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.455 ' HG3' ' HB2' ' A' ' 49' ' ' PHE . 67.6 Cg_endo -77.6 179.27 6.67 Favored 'Trans proline' 0 CA--C 1.574 2.492 0 C-N-CA 123.215 2.61 . . . . 0.0 112.734 174.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -62.06 127.8 22.27 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 121.953 1.768 . . . . 0.0 113.971 174.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.7 p -104.01 145.4 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 124.119 0.968 . . . . 0.0 109.884 173.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 77' ' ' ARG . 7.5 p -85.67 89.44 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.842 0 CA-C-O 122.192 0.996 . . . . 0.0 111.873 -176.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.469 HD21 ' HB3' ' A' ' 115' ' ' LEU . 7.9 mt -64.36 -24.06 67.51 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -177.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -73.27 -6.72 47.86 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 177.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.8 t -123.3 -12.99 7.76 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.679 0.791 . . . . 0.0 112.022 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 91.1 m -85.67 127.09 34.4 Favored 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 123.424 0.689 . . . . 0.0 112.171 -175.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -91.04 165.67 13.4 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.528 0.731 . . . . 0.0 111.518 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -63.32 -17.34 62.46 Favored 'General case' 0 CA--C 1.564 1.519 0 C-N-CA 124.398 1.079 . . . . 0.0 113.867 177.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 64.2 m -61.23 -24.91 66.7 Favored 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 122.696 0.398 . . . . 0.0 111.898 173.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.401 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -55.09 -38.9 68.68 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.418 0.687 . . . . 0.0 111.782 172.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.431 HD21 ' HB2' ' A' ' 112' ' ' LEU . 8.8 mp -67.47 3.4 1.33 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 124.647 1.179 . . . . 0.0 113.47 -176.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -95.72 -2.85 47.04 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.101 0.56 . . . . 0.0 110.357 174.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 75.6 m-85 -130.39 -53.24 1.1 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.122 1.369 . . . . 0.0 108.542 -177.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.699 HG12 ' HB2' ' A' ' 86' ' ' GLN . 17.0 m -89.07 177.87 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-O 122.256 1.027 . . . . 0.0 112.348 172.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.0 t -97.13 148.87 22.6 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 113.924 -1.489 . . . . 0.0 108.888 156.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.431 ' HB2' HD21 ' A' ' 107' ' ' LEU . 1.8 tt -57.99 -34.29 69.82 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 120.98 0.419 . . . . 0.0 109.958 170.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.91 -30.22 65.72 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.694 0.797 . . . . 0.0 112.524 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -71.57 -37.69 71.02 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.346 0.594 . . . . 0.0 110.131 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.652 HD23 ' HE1' ' A' ' 85' ' ' TRP . 75.9 mt -66.62 -50.0 64.44 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.652 0.781 . . . . 0.0 110.98 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -75.04 -37.7 61.65 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.065 -0.971 . . . . 0.0 112.582 -173.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -59.31 -25.65 64.33 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.469 173.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -120.05 19.84 12.22 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 123.526 0.731 . . . . 0.0 112.14 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.114 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 170.677 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.7 t . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 121.186 0.517 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.459 HG21 ' HB2' ' A' ' 82' ' ' ALA . 48.2 t -139.75 106.18 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.549 0.74 . . . . 0.0 109.871 -179.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 76.2 m -95.8 105.93 18.0 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.527 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -144.97 150.54 37.12 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.232 1.013 . . . . 0.0 108.793 -179.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -122.84 119.03 29.35 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 117.938 0.335 . . . . 0.0 110.632 -176.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 56.9 mtp -109.93 158.01 18.66 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.931 0.893 . . . . 0.0 111.274 178.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.41 ' OG1' ' HG2' ' A' ' 48' ' ' GLU . 25.6 p -96.86 158.85 15.23 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.971 0.908 . . . . 0.0 111.073 -177.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.594 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 23.7 tt0 -62.75 -29.12 70.45 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.973 -178.173 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.41 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 12.3 pt-20 -52.34 -45.41 65.65 Favored 'General case' 0 CA--C 1.565 1.548 0 C-N-CA 123.45 0.7 . . . . 0.0 112.73 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -79.38 -37.79 36.46 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 173.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.1 -20.16 64.91 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.73 -0.607 . . . . 0.0 111.616 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.594 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 76.4 mt -73.46 -30.74 63.37 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.536 1.134 . . . . 0.0 110.939 168.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.533 ' HE2' ' SD ' ' A' ' 93' ' ' MET . 13.7 m-85 -64.49 -47.65 78.15 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 118.319 0.509 . . . . 0.0 110.783 169.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.2 t . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.43 0.633 . . . . 0.0 111.577 176.044 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 68.87 26.33 74.69 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 116.69 -0.232 . . . . 0.0 113.118 -174.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -110.1 115.47 29.81 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.791 0.836 . . . . 0.0 110.065 176.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -99.17 84.89 3.11 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 171.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -158.76 116.63 2.88 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.244 0.618 . . . . 0.0 109.798 -175.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.0 t 43.84 33.86 0.8 Allowed 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 124.462 1.105 . . . . 0.0 113.218 175.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.527 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -62.85 123.42 18.44 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.97 0.908 . . . . 0.0 109.968 -174.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 63.0 m -62.6 105.44 0.64 Allowed 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.459 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -55.59 -26.05 41.71 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.208 1.003 . . . . 0.0 112.692 -177.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 65.2 m -58.87 -42.26 89.04 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.687 0.795 . . . . 0.0 112.474 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.7 mmt85 -69.68 -40.56 76.3 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.671 0.788 . . . . 0.0 112.04 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.619 ' HE1' HD23 ' A' ' 115' ' ' LEU . 15.9 t-105 -64.7 -54.14 36.37 Favored 'General case' 0 CA--C 1.559 1.296 0 C-N-CA 122.535 0.334 . . . . 0.0 110.162 175.502 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.744 ' HB2' HG12 ' A' ' 110' ' ' VAL . 29.5 tp60 -48.85 -43.64 38.9 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.906 0.882 . . . . 0.0 112.718 174.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -67.46 -33.48 75.21 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.839 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.22 -37.05 82.94 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 122.836 0.454 . . . . 0.0 111.361 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.647 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 81.5 t80 -58.13 -52.13 66.81 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.55 170.215 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -66.13 -23.97 66.59 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.749 0.819 . . . . 0.0 112.392 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.12 -5.89 59.32 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.783 0.833 . . . . 0.0 112.516 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.67 10.68 72.55 Favored Glycine 0 CA--C 1.538 1.496 0 N-CA-C 114.249 0.46 . . . . 0.0 114.249 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . 0.533 ' SD ' ' HE2' ' A' ' 52' ' ' PHE . 97.2 mmm -97.98 -75.39 0.55 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.649 0.78 . . . . 0.0 110.902 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.647 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 53.95 82.85 0.24 Allowed Pre-proline 0 CA--C 1.565 1.553 0 C-N-CA 125.0 1.32 . . . . 0.0 113.494 -178.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -56.89 160.15 12.94 Favored 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.677 2.918 . . . . 0.0 114.557 170.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -63.79 106.32 0.62 Allowed 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 122.776 2.318 . . . . 0.0 113.234 174.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 10.6 p -96.05 154.25 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 C-N-CA 123.481 0.712 . . . . 0.0 110.261 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.562 HG21 ' HB3' ' A' ' 101' ' ' SER . 27.7 m -73.1 141.98 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.446 0 C-N-CA 123.472 0.709 . . . . 0.0 111.864 173.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 73.1 mt -105.32 -8.62 18.12 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 123.265 0.626 . . . . 0.0 111.252 167.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.15 2.73 29.53 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.531 1.132 . . . . 0.0 112.312 -170.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.562 ' HB3' HG21 ' A' ' 98' ' ' VAL . 21.8 t -132.51 -51.64 0.93 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.884 0.874 . . . . 0.0 110.989 -179.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 98.3 m -38.11 123.6 1.13 Allowed 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 125.222 1.409 . . . . 0.0 113.87 -177.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -83.54 174.54 10.49 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.314 1.045 . . . . 0.0 113.419 -171.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -61.32 -38.74 87.95 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.402 1.081 . . . . 0.0 112.468 177.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 39.3 t -63.36 -28.12 69.78 Favored 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.805 -176.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.482 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -64.55 -47.14 79.88 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.15 0.58 . . . . 0.0 111.725 173.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.62 -15.78 13.11 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 124.369 1.068 . . . . 0.0 113.117 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -75.93 -39.27 56.5 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.503 0.721 . . . . 0.0 110.189 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -87.38 -36.31 17.85 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.696 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.744 HG12 ' HB2' ' A' ' 86' ' ' GLN . 26.8 m -97.55 -56.42 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 -176.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . 0.408 ' N ' HG23 ' A' ' 110' ' ' VAL . 38.4 t 83.67 134.11 0.05 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 125.924 1.689 . . . . 0.0 110.579 -151.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.655 ' HA ' HD12 ' A' ' 115' ' ' LEU . 1.7 tt -50.07 -30.64 11.31 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.281 1.032 . . . . 0.0 113.628 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.85 -36.11 71.86 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.179 0.592 . . . . 0.0 112.436 -178.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.65 -31.07 57.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.755 0.822 . . . . 0.0 110.637 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.655 HD12 ' HA ' ' A' ' 112' ' ' LEU . 56.9 mt -63.88 -56.18 17.25 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 123.879 0.872 . . . . 0.0 110.013 173.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -65.72 -28.72 69.26 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.074 0.95 . . . . 0.0 112.371 -175.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -49.17 -38.53 25.94 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -138.36 39.49 2.27 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-O 121.224 0.535 . . . . 0.0 111.818 178.183 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.139 0 C-N-CA 123.55 0.74 . . . . 0.0 111.094 170.38 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.406 ' O ' ' HB2' ' A' ' 105' ' ' SER . 18.2 p . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 121.558 0.694 . . . . 0.0 110.966 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.766 HG11 ' HB2' ' A' ' 82' ' ' ALA . 39.6 t -127.78 101.14 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.095 0.558 . . . . 0.0 109.831 174.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.5 m -111.38 106.59 15.57 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 171.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.427 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -139.32 150.67 45.65 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.36 1.064 . . . . 0.0 108.919 -176.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -116.62 108.54 16.07 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 122.065 -0.397 . . . . 0.0 110.584 -172.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.538 ' HB2' HD11 ' A' ' 50' ' ' LEU . 85.3 mmm -95.29 153.91 17.44 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.651 0.78 . . . . 0.0 111.024 177.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.411 ' OG1' ' HG2' ' A' ' 48' ' ' GLU . 73.0 p -90.94 156.47 17.96 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.898 0.879 . . . . 0.0 111.084 177.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.42 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 34.8 tt0 -62.7 -28.71 70.13 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.206 0.602 . . . . 0.0 112.146 -177.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.411 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 7.8 pt-20 -54.11 -38.05 64.97 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 122.825 0.45 . . . . 0.0 110.875 173.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.534 ' HB2' ' HG2' ' A' ' 95' ' ' PRO . 74.8 t80 -77.4 -45.59 25.4 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 123.658 0.783 . . . . 0.0 112.031 173.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' A' ' 45' ' ' MET . 9.0 mp -64.08 -41.12 97.42 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -174.171 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.42 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 88.6 mt -65.12 -31.33 72.48 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.768 0.427 . . . . 0.0 111.353 174.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -67.32 -44.07 80.05 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 123.647 0.779 . . . . 0.0 111.461 172.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 97.7 p . . . . . 0 N--CA 1.498 1.938 0 C-N-CA 123.499 0.72 . . . . 0.0 111.68 -179.253 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.998 0 CA-C-O 120.517 0.199 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 116.54 -11.17 16.27 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 116.193 -0.458 . . . . 0.0 113.668 -175.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -85.21 97.34 9.86 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 117.242 0.521 . . . . 0.0 110.59 175.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.534 ' HD2' HG21 ' A' ' 98' ' ' VAL . 44.8 ttp180 -96.66 84.12 3.58 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -174.95 120.7 0.21 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 125.873 1.669 . . . . 0.0 108.075 -174.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 36.2 m 59.47 27.99 17.26 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.511 0.724 . . . . 0.0 112.888 173.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.427 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -67.78 135.76 53.14 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 123.817 0.847 . . . . 0.0 110.559 -177.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.2 m -66.51 95.26 0.32 Allowed 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.845 0.858 . . . . 0.0 111.083 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.766 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -60.23 -29.42 68.74 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.847 0.859 . . . . 0.0 113.163 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.7 m -56.45 -35.21 67.62 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.553 0.741 . . . . 0.0 112.184 175.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -73.62 -41.56 62.64 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.136 0.974 . . . . 0.0 111.472 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 3.0 t-105 -66.54 -48.59 69.22 Favored 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 122.816 0.446 . . . . 0.0 110.366 176.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.56 ' HB2' HG12 ' A' ' 110' ' ' VAL . 11.0 tp60 -49.43 -43.28 44.61 Favored 'General case' 0 CA--C 1.564 1.481 0 C-N-CA 124.052 0.941 . . . . 0.0 111.885 169.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.11 -47.27 85.89 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.949 0.5 . . . . 0.0 111.765 175.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.05 -39.34 74.68 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -173.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.497 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 49.7 t80 -72.18 -45.06 61.92 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.354 0.261 . . . . 0.0 111.495 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -71.71 -21.59 61.75 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.253 0.621 . . . . 0.0 112.173 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.29 -24.59 29.81 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.036 0.934 . . . . 0.0 111.216 175.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.62 42.42 7.81 Favored Glycine 0 C--N 1.349 1.281 0 CA-C-N 116.418 -0.355 . . . . 0.0 113.474 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -142.05 12.54 2.02 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.032 0.933 . . . . 0.0 111.33 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.497 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -50.66 114.08 4.29 Favored Pre-proline 0 CA--C 1.566 1.586 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -176.028 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.534 ' HG2' ' HB2' ' A' ' 49' ' ' PHE . 12.0 Cg_exo -74.92 177.04 9.09 Favored 'Trans proline' 0 CA--C 1.57 2.296 0 C-N-CA 123.978 3.119 . . . . 0.0 112.651 170.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.479 ' HA ' ' HB3' ' A' ' 118' ' ' HIS . 65.5 Cg_endo -70.55 152.59 65.32 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.178 1.919 . . . . 0.0 113.715 174.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 14.9 p -138.1 167.68 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 124.294 1.038 . . . . 0.0 109.461 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.534 HG21 ' HD2' ' A' ' 77' ' ' ARG . 16.6 m -90.7 135.69 25.96 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 123.159 0.584 . . . . 0.0 111.231 169.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 12.5 mt -90.9 -36.9 13.89 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.598 0.713 . . . . 0.0 109.532 161.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -78.99 13.57 1.71 Allowed 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 125.093 1.357 . . . . 0.0 113.671 -171.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.477 ' HB3' HG21 ' A' ' 98' ' ' VAL . 46.3 t -147.01 -39.82 0.2 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.124 0.569 . . . . 0.0 111.279 179.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.7 m -61.78 130.14 44.32 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 122.697 0.399 . . . . 0.0 111.248 174.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -75.81 161.41 29.04 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.061 0.545 . . . . 0.0 111.957 -177.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.409 ' HA ' HD13 ' A' ' 107' ' ' LEU . 13.8 mptt -70.97 -17.5 62.65 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.532 0.733 . . . . 0.0 112.126 178.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' A' ' 40' ' ' THR . 49.6 m -60.82 -26.94 67.69 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.269 0.628 . . . . 0.0 111.938 174.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.431 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -61.72 -32.56 72.79 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.729 0.811 . . . . 0.0 112.587 176.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.5 mp -62.75 1.86 0.35 Allowed 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 125.027 1.331 . . . . 0.0 114.534 -174.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -96.12 -28.81 14.42 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.397 0.679 . . . . 0.0 110.214 177.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -97.64 -43.8 7.05 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.139 1.375 . . . . 0.0 109.139 -177.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.78 HG21 HD21 ' A' ' 115' ' ' LEU . 35.5 m -93.39 -171.25 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 122.087 0.946 . . . . 0.0 110.646 163.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 44.7 t -115.39 154.29 29.48 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 114.549 -1.205 . . . . 0.0 108.566 155.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.0 tt -48.8 -36.02 15.73 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.762 0.825 . . . . 0.0 111.513 170.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.64 74.63 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 123.937 0.895 . . . . 0.0 113.388 -177.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.72 -42.38 91.17 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.373 0.606 . . . . 0.0 110.463 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.78 HD21 HG21 ' A' ' 110' ' ' VAL . 6.4 mt -66.36 -52.43 46.98 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.791 -178.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.38 -25.11 63.1 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.173 0.989 . . . . 0.0 112.505 -174.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.78 -26.26 67.13 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 170.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 96' ' ' PRO . 78.0 m80 -132.54 26.68 4.41 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.76 0.824 . . . . 0.0 112.16 -177.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.215 0 C-N-CA 124.125 0.97 . . . . 0.0 110.387 176.13 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 121.038 0.447 . . . . 0.0 110.742 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.9 t -125.62 122.8 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.708 0.803 . . . . 0.0 110.448 176.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 79.4 m -121.08 107.29 12.44 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 168.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.5 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -136.18 142.89 44.17 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.147 0.979 . . . . 0.0 108.645 179.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.452 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 17.4 tt0 -122.02 110.02 15.3 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.808 0.337 . . . . 0.0 110.548 -171.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.617 ' HB2' HD11 ' A' ' 50' ' ' LEU . 42.7 mmm -89.56 136.02 33.27 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.803 0.841 . . . . 0.0 109.157 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 14.7 t -82.23 159.98 23.1 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 176.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.471 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 31.7 tt0 -54.57 -32.07 57.82 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.364 0.666 . . . . 0.0 112.601 -172.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -57.29 -37.55 72.6 Favored 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -175.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -76.01 -39.83 54.91 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.617 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.3 mp -68.41 -25.02 64.83 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 120.97 0.414 . . . . 0.0 110.765 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.471 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 94.1 mt -74.98 -44.75 46.48 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.483 1.113 . . . . 0.0 109.835 170.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -55.99 -39.53 71.98 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.915 0.486 . . . . 0.0 111.006 174.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.478 0.932 0 C-N-CA 123.741 0.816 . . . . 0.0 111.892 -176.848 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.064 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 99.8 2.28 56.23 Favored Glycine 0 CA--C 1.537 1.465 0 N-CA-C 114.738 0.655 . . . . 0.0 114.738 -177.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -97.14 109.27 22.06 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 117.96 0.88 . . . . 0.0 111.834 173.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.452 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 27.6 ptt-85 -90.95 87.84 6.78 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-O 122.079 0.943 . . . . 0.0 109.482 168.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -166.75 118.67 0.97 Allowed 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.67 -167.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 73.5 m 50.03 22.47 0.91 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 178.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.5 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -59.08 -31.03 68.51 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.823 0.849 . . . . 0.0 112.103 -169.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 42.4 t 67.11 113.53 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.685 1.194 . . . . 0.0 110.613 -172.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.86 -29.42 66.95 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -172.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.7 t -63.69 -33.23 75.18 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.466 0.706 . . . . 0.0 112.417 177.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -66.09 -41.83 90.13 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.624 0.769 . . . . 0.0 111.406 177.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.511 ' NE1' HD23 ' A' ' 115' ' ' LEU . 1.5 t-105 -69.26 -49.34 56.99 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 123.107 0.563 . . . . 0.0 110.822 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -52.98 -41.79 64.92 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.783 0.833 . . . . 0.0 111.397 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -64.12 -24.57 67.74 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.596 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.43 82.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.086 0.555 . . . . 0.0 111.477 176.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -65.03 -43.59 91.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.197 0.599 . . . . 0.0 110.552 173.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -68.0 -22.64 64.99 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.95 0.9 . . . . 0.0 111.665 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.6 -3.68 56.49 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.916 0.886 . . . . 0.0 112.206 173.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.03 41.2 23.05 Favored Glycine 0 C--N 1.352 1.444 0 C-N-CA 122.937 0.303 . . . . 0.0 113.25 -178.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 1.8 mmt -130.19 -78.02 0.54 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.501 0.721 . . . . 0.0 110.879 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.74 94.39 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.262 0 C-N-CA 124.624 1.169 . . . . 0.0 112.69 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -74.27 158.02 45.3 Favored 'Trans proline' 0 CA--C 1.567 2.13 0 C-N-CA 122.533 2.155 . . . . 0.0 112.663 170.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -59.6 111.42 0.94 Allowed 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 122.295 1.997 . . . . 0.0 113.1 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 6.6 p -95.07 149.49 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.41 0 C-N-CA 123.914 0.886 . . . . 0.0 111.318 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.5 p -80.32 91.79 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.865 0 CA-C-O 122.259 1.028 . . . . 0.0 113.036 -173.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.455 HD21 ' HB3' ' A' ' 115' ' ' LEU . 3.4 mm? -70.48 -22.08 62.7 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -178.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -73.91 -17.61 61.01 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 71.6 m -124.92 -4.78 7.51 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 96.7 m -71.0 126.42 29.53 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.422 0.556 . . . . 0.0 111.388 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -85.38 157.74 20.43 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.549 0.74 . . . . 0.0 111.712 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -58.07 -31.83 67.45 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.804 1.242 . . . . 0.0 113.488 -176.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 73.4 m -60.87 -29.13 69.36 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.2 70.74 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.312 0.645 . . . . 0.0 112.611 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.18 -24.68 65.9 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.834 0.854 . . . . 0.0 111.995 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -68.42 -18.14 64.37 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.928 0.491 . . . . 0.0 111.678 178.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -102.81 -53.07 2.93 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.101 0.96 . . . . 0.0 110.803 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.723 HG23 ' HB3' ' A' ' 114' ' ' ASP . 0.9 OUTLIER -99.34 -37.22 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 C-N-CA 122.625 0.37 . . . . 0.0 111.901 -172.481 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.1 t 73.25 134.37 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 125.135 1.522 . . . . 0.0 110.817 -166.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' A' ' 115' ' ' LEU . 5.5 tt -45.88 -29.46 1.39 Allowed 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -175.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.62 -34.84 74.83 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.731 0.412 . . . . 0.0 112.07 -179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.723 ' HB3' HG23 ' A' ' 110' ' ' VAL . 27.7 t70 -73.74 -40.44 63.53 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.568 0.747 . . . . 0.0 111.073 177.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.593 HD12 ' HA ' ' A' ' 112' ' ' LEU . 82.1 mt -54.93 -51.84 64.84 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.205 1.002 . . . . 0.0 111.36 173.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -75.34 -22.79 57.34 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.29 -1.323 . . . . 0.0 112.492 -176.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.23 -19.4 5.17 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 172.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -138.76 21.01 2.68 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 174.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.396 0 O-C-N 121.772 -0.58 . . . . 0.0 111.329 173.825 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.483 1.212 0 CA-C-O 121.448 0.642 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.473 HG11 ' HB2' ' A' ' 82' ' ' ALA . 82.2 t -140.38 110.33 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.214 1.006 . . . . 0.0 108.747 174.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 71.9 m -95.99 105.53 17.57 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.543 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -143.38 151.25 40.2 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.084 1.354 . . . . 0.0 108.26 -178.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.532 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 24.2 tt0 -125.24 108.52 11.82 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.013 0.824 . . . . 0.0 112.245 -174.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 70.6 mtp -87.41 135.22 33.42 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.355 0.662 . . . . 0.0 109.522 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.564 HG23 ' HD1' ' A' ' 49' ' ' PHE . 0.9 OUTLIER -91.63 155.18 18.52 Favored 'General case' 0 N--CA 1.502 2.142 0 CA-C-N 118.154 0.433 . . . . 0.0 110.734 -179.952 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -56.11 -32.1 63.89 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.944 0.898 . . . . 0.0 113.024 -169.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -53.69 -45.04 70.24 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.584 0.707 . . . . 0.0 110.621 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.564 ' HD1' HG23 ' A' ' 46' ' ' THR . 86.7 m-85 -78.58 -35.16 46.23 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.958 1.303 . . . . 0.0 113.899 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.9 mp -68.08 -42.22 80.71 Favored 'General case' 0 N--CA 1.499 2.011 0 CA-C-N 119.365 0.984 . . . . 0.0 110.727 177.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 83.5 mt -67.93 -37.34 81.53 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.072 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.406 ' HD2' ' SD ' ' A' ' 93' ' ' MET . 68.9 t80 -65.9 -39.35 90.52 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.261 0.624 . . . . 0.0 111.425 176.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 43.8 t . . . . . 0 N--CA 1.484 1.239 0 C-N-CA 123.612 0.765 . . . . 0.0 110.694 177.72 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.918 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 66.4 40.95 94.65 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.486 -0.779 . . . . 0.0 113.464 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -124.94 104.88 8.83 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 122.854 0.461 . . . . 0.0 110.247 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.532 ' HB2' ' HB2' ' A' ' 44' ' ' GLU . 0.1 OUTLIER -83.5 88.03 7.0 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 122.813 0.445 . . . . 0.0 110.024 174.934 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -168.61 120.79 0.81 Allowed 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 124.261 1.024 . . . . 0.0 110.115 177.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 39.3 t 53.36 26.4 5.32 Favored 'General case' 0 N--CA 1.5 2.066 0 C-N-CA 124.687 1.195 . . . . 0.0 112.937 174.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.543 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -62.77 131.39 48.73 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.451 1.1 . . . . 0.0 111.041 -176.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 42.6 t -63.06 101.4 0.28 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.644 0.778 . . . . 0.0 111.394 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.473 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -59.08 -25.95 64.23 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.722 0.809 . . . . 0.0 112.297 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.5 m -69.33 -39.88 77.92 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.718 0.807 . . . . 0.0 112.029 174.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -74.99 -32.76 61.74 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.172 0.589 . . . . 0.0 111.338 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.571 ' HE1' HD23 ' A' ' 115' ' ' LEU . 3.4 t-105 -65.1 -46.73 79.87 Favored 'General case' 0 CA--C 1.567 1.598 0 C-N-CA 123.456 0.702 . . . . 0.0 109.377 171.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -57.49 -44.45 84.96 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.12 0.968 . . . . 0.0 111.576 174.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -60.25 -34.82 74.24 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.056 0.942 . . . . 0.0 111.42 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.89 -39.12 87.38 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 122.927 0.491 . . . . 0.0 111.739 175.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -66.76 -39.78 88.0 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 121.074 0.464 . . . . 0.0 110.715 176.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -69.22 -28.44 66.35 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 123.728 0.811 . . . . 0.0 111.425 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.18 -5.68 57.99 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.852 0.861 . . . . 0.0 111.978 173.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 92.76 -20.94 41.91 Favored Glycine 0 C--N 1.353 1.497 0 N-CA-C 114.226 0.45 . . . . 0.0 114.226 177.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . 0.406 ' SD ' ' HD2' ' A' ' 52' ' ' PHE . 6.3 ptm -71.27 -87.92 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.773 0 C-N-CA 124.03 0.932 . . . . 0.0 112.59 -177.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 61.58 112.67 0.02 OUTLIER Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -67.69 176.72 4.77 Favored 'Trans proline' 0 N--CA 1.507 2.304 0 C-N-CA 123.498 2.799 . . . . 0.0 113.661 170.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -82.01 134.47 8.23 Favored 'Trans proline' 0 C--N 1.381 2.267 0 C-N-CA 122.402 2.068 . . . . 0.0 111.897 166.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.9 p -122.79 143.74 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.912 0.885 . . . . 0.0 110.179 177.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.3 p -94.65 120.2 43.72 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.652 0 C-N-CA 123.216 0.606 . . . . 0.0 111.852 -178.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.4 mt -61.0 -45.82 93.28 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.161 0.985 . . . . 0.0 113.384 -176.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -75.14 14.75 0.5 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.988 0.915 . . . . 0.0 113.451 -172.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.2 t -137.39 -5.73 1.8 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 123.521 0.728 . . . . 0.0 112.07 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 53.5 m -91.24 124.2 35.26 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.029 0.532 . . . . 0.0 110.888 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.8 mp0 -66.39 154.6 39.71 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.001 0.52 . . . . 0.0 112.194 175.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 1.4 tmtp? -67.17 -19.32 65.56 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 123.633 0.773 . . . . 0.0 111.545 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 42.9 t -56.43 -26.68 54.35 Favored 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 123.715 0.806 . . . . 0.0 111.918 176.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.37 73.73 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.956 0.902 . . . . 0.0 112.692 174.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 10.6 mp -62.9 -6.82 4.16 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -173.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 59.6 mtp180 -83.67 -34.2 25.04 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 121.084 0.469 . . . . 0.0 111.526 172.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -102.21 -22.73 14.12 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.501 1.121 . . . . 0.0 111.524 -173.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.424 HG21 ' NE1' ' A' ' 85' ' ' TRP . 7.6 p -136.24 170.98 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 124.331 1.052 . . . . 0.0 108.756 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . 0.512 ' HB3' ' HB2' ' A' ' 114' ' ' ASP . 28.7 t -92.97 151.29 20.0 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 121.747 -0.596 . . . . 0.0 111.277 170.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.9 tt -59.9 -44.63 94.16 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.551 0.34 . . . . 0.0 110.196 167.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.07 -30.65 69.35 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.298 0.639 . . . . 0.0 111.356 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.512 ' HB2' ' HB3' ' A' ' 111' ' ' SER . 5.5 t70 -67.1 -41.01 86.98 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.588 1.155 . . . . 0.0 110.45 175.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.571 HD23 ' HE1' ' A' ' 85' ' ' TRP . 71.3 mt -66.33 -53.48 35.88 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.845 0.858 . . . . 0.0 110.509 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . 0.46 ' HA ' ' HB3' ' A' ' 119' ' ' ALA . 11.3 mt-30 -69.47 -28.03 65.74 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.445 1.098 . . . . 0.0 111.947 -173.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -55.2 -37.03 66.56 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.283 0.633 . . . . 0.0 112.43 171.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -113.22 30.26 7.34 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.757 0.823 . . . . 0.0 111.455 178.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.46 ' HB3' ' HA ' ' A' ' 116' ' ' GLN . . . . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.494 1.729 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.604 HG11 ' HB2' ' A' ' 82' ' ' ALA . 42.3 t -139.5 110.6 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 C-N-CA 123.591 0.756 . . . . 0.0 110.618 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.8 m -108.23 106.92 17.31 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.631 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.27 151.31 41.91 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.45 0.7 . . . . 0.0 109.321 -168.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.465 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 29.1 tt0 -112.25 115.81 29.4 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.837 0.351 . . . . 0.0 111.667 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.443 ' HB3' HD11 ' A' ' 50' ' ' LEU . 75.5 mmm -95.19 114.84 26.68 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 170.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.695 ' HB ' ' HB2' ' A' ' 95' ' ' PRO . 92.4 m -83.56 147.73 27.59 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.34 0.656 . . . . 0.0 110.294 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.48 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 35.6 tt0 -47.31 -32.52 4.8 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -164.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -53.1 -41.87 65.39 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -76.08 -32.5 59.27 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.383 0.273 . . . . 0.0 111.595 175.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.598 HD22 ' HA ' ' A' ' 74' ' ' ALA . 5.3 mp -77.39 -22.54 51.48 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.803 0.441 . . . . 0.0 110.813 -177.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.48 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 70.2 mt -68.79 -46.82 67.72 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.811 1.244 . . . . 0.0 109.626 168.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -55.08 -48.77 73.08 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.427 1.091 . . . . 0.0 110.98 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 N--CA 1.484 1.261 0 C-N-CA 124.117 0.967 . . . . 0.0 111.949 177.802 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.598 ' HA ' HD22 ' A' ' 50' ' ' LEU . . . . . . . . 0 CA--C 1.55 0.942 0 CA-C-O 120.863 0.363 . . . . 0.0 111.543 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 75.65 44.88 19.32 Favored Glycine 0 C--N 1.346 1.12 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.811 -176.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -119.93 149.14 42.6 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.227 0.611 . . . . 0.0 109.96 173.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.465 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -135.54 91.68 2.75 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.206 0.602 . . . . 0.0 110.787 -174.713 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -179.61 123.8 0.08 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.551 1.141 . . . . 0.0 109.454 173.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.2 t 54.57 30.86 13.89 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.392 1.077 . . . . 0.0 112.706 177.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.631 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.4 tm? -68.6 131.77 45.78 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.697 0.799 . . . . 0.0 110.538 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 60.8 m -60.26 106.93 0.58 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.133 0.973 . . . . 0.0 110.761 176.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.604 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -64.5 -24.8 67.73 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.6 t -64.0 -34.01 77.02 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 122.756 0.422 . . . . 0.0 111.741 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -63.07 -37.99 89.38 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.82 0.848 . . . . 0.0 110.978 176.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -75.14 -50.62 15.74 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 124.279 1.032 . . . . 0.0 111.155 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.47 ' HB2' HG12 ' A' ' 110' ' ' VAL . 19.6 tp60 -49.1 -44.29 42.01 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.952 0.901 . . . . 0.0 112.07 173.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -69.61 -30.01 67.65 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.48 -43.13 91.21 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 122.822 0.449 . . . . 0.0 111.911 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.524 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 80.0 t80 -64.68 -41.37 96.1 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.134 0.574 . . . . 0.0 111.127 176.489 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -67.07 -29.94 69.85 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.612 0.765 . . . . 0.0 112.647 175.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.48 -14.7 56.7 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.598 0.759 . . . . 0.0 111.914 175.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 78.58 7.51 88.04 Favored Glycine 0 C--N 1.352 1.448 0 CA-C-N 116.25 -0.432 . . . . 0.0 113.318 -174.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 94.6 mmm -104.2 17.82 23.33 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.227 1.011 . . . . 0.0 112.075 -177.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.524 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -52.06 108.56 1.1 Allowed Pre-proline 0 CA--C 1.569 1.701 0 C-N-CA 125.39 1.476 . . . . 0.0 114.439 178.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.695 ' HB2' ' HB ' ' A' ' 46' ' ' THR . 32.3 Cg_endo -86.56 168.06 8.6 Favored 'Trans proline' 0 CA--C 1.571 2.327 0 C-N-CA 123.06 2.507 . . . . 0.0 113.172 175.205 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.79 126.58 21.6 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.853 2.369 . . . . 0.0 114.803 176.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.2 p -115.43 175.61 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 125.381 1.472 . . . . 0.0 109.363 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.414 HG21 ' HB3' ' A' ' 101' ' ' SER . 10.0 m -95.67 161.1 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.435 0 O-C-N 121.625 -0.672 . . . . 0.0 110.612 165.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.46 HD11 ' HG2' ' A' ' 116' ' ' GLN . 7.7 mt -113.44 -29.73 7.11 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.214 1.006 . . . . 0.0 108.889 161.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -59.43 -46.06 89.79 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.802 1.241 . . . . 0.0 112.082 -173.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.414 ' HB3' HG21 ' A' ' 98' ' ' VAL . 28.1 t -96.63 -23.83 16.3 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.008 178.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.7 m -63.49 110.1 1.85 Allowed 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 120.855 0.359 . . . . 0.0 111.482 175.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.0 mp0 -65.59 155.65 35.15 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.947 0.899 . . . . 0.0 112.11 178.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -66.86 -16.61 64.42 Favored 'General case' 0 N--CA 1.5 2.03 0 C-N-CA 123.45 0.7 . . . . 0.0 112.057 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.4 t -61.34 -26.34 67.74 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.095 0.958 . . . . 0.0 112.302 173.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.497 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -54.66 -37.64 65.96 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.117 0.567 . . . . 0.0 112.084 174.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 7.0 mp -65.85 4.04 0.69 Allowed 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 124.956 1.303 . . . . 0.0 113.261 -176.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 65.1 mtp85 -98.69 -10.19 23.56 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.485 1.114 . . . . 0.0 110.848 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -121.06 -49.28 2.2 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.997 1.319 . . . . 0.0 108.611 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.838 HG21 HD21 ' A' ' 115' ' ' LEU . 32.6 m -90.1 -174.32 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 CA-C-O 122.101 0.953 . . . . 0.0 111.09 167.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.9 t -110.02 160.68 16.22 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.219 155.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.58 -36.91 62.42 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.252 0.621 . . . . 0.0 112.39 173.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.36 -30.74 71.4 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -177.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -61.47 -46.36 90.39 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.307 0.575 . . . . 0.0 110.12 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.838 HD21 HG21 ' A' ' 110' ' ' VAL . 5.9 mt -66.55 -56.58 10.17 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.431 -175.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . 0.46 ' HG2' HD11 ' A' ' 99' ' ' LEU . 3.2 mt-30 -65.84 -24.65 66.94 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.479 -170.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -51.17 -40.32 58.37 Favored 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 172.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -140.7 21.52 2.33 Favored 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 123.258 0.623 . . . . 0.0 112.639 -176.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -178.56 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 45.0 p . . . . . 0 CA--C 1.552 1.029 0 CA-C-O 120.775 0.322 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.42 HG11 ' HB2' ' A' ' 82' ' ' ALA . 39.2 t -129.07 123.51 58.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.781 -0.574 . . . . 0.0 110.525 173.169 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 71.9 m -119.95 108.91 14.9 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 167.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.684 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -138.96 147.93 42.87 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.851 0.86 . . . . 0.0 108.835 -174.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -112.17 118.76 36.22 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 117.796 0.271 . . . . 0.0 111.501 -172.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.508 ' SD ' ' HB2' ' A' ' 85' ' ' TRP . 75.7 mmm -101.88 129.86 48.22 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.501 0.72 . . . . 0.0 110.641 178.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.47 ' H ' ' HB3' ' A' ' 95' ' ' PRO . 57.0 m -85.73 150.96 24.22 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.222 1.009 . . . . 0.0 110.412 -178.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -47.92 -30.01 3.84 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.631 1.573 . . . . 0.0 114.432 -172.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -48.19 -55.15 11.13 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.164 0.986 . . . . 0.0 112.179 177.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -74.39 -33.74 63.12 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.277 -176.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.8 mp -73.19 -35.61 66.39 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 117.914 0.324 . . . . 0.0 111.293 -176.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 38.8 mt -74.16 -33.67 63.56 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.972 0.509 . . . . 0.0 110.995 173.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -58.28 -51.92 67.76 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.908 0.483 . . . . 0.0 110.664 171.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.477 0.889 0 C-N-CA 123.662 0.785 . . . . 0.0 111.745 -179.691 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.004 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.85 20.8 25.28 Favored Glycine 0 CA--C 1.537 1.452 0 CA-C-N 115.648 -0.705 . . . . 0.0 113.431 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -95.99 134.02 39.51 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.565 0.746 . . . . 0.0 110.772 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.67 90.56 3.13 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.934 0.873 . . . . 0.0 111.791 172.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -173.96 121.4 0.3 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.485 1.114 . . . . 0.0 108.765 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 36.6 t 58.75 21.51 9.01 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.945 0.898 . . . . 0.0 112.374 177.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.684 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -68.87 112.92 5.85 Favored 'General case' 0 C--N 1.355 0.82 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 63.0 m -59.46 115.34 3.21 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.997 0.519 . . . . 0.0 109.967 176.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.42 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -56.28 -25.12 47.04 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -176.15 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.5 t -61.45 -33.32 73.54 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.623 0.769 . . . . 0.0 112.52 174.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -71.01 -40.21 71.93 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 123.852 0.861 . . . . 0.0 112.016 177.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.744 ' HE1' HD23 ' A' ' 115' ' ' LEU . 10.7 t-105 -68.84 -51.67 38.04 Favored 'General case' 0 CA--C 1.561 1.385 0 O-C-N 122.249 -0.282 . . . . 0.0 111.009 173.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.494 ' HB2' HG12 ' A' ' 110' ' ' VAL . 6.8 tp60 -48.43 -37.32 16.83 Favored 'General case' 0 CA--C 1.567 1.603 0 C-N-CA 124.167 0.987 . . . . 0.0 111.62 173.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -59.43 -44.04 92.98 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.634 1.174 . . . . 0.0 112.425 174.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.5 -36.6 73.9 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.149 0.58 . . . . 0.0 111.97 -173.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.726 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 65.5 t80 -66.02 -52.23 51.09 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.057 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -67.78 -22.52 65.19 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.92 -22.14 60.78 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.301 0.641 . . . . 0.0 111.528 171.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 102.26 -4.89 51.98 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 114.136 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 61.5 mtp -81.11 -70.14 0.55 Allowed 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 117.356 0.578 . . . . 0.0 109.909 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.726 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 57.21 92.05 0.07 OUTLIER Pre-proline 0 CA--C 1.557 1.224 0 C-N-CA 125.034 1.333 . . . . 0.0 113.54 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.47 ' HB3' ' H ' ' A' ' 46' ' ' THR . 93.5 Cg_exo -55.06 159.25 10.02 Favored 'Trans proline' 0 CA--C 1.564 2.004 0 C-N-CA 123.049 2.499 . . . . 0.0 114.496 163.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.65 110.98 2.0 Favored 'Trans proline' 0 CA--C 1.558 1.699 0 C-N-CA 121.776 1.651 . . . . 0.0 110.999 163.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -95.24 157.15 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 123.245 0.618 . . . . 0.0 110.224 178.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.52 HG21 ' HB3' ' A' ' 101' ' ' SER . 28.1 m -73.48 147.28 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.149 0 C-N-CA 123.097 0.559 . . . . 0.0 111.175 171.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.458 HD23 ' HG2' ' A' ' 116' ' ' GLN . 0.6 OUTLIER -105.17 -30.25 9.83 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 167.766 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -80.52 -14.42 58.26 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.629 1.171 . . . . 0.0 113.338 -172.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.52 ' HB3' HG21 ' A' ' 98' ' ' VAL . 33.0 t -119.6 -24.69 6.17 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 122.759 0.424 . . . . 0.0 111.783 -179.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 85.5 m -63.31 106.3 0.87 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.747 0.419 . . . . 0.0 111.113 172.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -76.57 160.31 29.55 Favored 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 124.167 0.987 . . . . 0.0 110.702 -176.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -57.98 -23.36 53.51 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -174.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.6 m -59.23 -32.23 69.78 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 120.765 0.317 . . . . 0.0 111.628 176.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.451 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -59.8 -36.36 76.58 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.556 0.742 . . . . 0.0 112.801 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.7 mp -65.47 5.49 0.41 Allowed 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 124.615 1.166 . . . . 0.0 113.495 -178.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 49.4 mtp180 -98.72 -26.01 14.49 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.044 0.938 . . . . 0.0 110.525 175.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -95.79 -53.15 3.8 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.731 1.212 . . . . 0.0 108.065 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.626 HG21 HD21 ' A' ' 115' ' ' LEU . 33.1 m -91.02 -171.54 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 122.207 1.003 . . . . 0.0 111.569 170.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 47.1 t -114.52 161.1 18.46 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.304 -1.316 . . . . 0.0 108.216 156.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.2 tt -53.88 -40.24 66.42 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.479 0.311 . . . . 0.0 110.97 168.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.89 -30.31 67.68 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.524 0.73 . . . . 0.0 112.43 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.57 -39.09 88.3 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.613 0.765 . . . . 0.0 110.298 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.744 HD23 ' HE1' ' A' ' 85' ' ' TRP . 23.4 mt -71.61 -53.67 12.92 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.738 -177.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . 0.458 ' HG2' HD23 ' A' ' 99' ' ' LEU . 28.6 mt-30 -69.51 -27.16 64.95 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.445 -173.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -50.53 -54.54 21.62 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.878 0.871 . . . . 0.0 113.331 177.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 23.1 t-80 -99.9 -14.36 18.77 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.4 ' HB1' HD11 ' A' ' 99' ' ' LEU . . . . . . . . 0 CA--C 1.557 1.232 0 O-C-N 122.195 -0.316 . . . . 0.0 111.051 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 120.663 0.268 . . . . 0.0 111.325 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 84.26 -136.04 14.32 Favored Glycine 0 C--N 1.349 1.26 0 N-CA-C 111.858 -0.497 . . . . 0.0 111.858 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -92.97 150.27 20.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-N 117.357 0.578 . . . . 0.0 110.781 176.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -146.77 153.56 25.42 Favored Glycine 0 N--CA 1.478 1.481 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.354 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -90.57 137.72 32.13 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 117.248 0.524 . . . . 0.0 111.045 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -100.12 163.72 12.3 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.79 0.836 . . . . 0.0 111.692 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.2 m -68.32 -24.93 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 CA-C-O 121.72 0.772 . . . . 0.0 111.07 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 62.9 mt -81.38 -21.99 38.64 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.622 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.78 -71.05 0.91 Allowed Glycine 0 C--N 1.353 1.495 0 N-CA-C 114.608 0.603 . . . . 0.0 114.608 -175.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -156.43 150.01 24.67 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 117.128 0.464 . . . . 0.0 111.2 -176.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.3 t0 67.25 151.85 0.07 Allowed 'General case' 0 CA--C 1.567 1.615 0 C-N-CA 125.153 1.381 . . . . 0.0 113.939 164.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.0 tp -168.88 24.13 0.02 OUTLIER 'General case' 0 CA--C 1.566 1.579 0 C-N-CA 123.918 0.887 . . . . 0.0 109.948 175.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -87.13 151.03 23.55 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.492 0.717 . . . . 0.0 111.854 -177.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.527 HG23 ' HG3' ' A' ' 100' ' ' GLN . 8.7 p -91.61 146.29 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.437 0 C-N-CA 123.466 0.707 . . . . 0.0 110.26 177.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 36.0 t -163.94 85.55 0.47 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.865 0.466 . . . . 0.0 111.92 -172.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 35.6 t 55.91 6.36 0.21 Allowed 'General case' 0 N--CA 1.509 2.509 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 169.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 35.2 t 60.51 19.27 9.07 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 124.373 1.069 . . . . 0.0 111.815 -167.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -160.5 146.61 11.58 Favored Pre-proline 0 CA--C 1.56 1.328 0 C-N-CA 124.876 1.271 . . . . 0.0 110.395 -173.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_exo -47.49 -36.73 24.69 Favored 'Trans proline' 0 C--N 1.385 2.469 0 C-N-CA 123.812 3.008 . . . . 0.0 116.064 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.8 mtt -87.88 138.4 31.49 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.03 0.532 . . . . 0.0 110.882 173.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 19.2 p -86.02 85.51 7.37 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.466 0.706 . . . . 0.0 111.836 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -85.37 98.17 2.23 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-N 116.054 -0.521 . . . . 0.0 113.168 177.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -74.49 84.54 2.01 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -124.98 19.15 8.44 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.613 1.165 . . . . 0.0 109.343 163.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 38.9 ttp180 55.8 74.99 0.35 Allowed 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 124.818 1.247 . . . . 0.0 110.971 -170.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -119.41 -100.37 0.43 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 122.953 0.501 . . . . 0.0 110.577 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.432 ' O ' HG22 ' A' ' 14' ' ' VAL . . . -93.35 45.11 2.42 Favored Glycine 0 C--N 1.358 1.76 0 CA-C-N 118.09 0.404 . . . . 0.0 112.903 -177.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -106.41 -34.24 7.48 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.06 0.944 . . . . 0.0 108.787 169.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.7 ' SG ' ' HA ' ' A' ' 101' ' ' SER . 55.5 m 60.27 21.66 11.1 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.174 1.39 . . . . 0.0 113.15 174.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -87.2 59.57 5.66 Favored 'General case' 0 CA--C 1.556 1.176 0 CA-C-O 121.921 0.867 . . . . 0.0 110.107 -179.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.448 HG22 ' HG2' ' A' ' 103' ' ' GLU . 9.0 t -91.73 -21.11 20.9 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.357 174.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -68.39 126.44 29.62 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 168.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.48 -25.33 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 C-N-CA 123.59 0.756 . . . . 0.0 112.671 -176.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -169.02 -49.82 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.365 1.066 . . . . 0.0 109.583 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -142.73 -63.0 0.42 Allowed 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.314 -177.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 75.3 mtt85 -85.4 113.48 21.72 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.953 -177.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.4 -100.4 0.31 Allowed Glycine 0 CA--C 1.534 1.227 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 167.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.3 t -170.58 -64.99 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.541 0.736 . . . . 0.0 110.23 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -151.31 38.95 0.65 Allowed 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.454 0.702 . . . . 0.0 110.466 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 68.1 p -95.7 102.76 14.59 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.493 0.663 . . . . 0.0 111.303 -173.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.824 HG21 ' HB2' ' A' ' 82' ' ' ALA . 53.2 t -134.44 111.1 14.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 124.602 1.161 . . . . 0.0 109.516 175.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 78.2 m -107.44 106.69 17.21 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 169.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.555 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -143.76 152.39 41.19 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.679 1.191 . . . . 0.0 108.904 -175.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -117.54 109.57 16.87 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 121.638 -0.663 . . . . 0.0 111.71 -176.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.488 ' HB3' HD11 ' A' ' 50' ' ' LEU . 89.7 mmm -93.02 141.98 27.8 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.983 0.913 . . . . 0.0 110.838 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.4 p -93.78 156.84 16.45 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.025 0.53 . . . . 0.0 111.497 -176.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -68.15 -33.64 74.84 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.124 0.569 . . . . 0.0 111.713 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -53.61 -49.17 68.4 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 124.194 0.998 . . . . 0.0 111.307 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -77.48 -33.45 54.52 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.087 0.955 . . . . 0.0 111.864 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.488 HD11 ' HB3' ' A' ' 45' ' ' MET . 5.2 mp -77.6 -33.71 53.68 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 113.55 0.945 . . . . 0.0 113.55 -176.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 61.0 mt -71.97 -34.67 69.15 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.901 0.481 . . . . 0.0 110.713 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.418 ' CD2' ' SD ' ' A' ' 93' ' ' MET . 81.9 t80 -63.44 -52.55 61.01 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.074 0.549 . . . . 0.0 110.688 175.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.7 t -67.63 -30.42 69.98 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.853 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.583 ' HG3' ' HA ' ' A' ' 59' ' ' ASP . 71.1 ttt-85 -61.08 -58.35 8.75 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.12 0.568 . . . . 0.0 111.416 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -84.09 4.9 28.16 Favored 'General case' 0 CA--C 1.556 1.206 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -176.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -70.36 -43.19 70.67 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 122.899 0.479 . . . . 0.0 110.772 167.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 160.95 38.11 0.02 OUTLIER Glycine 0 N--CA 1.479 1.518 0 N-CA-C 114.668 0.627 . . . . 0.0 114.668 176.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.449 ' O ' ' HA ' ' A' ' 54' ' ' ARG . 44.8 t-20 -174.51 118.21 0.21 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.809 0.843 . . . . 0.0 108.815 176.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.583 ' HA ' ' HG3' ' A' ' 54' ' ' ARG . 17.3 m-20 -69.79 105.83 2.91 Favored 'General case' 0 CA--C 1.555 1.151 0 CA-C-O 120.87 0.367 . . . . 0.0 111.889 178.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.482 HD23 ' HG ' ' A' ' 50' ' ' LEU . 8.2 mp -67.69 -30.59 70.15 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.92 0.888 . . . . 0.0 109.953 170.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.493 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 1.7 mpt? -100.3 -144.99 0.34 Allowed 'General case' 0 CA--C 1.563 1.457 0 C-N-CA 124.401 1.08 . . . . 0.0 108.145 168.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 70.4 p -96.39 165.41 16.25 Favored Pre-proline 0 N--CA 1.492 1.637 0 C-N-CA 123.26 0.624 . . . . 0.0 110.552 169.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -72.49 34.69 0.31 Allowed 'Trans proline' 0 C--N 1.39 2.747 0 C-N-CA 123.154 2.57 . . . . 0.0 114.225 174.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -116.51 145.81 36.08 Favored Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 124.2 1.0 . . . . 0.0 109.938 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -71.31 -6.99 20.39 Favored 'Trans proline' 0 C--N 1.382 2.318 0 C-N-CA 122.612 2.208 . . . . 0.0 113.528 175.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -80.5 168.05 19.4 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.049 0.94 . . . . 0.0 110.983 175.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -87.15 37.0 0.75 Allowed 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.454 0.702 . . . . 0.0 111.749 -174.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -84.69 112.06 20.13 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 124.088 0.955 . . . . 0.0 110.33 -179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -119.19 144.25 35.8 Favored Pre-proline 0 N--CA 1.486 1.364 0 C-N-CA 124.203 1.001 . . . . 0.0 110.606 177.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -69.6 -45.73 1.57 Allowed 'Trans proline' 0 C--N 1.374 1.915 0 C-N-CA 122.157 1.905 . . . . 0.0 112.762 173.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -175.79 145.72 7.81 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 55.37 92.37 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.722 1.209 . . . . 0.0 112.339 -175.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -165.96 1.35 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.112 0.965 . . . . 0.0 110.519 177.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.96 111.09 6.08 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.597 0.759 . . . . 0.0 112.686 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 109.3 -1.17 31.11 Favored Glycine 0 N--CA 1.474 1.208 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 175.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -74.77 93.8 2.65 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 117.55 0.675 . . . . 0.0 110.991 173.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -85.63 85.0 7.43 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 173.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.6 t90 163.11 127.7 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 125.27 1.428 . . . . 0.0 108.552 -171.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 51.4 t 52.28 27.3 4.64 Favored 'General case' 0 N--CA 1.505 2.294 0 C-N-CA 124.184 0.994 . . . . 0.0 112.744 174.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.555 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.6 tm? -66.11 130.41 43.14 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.216 -176.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.4 t -57.22 104.44 0.16 Allowed 'General case' 0 N--CA 1.474 0.732 0 O-C-N 123.638 0.586 . . . . 0.0 110.957 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.824 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -51.72 -35.72 44.13 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.652 1.181 . . . . 0.0 112.897 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.8 m -63.97 -32.81 74.48 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.055 0.942 . . . . 0.0 112.286 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.464 ' HD2' HD23 ' A' ' 60' ' ' LEU . 46.3 ttp180 -71.6 -47.75 52.72 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.246 0.618 . . . . 0.0 112.041 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.472 ' HE1' HD23 ' A' ' 115' ' ' LEU . 8.3 t-105 -59.21 -47.77 84.11 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.284 0.564 . . . . 0.0 109.966 174.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.411 HE21 ' HG3' ' A' ' 90' ' ' GLU . 22.6 tp60 -60.31 -39.15 85.99 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.923 177.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -65.32 -43.28 91.47 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.137 0.575 . . . . 0.0 111.556 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.86 -24.98 60.94 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.244 0.217 . . . . 0.0 111.446 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.597 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 49.1 t80 -66.87 -48.52 68.55 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-O 120.909 0.385 . . . . 0.0 110.331 171.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.411 ' HG3' HE21 ' A' ' 86' ' ' GLN . 39.8 mt-10 -65.5 -27.05 68.2 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.807 0.843 . . . . 0.0 112.109 177.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.73 -2.31 22.83 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.348 0.659 . . . . 0.0 112.465 174.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.39 23.0 63.79 Favored Glycine 0 C--N 1.355 1.631 0 CA-C-N 116.662 -0.245 . . . . 0.0 113.542 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . 0.418 ' SD ' ' CD2' ' A' ' 52' ' ' PHE . 67.9 mtp -114.6 -86.06 0.6 Allowed 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 123.571 0.749 . . . . 0.0 111.129 -175.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.597 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 63.71 108.47 0.03 OUTLIER Pre-proline 0 CA--C 1.573 1.83 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 175.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -67.59 167.68 20.27 Favored 'Trans proline' 0 C--N 1.386 2.52 0 C-N-CA 123.367 2.711 . . . . 0.0 113.809 172.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.05 105.54 0.85 Allowed 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.396 2.064 . . . . 0.0 111.97 171.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.5 p -95.16 142.58 13.36 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 C-N-CA 123.631 0.773 . . . . 0.0 110.934 -176.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.435 HG12 HD13 ' A' ' 120' ' ' LEU . 4.9 m -75.14 94.55 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.834 -178.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.424 HD11 ' HG2' ' A' ' 116' ' ' GLN . 3.3 mm? -58.9 -27.49 65.28 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 123.585 0.754 . . . . 0.0 112.352 173.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.527 ' HG3' HG23 ' A' ' 14' ' ' VAL . 10.5 tt0 -69.62 -47.01 64.94 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.742 0.817 . . . . 0.0 112.085 177.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.7 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 32.6 t -92.97 -30.47 15.33 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -171.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.8 p -56.6 121.03 8.76 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 170.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.448 ' HG2' HG22 ' A' ' 31' ' ' THR . 3.7 mp0 -84.83 172.55 11.34 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.893 0.877 . . . . 0.0 112.106 -177.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -72.55 -28.24 62.71 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 122.972 0.509 . . . . 0.0 111.015 -172.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.2 t -59.64 -25.97 65.13 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.63 0.772 . . . . 0.0 112.367 176.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.52 -37.65 70.73 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.885 0.874 . . . . 0.0 113.299 177.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.0 mp -65.81 2.78 0.93 Allowed 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -173.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 -98.4 -20.24 17.26 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 123.107 0.563 . . . . 0.0 111.618 -177.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -109.07 -32.01 7.4 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.586 HG12 ' H ' ' A' ' 111' ' ' SER . 2.5 t -110.09 -166.06 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 CA-C-N 112.395 -2.184 . . . . 0.0 108.529 -178.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . 0.586 ' H ' HG12 ' A' ' 110' ' ' VAL . 58.2 p -140.73 156.05 46.29 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 121.591 -0.693 . . . . 0.0 109.594 164.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.2 tt -53.5 -45.47 69.7 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.275 0.63 . . . . 0.0 112.114 173.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.17 -39.47 82.6 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.314 0.645 . . . . 0.0 111.997 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -64.52 -36.22 83.49 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.543 0.737 . . . . 0.0 112.02 175.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.472 HD23 ' HE1' ' A' ' 85' ' ' TRP . 39.2 mt -66.82 -55.58 14.2 Favored 'General case' 0 CA--C 1.55 0.956 0 CA-C-O 121.214 0.53 . . . . 0.0 109.671 177.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.424 ' HG2' HD11 ' A' ' 99' ' ' LEU . 2.8 mt-30 -64.75 -34.88 79.37 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.27 1.028 . . . . 0.0 112.213 -172.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.8 -40.69 69.77 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.901 0.88 . . . . 0.0 112.656 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -123.76 47.61 2.01 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.288 0.635 . . . . 0.0 110.36 178.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -61.45 155.07 22.69 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 175.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.435 HD13 HG12 ' A' ' 98' ' ' VAL . 2.5 pt? -63.62 166.4 9.49 Favored Pre-proline 0 CA--C 1.567 1.621 0 C-N-CA 123.923 0.889 . . . . 0.0 111.753 173.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -54.08 108.17 0.27 Allowed 'Trans proline' 0 C--N 1.381 2.243 0 C-N-CA 122.665 2.243 . . . . 0.0 112.009 165.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 60.7 t -73.66 87.42 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 CA-C-O 121.703 0.763 . . . . 0.0 110.388 -177.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 94.6 mt -80.4 120.4 24.37 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.038 175.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -71.47 112.94 8.0 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.307 0.643 . . . . 0.0 110.327 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -99.5 132.75 44.62 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.819 0.848 . . . . 0.0 109.487 173.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -69.11 104.51 2.17 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.97 0.508 . . . . 0.0 111.122 -177.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 50.7 m80 -71.07 103.55 2.76 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.929 0.892 . . . . 0.0 110.818 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -80.98 8.54 8.18 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.536 0.734 . . . . 0.0 111.992 176.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -64.71 -28.18 69.42 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 123.646 0.778 . . . . 0.0 111.268 173.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 . . . . . 0 CA--C 1.57 1.722 0 CA-C-O 118.964 -0.541 . . . . 0.0 110.292 172.732 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.4 ttm . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 110.442 -0.207 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 77.75 -104.06 1.94 Allowed Glycine 0 CA--C 1.535 1.31 0 CA-C-N 116.377 -0.374 . . . . 0.0 113.912 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -118.28 150.09 40.05 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.757 0.823 . . . . 0.0 110.434 -176.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.52 148.37 48.38 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 114.229 0.451 . . . . 0.0 114.229 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -90.78 165.55 13.59 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.077 0.951 . . . . 0.0 111.463 -175.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.431 HD22 ' N ' ' A' ' 6' ' ' ASN . 0.1 OUTLIER -158.8 -175.02 5.06 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.464 0.706 . . . . 0.0 111.637 -174.375 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.0 m -110.43 -14.27 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 C-N-CA 123.494 0.717 . . . . 0.0 111.456 175.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.9 mp -87.07 -63.62 1.28 Allowed 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.015 0.526 . . . . 0.0 111.125 -162.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -164.22 -62.27 0.02 OUTLIER Glycine 0 CA--C 1.529 0.925 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.111 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.628 ' HG3' ' H ' ' A' ' 11' ' ' ASP . 18.8 pt20 -143.94 -71.79 0.29 Allowed 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.96 0.904 . . . . 0.0 110.175 177.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.628 ' H ' ' HG3' ' A' ' 10' ' ' GLN . 11.0 m-20 55.57 162.97 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 125.711 1.604 . . . . 0.0 114.402 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.1 tp 70.01 157.25 0.16 Allowed 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 124.668 1.187 . . . . 0.0 110.487 -167.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 67.42 -159.97 0.23 Allowed 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 124.351 1.06 . . . . 0.0 111.193 -177.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.642 HG23 ' H ' ' A' ' 28' ' ' PHE . 12.8 p -66.39 152.93 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.434 0 C-N-CA 123.162 0.585 . . . . 0.0 111.441 174.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.402 ' SG ' ' HB3' ' A' ' 28' ' ' PHE . 30.3 p -53.74 -32.5 52.37 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 123.597 0.759 . . . . 0.0 112.151 172.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.544 ' H ' HG22 ' A' ' 14' ' ' VAL . 49.5 t 73.06 -65.68 0.35 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 125.737 1.615 . . . . 0.0 112.618 175.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 43.4 t -75.75 76.96 2.7 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 121.598 0.713 . . . . 0.0 111.351 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -168.46 132.52 1.36 Allowed Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.611 1.164 . . . . 0.0 108.979 -178.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -57.04 143.44 92.8 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 123.05 2.5 . . . . 0.0 114.18 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.9 mtt 65.7 8.04 4.93 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 172.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 72.7 p -80.56 -56.46 4.15 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-N 118.517 0.599 . . . . 0.0 109.726 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 57.62 -104.58 0.45 Allowed Glycine 0 C--N 1.35 1.321 0 C-N-CA 124.297 0.951 . . . . 0.0 114.604 170.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 11.7 m-90 -82.94 57.33 3.83 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.861 0.864 . . . . 0.0 111.0 177.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 74.77 -44.16 0.54 Allowed 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 125.962 1.705 . . . . 0.0 114.608 177.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 53.6 ttt-85 68.02 -73.09 0.09 Allowed 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.849 1.26 . . . . 0.0 110.501 -169.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -141.38 4.01 1.76 Allowed 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.304 1.042 . . . . 0.0 111.111 175.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 78.27 77.46 0.86 Allowed Glycine 0 CA--C 1.534 1.219 0 N-CA-C 110.951 -0.859 . . . . 0.0 110.951 -166.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.642 ' H ' HG23 ' A' ' 14' ' ' VAL . 28.4 t80 -63.52 148.21 49.33 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.355 0.662 . . . . 0.0 111.911 -175.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 75.4 m 72.56 22.36 3.34 Favored 'General case' 0 N--CA 1.5 2.042 0 C-N-CA 125.683 1.593 . . . . 0.0 112.186 -172.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -80.27 107.53 13.14 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.629 0.772 . . . . 0.0 110.46 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.6 t -117.89 102.28 8.96 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.23 0.612 . . . . 0.0 111.22 -177.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -155.85 160.95 40.63 Favored 'General case' 0 CA--C 1.555 1.173 0 CA-C-O 121.077 0.465 . . . . 0.0 111.439 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -69.96 -34.33 59.43 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.426 0 C-N-CA 124.09 0.956 . . . . 0.0 112.894 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -154.12 -60.44 0.13 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.142 0.577 . . . . 0.0 111.638 -174.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -70.97 95.0 1.13 Allowed 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.714 0.805 . . . . 0.0 111.4 -169.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -59.59 100.21 0.08 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 114.698 -1.137 . . . . 0.0 112.606 -178.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.46 -136.69 7.35 Favored Glycine 0 C--N 1.347 1.176 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.787 178.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.2 t -86.83 84.29 7.38 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.418 0.687 . . . . 0.0 111.383 -177.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -144.17 14.08 1.65 Allowed 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 124.032 0.933 . . . . 0.0 110.285 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.425 ' HB ' ' HG2' ' A' ' 103' ' ' GLU . 26.4 m -92.41 108.14 19.74 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.268 0.627 . . . . 0.0 110.704 -167.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.498 HG21 ' HB2' ' A' ' 82' ' ' ALA . 26.2 t -131.37 112.98 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 124.267 1.027 . . . . 0.0 110.426 -177.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 81.6 m -107.09 108.04 19.32 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 171.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.414 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -145.12 153.74 41.72 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.28 1.032 . . . . 0.0 109.138 -176.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.668 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 27.8 tt0 -119.12 107.76 13.86 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 118.708 0.685 . . . . 0.0 111.88 177.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.591 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 81.5 mmm -84.8 114.47 22.1 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.102 0.961 . . . . 0.0 109.035 166.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.6 t -80.94 151.61 28.45 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 122.86 0.464 . . . . 0.0 110.301 -176.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.406 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 28.8 tt0 -56.84 -33.62 66.97 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 123.558 0.536 . . . . 0.0 111.706 -175.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -50.76 -55.69 15.56 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 124.165 0.986 . . . . 0.0 110.99 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -79.67 -29.61 40.93 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 124.661 1.185 . . . . 0.0 113.189 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.1 tp -82.69 -24.49 33.65 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.304 0.641 . . . . 0.0 111.894 -173.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 47' ' ' GLU . 63.8 mt -64.92 -34.03 77.42 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 122.885 0.474 . . . . 0.0 110.55 171.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -58.31 -44.46 88.6 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.13 0.572 . . . . 0.0 110.899 169.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.1 m -68.88 -30.06 68.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.201 0.6 . . . . 0.0 111.777 175.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.69 ' HA ' ' HB3' ' A' ' 59' ' ' ASP . 39.3 ttp180 -67.1 -55.88 12.36 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.989 0.916 . . . . 0.0 111.849 -177.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -69.72 -13.38 62.26 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.661 0.784 . . . . 0.0 112.089 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -76.28 -23.1 54.39 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.056 0.943 . . . . 0.0 111.326 170.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.96 -7.12 57.08 Favored Glycine 0 N--CA 1.477 1.396 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.932 -176.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -97.65 39.05 1.23 Allowed 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 124.244 1.017 . . . . 0.0 111.232 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.69 ' HB3' ' HA ' ' A' ' 54' ' ' ARG . 3.9 p-10 -69.94 120.88 16.33 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-O 121.429 0.633 . . . . 0.0 112.252 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.9 tp -97.33 26.27 4.98 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-O 121.989 0.899 . . . . 0.0 109.316 169.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.48 ' SD ' ' HB2' ' A' ' 74' ' ' ALA . 19.5 mmt -72.28 -60.66 2.12 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.461 1.104 . . . . 0.0 110.835 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.509 HG22 ' HG3' ' A' ' 64' ' ' ARG . 26.8 m 56.86 94.86 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.231 0 C-N-CA 124.979 1.312 . . . . 0.0 110.793 -171.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -52.1 -48.25 22.58 Favored 'Trans proline' 0 C--N 1.383 2.38 0 C-N-CA 123.232 2.621 . . . . 0.0 113.887 -174.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.509 ' HG3' HG22 ' A' ' 62' ' ' THR . 64.1 mtm180 56.18 86.5 0.16 Allowed Pre-proline 0 N--CA 1.488 1.439 0 C-N-CA 123.511 0.724 . . . . 0.0 111.21 -177.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -82.71 24.11 0.76 Allowed 'Trans proline' 0 C--N 1.372 1.795 0 C-N-CA 123.189 2.593 . . . . 0.0 113.659 -172.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -88.54 -92.61 0.11 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.066 0.947 . . . . 0.0 110.263 -173.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -142.01 -81.02 0.22 Allowed 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 176.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -158.9 115.44 2.69 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.12 0.968 . . . . 0.0 109.276 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -128.49 153.86 79.33 Favored Pre-proline 0 N--CA 1.489 1.493 0 C-N-CA 124.164 0.986 . . . . 0.0 110.861 -173.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.22 177.11 2.72 Favored 'Trans proline' 0 C--N 1.386 2.543 0 C-N-CA 122.946 2.431 . . . . 0.0 114.6 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 123.11 -132.09 8.46 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.287 -174.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -149.64 175.57 11.43 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.435 0.694 . . . . 0.0 111.204 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.38 -174.78 4.67 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.743 0.817 . . . . 0.0 110.464 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.48 ' HB2' ' SD ' ' A' ' 61' ' ' MET . . . -62.09 106.85 0.77 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.509 0.723 . . . . 0.0 112.844 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 82.43 56.94 2.71 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.952 -174.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -147.03 107.21 4.02 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 123.683 0.793 . . . . 0.0 110.462 176.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.668 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 4.8 ptp180 -79.78 89.83 5.23 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.245 0.618 . . . . 0.0 111.606 -176.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 31.3 t-105 -178.06 122.07 0.1 Allowed 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.789 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 42.3 t 52.36 53.82 11.72 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.155 0.982 . . . . 0.0 112.226 174.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.414 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.3 tm? -92.99 124.24 36.82 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.626 -175.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 61.5 m -59.39 111.97 1.58 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.023 0.529 . . . . 0.0 109.995 173.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.498 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -57.47 -27.29 62.36 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -171.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.8 m -69.59 -28.76 66.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.396 0.679 . . . . 0.0 112.266 176.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -61.89 -45.11 95.18 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.803 0.841 . . . . 0.0 111.325 175.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.591 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 1.3 t-105 -70.85 -47.92 56.73 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.63 174.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.48 HE21 ' HG3' ' A' ' 90' ' ' GLU . 21.2 tp60 -56.15 -42.79 77.56 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.098 0.959 . . . . 0.0 111.665 -177.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -55.31 -45.54 76.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.724 0.81 . . . . 0.0 111.574 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.21 -37.76 86.57 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.457 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.529 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 51.6 t80 -71.9 -34.41 69.11 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 122.439 0.296 . . . . 0.0 111.649 178.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.48 ' HG3' HE21 ' A' ' 86' ' ' GLN . 58.3 mt-10 -69.45 -23.11 63.63 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.206 0.602 . . . . 0.0 111.754 178.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.61 -11.37 59.66 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.558 0.743 . . . . 0.0 111.99 170.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 81.81 8.8 86.31 Favored Glycine 0 CA--C 1.537 1.454 0 CA-C-N 116.496 -0.32 . . . . 0.0 112.995 -174.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 25.9 ttt -88.13 -77.95 0.34 Allowed 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 124.313 1.045 . . . . 0.0 110.135 -174.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.529 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 61.94 114.18 0.02 OUTLIER Pre-proline 0 N--CA 1.497 1.905 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 167.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.443 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 92.6 Cg_endo -74.6 171.46 18.12 Favored 'Trans proline' 0 CA--C 1.572 2.39 0 C-N-CA 122.824 2.349 . . . . 0.0 113.152 171.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.38 111.15 2.65 Favored 'Trans proline' 0 C--N 1.383 2.394 0 C-N-CA 122.057 1.838 . . . . 0.0 111.778 171.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -97.35 134.26 35.96 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 123.065 0.546 . . . . 0.0 110.525 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.1 m -67.97 98.78 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 123.954 0.902 . . . . 0.0 113.231 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.553 HD21 ' HB3' ' A' ' 115' ' ' LEU . 3.6 mm? -73.57 -13.4 61.02 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.743 -0.598 . . . . 0.0 112.062 172.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -83.18 -12.45 56.89 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 124.273 1.029 . . . . 0.0 112.418 176.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.2 t -130.73 -26.35 2.23 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -174.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.3 p -55.33 106.0 0.21 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.407 0.622 . . . . 0.0 112.098 170.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.455 ' HG3' ' H ' ' A' ' 105' ' ' SER . 15.1 tp10 -61.77 141.28 58.0 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 125.09 1.356 . . . . 0.0 110.968 168.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.465 ' HA ' HD13 ' A' ' 107' ' ' LEU . 21.5 ptmt -61.33 -17.52 54.19 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -177.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.455 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 69.6 m -58.19 -27.33 63.78 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 123.186 0.594 . . . . 0.0 112.594 171.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.05 -28.29 68.96 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.573 0.749 . . . . 0.0 112.712 173.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' A' ' 104' ' ' LYS . 7.9 mp -70.31 1.99 4.31 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 124.29 1.036 . . . . 0.0 113.65 -175.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 48.3 mtp180 -88.75 -35.29 16.77 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.143 0.577 . . . . 0.0 111.235 167.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -91.34 -49.47 6.33 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.212 1.005 . . . . 0.0 110.361 -174.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.58 HG21 ' HE1' ' A' ' 85' ' ' TRP . 6.9 p -106.08 176.02 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.367 0 C-N-CA 124.407 1.083 . . . . 0.0 108.496 169.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 47.0 m -116.17 153.26 32.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.975 -1.078 . . . . 0.0 109.992 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.8 tt -57.09 -36.5 70.67 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.511 0.724 . . . . 0.0 112.603 179.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.22 -34.16 73.26 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.5 -36.72 79.31 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.499 0.719 . . . . 0.0 110.526 175.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.553 ' HB3' HD21 ' A' ' 99' ' ' LEU . 85.6 mt -68.35 -52.74 29.91 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.376 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -73.77 -27.86 61.37 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 114.73 -1.123 . . . . 0.0 112.672 -172.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -66.97 -17.16 64.79 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 175.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -130.42 20.01 5.24 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 123.383 0.673 . . . . 0.0 111.955 172.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -90.6 -162.84 0.94 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.644 0.778 . . . . 0.0 110.475 168.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.39 150.27 65.39 Favored Pre-proline 0 CA--C 1.562 1.407 0 CA-C-O 119.012 -0.518 . . . . 0.0 110.788 167.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.29 82.23 0.05 OUTLIER 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.48 2.786 . . . . 0.0 114.562 -175.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 42.7 t -106.45 92.58 2.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 124.437 1.095 . . . . 0.0 108.446 176.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 123' ' ' LEU . 1.1 pp -80.0 108.03 13.26 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-O 121.465 0.65 . . . . 0.0 111.218 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -105.28 137.04 43.71 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.05 0.54 . . . . 0.0 110.746 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 35.6 p80 -111.01 6.92 21.32 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 124.389 1.075 . . . . 0.0 113.061 -173.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 52.2 m170 -60.13 113.85 2.56 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 47.1 p-80 -163.14 165.68 24.29 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.212 1.005 . . . . 0.0 110.703 174.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 11.0 p-80 -163.94 166.06 22.04 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.049 0.94 . . . . 0.0 110.778 175.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -88.46 140.61 29.29 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.515 0.726 . . . . 0.0 110.314 176.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 29.5 p-80 . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 119.523 -0.275 . . . . 0.0 110.647 172.051 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtt . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 120.478 0.18 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -74.87 91.81 0.8 Allowed Glycine 0 CA--C 1.541 1.658 0 CA-C-N 116.477 -0.329 . . . . 0.0 113.833 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -78.28 111.9 14.72 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.497 0.719 . . . . 0.0 110.566 176.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -148.2 174.91 27.74 Favored Glycine 0 C--N 1.349 1.303 0 N-CA-C 113.994 0.358 . . . . 0.0 113.994 -175.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -90.63 130.32 36.66 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.713 0.805 . . . . 0.0 110.213 -176.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -143.84 158.47 43.66 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.842 0.857 . . . . 0.0 110.811 -178.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 21.7 t 72.71 -48.29 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.398 0 C-N-CA 126.149 1.779 . . . . 0.0 112.783 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.406 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 2.6 pp -65.75 -48.67 71.1 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.659 0.784 . . . . 0.0 111.663 -176.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -89.24 39.87 3.1 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 114.353 0.501 . . . . 0.0 114.353 -173.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -160.38 -47.37 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.89 0.876 . . . . 0.0 110.543 -176.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -86.03 -37.89 18.45 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.843 0.857 . . . . 0.0 110.926 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.544 ' HG ' ' H ' ' A' ' 13' ' ' GLU . 14.1 tp -118.49 -151.56 0.48 Allowed 'General case' 0 CA--C 1.569 1.706 0 C-N-CA 123.83 0.852 . . . . 0.0 109.612 -177.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.544 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 26.1 mm-40 66.84 176.64 0.24 Allowed 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.315 1.446 . . . . 0.0 112.716 -175.248 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.7 p -60.74 123.19 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-O 121.289 0.566 . . . . 0.0 111.453 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.594 ' SG ' ' HA ' ' A' ' 21' ' ' THR . 37.0 t -137.48 98.46 3.7 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.507 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 27.5 p -121.02 150.33 41.32 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.502 1.121 . . . . 0.0 110.371 173.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 54.0 t 72.95 -59.07 0.58 Allowed 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 125.373 1.469 . . . . 0.0 113.606 176.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.6 150.13 18.86 Favored Pre-proline 0 CA--C 1.564 1.499 0 C-N-CA 124.788 1.235 . . . . 0.0 113.629 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -56.85 129.99 37.49 Favored 'Trans proline' 0 C--N 1.392 2.846 0 C-N-CA 123.247 2.631 . . . . 0.0 112.785 -178.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 10.9 tmm? 65.0 95.26 0.05 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.959 1.303 . . . . 0.0 110.281 -171.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.594 ' HA ' ' SG ' ' A' ' 15' ' ' CYS . 43.2 p -96.2 169.19 10.11 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.288 0.635 . . . . 0.0 111.406 176.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -54.75 -48.95 63.58 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 123.446 0.466 . . . . 0.0 114.115 -178.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 31.5 t90 67.43 163.83 0.2 Allowed 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.745 1.218 . . . . 0.0 112.554 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 44.3 t80 68.37 -87.65 0.03 OUTLIER 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 124.536 1.134 . . . . 0.0 111.751 172.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 65.7 mmt-85 -142.78 22.64 1.95 Allowed 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 124.658 1.183 . . . . 0.0 109.966 178.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -126.92 142.48 51.54 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.042 0.937 . . . . 0.0 110.491 -166.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 88.1 -92.09 1.78 Allowed Glycine 0 CA--C 1.531 1.077 0 CA-C-N 114.766 -1.106 . . . . 0.0 113.922 170.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -90.54 143.13 27.05 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.191 0.596 . . . . 0.0 111.955 -171.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 85.4 m -130.21 -175.55 3.66 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.574 1.15 . . . . 0.0 111.029 -178.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -77.27 70.65 3.69 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.227 0.611 . . . . 0.0 112.493 -178.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.1 t -168.32 157.14 8.94 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.244 0.618 . . . . 0.0 111.322 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -109.19 156.89 19.34 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.295 0.638 . . . . 0.0 109.384 168.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 13.4 p -64.91 -35.92 76.47 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 123.609 0.763 . . . . 0.0 112.832 -174.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -72.78 -21.17 61.03 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.563 0.745 . . . . 0.0 112.573 -171.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -76.92 19.19 0.31 Allowed 'General case' 0 CA--C 1.564 1.483 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -177.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? 61.38 22.4 12.8 Favored 'General case' 0 CA--C 1.567 1.626 0 C-N-CA 124.463 1.105 . . . . 0.0 111.703 175.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.12 6.03 67.53 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 114.947 0.739 . . . . 0.0 114.947 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.2 m -92.96 20.26 6.88 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.754 0.822 . . . . 0.0 112.121 -179.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 105' ' ' SER . 68.3 m80 67.58 174.44 0.26 Allowed 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 125.341 1.456 . . . . 0.0 112.277 -178.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 105' ' ' SER . 60.3 p -94.19 100.45 12.52 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.461 0.648 . . . . 0.0 110.35 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.737 HG11 ' HB2' ' A' ' 82' ' ' ALA . 39.3 t -136.26 102.65 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 C-N-CA 123.615 0.766 . . . . 0.0 109.982 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.566 ' SG ' ' HA ' ' A' ' 78' ' ' TRP . 80.2 m -111.18 107.39 16.71 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 174.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.483 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -138.57 150.4 46.28 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -172.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 20.7 tt0 -116.96 130.24 56.57 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.775 0.322 . . . . 0.0 111.246 -175.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.421 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 37.6 mtm -116.33 154.24 30.56 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.409 173.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.498 HG22 ' HB3' ' A' ' 95' ' ' PRO . 9.2 t -92.91 156.22 17.08 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.755 0.822 . . . . 0.0 110.517 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.436 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 37.1 tt0 -54.38 -32.69 57.63 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.198 0.599 . . . . 0.0 112.313 -175.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -48.99 -53.17 21.05 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.622 1.169 . . . . 0.0 112.351 -176.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.463 ' HA ' ' HD2' ' A' ' 52' ' ' PHE . 53.8 t80 -71.05 -40.6 71.58 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 177.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 45' ' ' MET . 8.9 mp -63.78 -24.52 67.79 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.827 0.451 . . . . 0.0 111.36 -178.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.436 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 92.8 mt -71.28 -45.87 62.15 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.924 0.889 . . . . 0.0 110.939 170.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.463 ' HD2' ' HA ' ' A' ' 49' ' ' PHE . 25.9 m-85 -58.35 -31.76 67.9 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 123.121 0.568 . . . . 0.0 111.258 174.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 58.5 m -71.29 -42.03 69.21 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 115.542 -0.753 . . . . 0.0 110.979 173.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -61.58 -39.32 90.76 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.554 0.742 . . . . 0.0 112.482 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -64.41 -16.12 61.8 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -70.94 -21.13 62.38 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.131 0.573 . . . . 0.0 112.526 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -167.33 37.48 0.23 Allowed Glycine 0 C--N 1.355 1.584 0 CA-C-O 119.977 -0.346 . . . . 0.0 113.857 -178.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 78.42 -40.62 0.29 Allowed 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 125.846 1.658 . . . . 0.0 114.39 170.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -138.08 -78.78 0.36 Allowed 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 123.044 0.538 . . . . 0.0 112.068 -177.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 36.15 24.32 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 116.417 2.006 . . . . 0.0 116.417 -173.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 56.8 mtt -93.36 -41.61 9.74 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.605 0.762 . . . . 0.0 109.607 171.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 91.5 m -146.3 133.31 10.02 Favored Pre-proline 0 CA--C 1.553 1.067 0 C-N-CA 124.585 1.154 . . . . 0.0 108.989 175.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -67.62 133.08 28.72 Favored 'Trans proline' 0 C--N 1.375 1.949 0 C-N-CA 122.138 1.892 . . . . 0.0 111.621 169.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 69.37 153.89 0.14 Allowed Pre-proline 0 N--CA 1.501 2.077 0 C-N-CA 124.894 1.277 . . . . 0.0 112.673 176.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.01 -13.93 23.74 Favored 'Trans proline' 0 C--N 1.386 2.505 0 C-N-CA 122.199 1.932 . . . . 0.0 112.331 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -134.38 118.16 17.14 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.245 -1.021 . . . . 0.0 108.245 174.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -139.28 16.15 2.59 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.594 0.758 . . . . 0.0 111.171 -173.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 24.4 m-80 67.64 -71.29 0.11 Allowed 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 125.46 1.504 . . . . 0.0 111.577 -176.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -113.47 136.72 21.94 Favored Pre-proline 0 CA--C 1.559 1.309 0 C-N-CA 124.312 1.045 . . . . 0.0 110.692 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -80.1 145.9 17.67 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.411 2.074 . . . . 0.0 112.094 169.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -81.77 -162.78 30.54 Favored Glycine 0 CA--C 1.534 1.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 112.925 175.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 78' ' ' TRP . 3.0 mm? -76.53 111.27 11.83 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.137 0.494 . . . . 0.0 111.138 -178.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.0 pttm -104.51 -168.39 1.48 Allowed 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 123.742 0.817 . . . . 0.0 110.226 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.67 125.78 25.43 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.475 0.71 . . . . 0.0 111.592 176.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.75 -2.61 70.03 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 114.41 0.524 . . . . 0.0 114.41 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -97.09 123.06 40.74 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.079 0.551 . . . . 0.0 110.539 173.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.48 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.1 OUTLIER -114.89 91.22 3.55 Favored 'General case' 0 CA--C 1.574 1.88 0 CA-C-O 121.919 0.866 . . . . 0.0 110.437 176.643 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.566 ' HA ' ' SG ' ' A' ' 42' ' ' CYS . 75.0 t90 -172.28 124.49 0.5 Allowed 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.318 0.647 . . . . 0.0 110.098 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 86.9 m 50.59 26.13 2.31 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.483 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -66.31 118.52 10.1 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 6.4 p -61.98 105.92 0.64 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 122.993 0.517 . . . . 0.0 110.564 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.737 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -55.16 -23.61 22.37 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.953 1.301 . . . . 0.0 113.775 -176.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.7 m -58.92 -38.77 79.7 Favored 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 123.503 0.721 . . . . 0.0 112.425 173.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.3 mmm-85 -74.97 -36.12 62.05 Favored 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 123.726 0.81 . . . . 0.0 112.433 178.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.567 ' HE1' HD23 ' A' ' 115' ' ' LEU . 7.7 t-105 -64.88 -45.8 84.47 Favored 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 173.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -57.94 -43.89 86.6 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.85 0.86 . . . . 0.0 110.792 173.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -55.28 -38.32 68.44 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.515 1.126 . . . . 0.0 112.024 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.34 94.03 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 174.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -68.26 -40.25 81.95 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 122.586 0.354 . . . . 0.0 111.48 174.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -63.48 -33.34 75.35 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.016 0.926 . . . . 0.0 111.785 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.29 -15.97 25.24 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 123.843 0.857 . . . . 0.0 112.138 175.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.87 -20.93 37.5 Favored Glycine 0 CA--C 1.542 1.779 0 N-CA-C 115.202 0.841 . . . . 0.0 115.202 175.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -89.79 33.08 0.86 Allowed 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 118.054 0.927 . . . . 0.0 113.023 -174.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.22 112.79 4.54 Favored Pre-proline 0 CA--C 1.569 1.679 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.498 ' HB3' HG22 ' A' ' 46' ' ' THR . 57.4 Cg_exo -59.83 171.51 2.8 Favored 'Trans proline' 0 CA--C 1.568 2.182 0 C-N-CA 123.947 3.098 . . . . 0.0 114.825 172.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -80.1 113.15 2.92 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.719 2.279 . . . . 0.0 111.983 168.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 9.7 p -99.25 156.78 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 123.884 0.873 . . . . 0.0 110.642 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.516 HG21 ' HB3' ' A' ' 101' ' ' SER . 33.3 m -81.44 164.32 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.096 0 CA-C-O 121.608 0.718 . . . . 0.0 112.228 173.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 83.5 mt -112.55 -13.78 13.28 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.973 0.909 . . . . 0.0 110.056 163.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -71.6 -70.47 0.32 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.735 0.814 . . . . 0.0 111.208 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.516 ' HB3' HG21 ' A' ' 98' ' ' VAL . 34.6 t -66.26 -31.55 72.43 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.219 0.608 . . . . 0.0 112.061 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 76.2 m -62.67 127.38 31.04 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.61 0.764 . . . . 0.0 111.938 175.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -98.97 164.27 12.25 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.891 0.877 . . . . 0.0 110.842 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.457 ' HD3' HD22 ' A' ' 107' ' ' LEU . 3.0 tppp? -53.5 -32.83 52.01 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 125.422 1.489 . . . . 0.0 113.595 176.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.46 ' HB3' ' HB3' ' A' ' 39' ' ' HIS . 56.7 m -60.5 -26.06 66.54 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 178.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.68 -33.45 72.87 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.393 0.677 . . . . 0.0 112.667 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.457 HD22 ' HD3' ' A' ' 104' ' ' LYS . 8.8 mp -61.65 -24.46 66.75 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.923 0.889 . . . . 0.0 112.264 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -74.34 -11.49 60.27 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.978 0.911 . . . . 0.0 112.81 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -116.3 -48.99 2.69 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.041 0.937 . . . . 0.0 111.708 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.481 HG21 ' CD1' ' A' ' 85' ' ' TRP . 14.8 p -113.25 -24.33 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -169.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 46.2 t 75.2 148.17 0.1 Allowed 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 125.112 1.365 . . . . 0.0 112.607 -173.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.494 ' HA ' HD12 ' A' ' 115' ' ' LEU . 3.8 tt -58.59 -39.05 79.29 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.487 1.115 . . . . 0.0 112.149 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.72 -38.83 70.28 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.278 0.631 . . . . 0.0 112.686 -176.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -67.17 -44.74 78.96 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.589 0.756 . . . . 0.0 110.373 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.567 HD23 ' HE1' ' A' ' 85' ' ' TRP . 63.8 mt -58.99 -46.86 87.09 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.814 0.816 . . . . 0.0 110.114 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.408 HE22 ' HB ' ' A' ' 122' ' ' VAL . 11.1 mt-30 -74.98 -29.96 61.05 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 114.131 -1.395 . . . . 0.0 112.828 -176.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.91 -19.31 60.34 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.341 170.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -123.33 6.49 9.05 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.788 0.835 . . . . 0.0 112.489 178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -127.72 -88.46 0.55 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.374 0.669 . . . . 0.0 111.296 177.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -161.06 159.69 24.64 Favored Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 123.88 0.872 . . . . 0.0 110.808 179.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -60.26 150.83 77.75 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 123.037 2.491 . . . . 0.0 114.202 174.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.408 ' HB ' HE22 ' A' ' 116' ' ' GLN . 7.7 p -71.95 122.75 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 122.991 0.517 . . . . 0.0 110.277 173.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tt -79.57 71.55 6.18 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-O 122.12 0.962 . . . . 0.0 109.025 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -142.13 113.0 7.39 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.906 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 -169.8 20.28 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 124.217 1.007 . . . . 0.0 110.1 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 53.4 p-80 -76.28 79.47 3.05 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.427 1.108 . . . . 0.0 111.781 -171.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 56.5 m80 -140.21 104.16 4.75 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.51 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -126.56 85.38 2.38 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.759 0.824 . . . . 0.0 109.147 172.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -155.89 130.62 9.11 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.228 0.611 . . . . 0.0 110.228 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 . . . . . 0 CA--C 1.561 1.381 0 C-N-CA 123.491 0.717 . . . . 0.0 109.433 172.881 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.8 mtp . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 120.425 0.155 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -167.18 95.33 0.12 Allowed Glycine 0 C--N 1.349 1.256 0 CA-C-N 116.673 -0.239 . . . . 0.0 112.811 -178.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -119.66 114.63 22.49 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.515 0.726 . . . . 0.0 110.252 178.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.37 -145.15 8.54 Favored Glycine 0 N--CA 1.476 1.312 0 N-CA-C 111.905 -0.478 . . . . 0.0 111.905 168.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -130.59 118.3 20.82 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.394 0.678 . . . . 0.0 110.123 173.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -146.47 94.22 2.41 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-O 122.327 1.06 . . . . 0.0 110.229 -168.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.508 HG23 ' HG ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -157.31 -53.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.117 1.367 . . . . 0.0 109.501 -176.449 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 7' ' ' VAL . 82.2 mt -97.6 -28.87 13.74 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 114.745 -1.116 . . . . 0.0 112.629 -168.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 77.55 90.33 0.31 Allowed Glycine 0 C--N 1.349 1.256 0 N-CA-C 112.339 -0.304 . . . . 0.0 112.339 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -137.0 161.14 36.88 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.068 0.947 . . . . 0.0 109.609 -176.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.2 t70 62.14 31.14 17.84 Favored 'General case' 0 CA--C 1.568 1.648 0 C-N-CA 124.385 1.074 . . . . 0.0 110.528 -173.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.9 tt -87.79 131.54 34.48 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.218 1.007 . . . . 0.0 110.052 -174.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -108.93 154.98 21.38 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.632 0.773 . . . . 0.0 110.954 177.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 14.6 p -156.42 139.59 7.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 123.376 0.67 . . . . 0.0 110.996 173.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.8 m -93.84 -75.43 0.5 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.399 0.68 . . . . 0.0 110.163 175.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.0 t 50.66 101.33 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 125.228 1.411 . . . . 0.0 114.5 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.5 m 70.75 -3.25 2.01 Favored 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 124.854 1.261 . . . . 0.0 113.78 173.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.87 158.06 87.78 Favored Pre-proline 0 CA--C 1.562 1.432 0 C-N-CA 123.939 0.896 . . . . 0.0 111.562 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -60.91 121.43 9.67 Favored 'Trans proline' 0 C--N 1.375 1.958 0 C-N-CA 122.058 1.839 . . . . 0.0 111.882 171.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.414 ' HG2' ' HB2' ' A' ' 23' ' ' TRP . 42.6 ttm 68.29 43.14 1.55 Allowed 'General case' 0 CA--C 1.564 1.519 0 C-N-CA 125.324 1.449 . . . . 0.0 111.412 -177.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.3 m -63.22 106.91 0.95 Allowed 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.161 170.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 138.14 -22.05 3.11 Favored Glycine 0 N--CA 1.474 1.232 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.735 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.414 ' HB2' ' HG2' ' A' ' 20' ' ' MET . 81.6 t90 -58.13 -45.68 86.9 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.3 0.64 . . . . 0.0 111.419 177.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -69.71 -28.27 65.68 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.35 0.66 . . . . 0.0 112.08 175.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.42 ' NH1' ' HA ' ' A' ' 33' ' ' VAL . 28.0 ttp85 70.41 -68.5 0.2 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.419 1.488 . . . . 0.0 112.747 177.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -44.23 -48.48 9.37 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 125.389 1.475 . . . . 0.0 114.029 -175.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.21 22.73 5.86 Favored Glycine 0 CA--C 1.542 1.758 0 N-CA-C 115.976 1.15 . . . . 0.0 115.976 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -162.56 -67.32 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 117.949 0.875 . . . . 0.0 109.885 175.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.9 t -82.64 65.23 7.66 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.201 1.0 . . . . 0.0 110.297 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.4 ' H ' ' HG2' ' A' ' 30' ' ' GLN . 2.0 pt20 -87.83 58.53 4.91 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-O 122.708 1.242 . . . . 0.0 110.497 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.1 t -94.13 36.43 1.13 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 125.758 1.623 . . . . 0.0 110.309 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 62.72 -79.34 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 124.971 1.308 . . . . 0.0 110.532 -165.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.42 ' HA ' ' NH1' ' A' ' 25' ' ' ARG . 86.9 t -131.38 -50.2 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 124.117 0.967 . . . . 0.0 108.719 168.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -156.7 -48.96 0.07 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 124.112 0.965 . . . . 0.0 110.937 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.445 ' HB3' ' HB2' ' A' ' 39' ' ' HIS . 34.2 t70 50.27 79.88 0.08 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 125.492 1.517 . . . . 0.0 112.67 -175.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.0 mtm180 69.27 -8.89 0.66 Allowed 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 125.328 1.451 . . . . 0.0 113.622 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 147.68 -48.47 0.64 Allowed Glycine 0 C--N 1.348 1.21 0 N-CA-C 112.034 -0.426 . . . . 0.0 112.034 -175.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 t -160.24 142.28 12.9 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.093 0.557 . . . . 0.0 111.628 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.445 ' HB2' ' HB3' ' A' ' 35' ' ' ASP . 8.9 t-160 -155.14 42.98 0.46 Allowed 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.335 1.054 . . . . 0.0 109.179 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 56.4 p -93.86 102.35 14.46 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.229 -172.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.422 HG11 ' N ' ' A' ' 82' ' ' ALA . 28.6 t -123.8 103.47 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.434 0.694 . . . . 0.0 110.126 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 80.8 m -113.78 108.17 16.72 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 173.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -142.28 152.55 43.12 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.084 0.953 . . . . 0.0 109.384 -167.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.463 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 27.0 tt0 -122.74 126.8 48.21 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.548 ' HB2' HD11 ' A' ' 50' ' ' LEU . 18.7 mtm -119.89 136.67 54.41 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.617 0.767 . . . . 0.0 109.509 173.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 6.2 t -98.68 160.73 14.07 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 123.005 0.522 . . . . 0.0 111.764 -172.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -53.13 -35.38 59.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.345 1.058 . . . . 0.0 113.051 -171.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -55.17 -46.68 75.78 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 122.266 1.031 . . . . 0.0 110.529 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -79.6 -35.82 38.99 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.949 -177.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.548 HD11 ' HB2' ' A' ' 45' ' ' MET . 10.5 mp -68.57 -36.89 79.36 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 117.709 0.231 . . . . 0.0 111.589 178.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.9 mt -64.02 -31.7 72.99 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.312 0.645 . . . . 0.0 111.579 177.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.542 ' HE2' ' HB1' ' A' ' 91' ' ' ALA . 87.2 t80 -61.71 -46.77 88.26 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.621 0.368 . . . . 0.0 110.871 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 45.2 m -62.34 -49.14 76.77 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.298 0.639 . . . . 0.0 112.386 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -76.52 -56.76 4.33 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -178.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -77.05 -7.31 55.47 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -171.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.87 17.68 3.85 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 118.202 0.455 . . . . 0.0 111.891 177.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -159.52 -104.23 0.2 Allowed Glycine 0 C--N 1.353 1.475 0 O-C-N 122.055 -0.403 . . . . 0.0 113.607 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -129.27 162.98 26.66 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.259 1.024 . . . . 0.0 111.553 -175.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -63.54 134.65 55.92 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.446 0.698 . . . . 0.0 111.717 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.6 tp -143.04 -44.04 0.3 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.441 0.696 . . . . 0.0 110.791 -176.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 39.9 ttm -95.11 80.26 3.6 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.218 0.607 . . . . 0.0 109.803 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 41.3 p -135.28 140.69 35.25 Favored Pre-proline 0 N--CA 1.491 1.602 0 C-N-CA 123.676 0.79 . . . . 0.0 111.298 -177.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -55.5 -47.38 25.99 Favored 'Trans proline' 0 C--N 1.388 2.633 0 C-N-CA 123.452 2.768 . . . . 0.0 113.908 174.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 65.2 mtt85 64.58 80.91 0.23 Allowed Pre-proline 0 N--CA 1.492 1.626 0 C-N-CA 124.872 1.269 . . . . 0.0 112.115 -177.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.78 -12.92 24.39 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.768 2.312 . . . . 0.0 113.001 -178.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -73.8 -27.96 61.4 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.891 0.876 . . . . 0.0 111.529 177.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -139.73 105.68 5.19 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.206 1.003 . . . . 0.0 109.599 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -79.8 43.64 0.6 Allowed 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.297 1.039 . . . . 0.0 112.802 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.489 ' HB2' ' HD3' ' A' ' 70' ' ' PRO . 59.7 m-85 -132.07 -56.09 0.03 OUTLIER Pre-proline 0 CA--C 1.574 1.886 0 C-N-CA 123.541 0.736 . . . . 0.0 111.582 -177.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.489 ' HD3' ' HB2' ' A' ' 69' ' ' PHE . 94.5 Cg_endo -89.49 114.63 0.62 Allowed 'Trans proline' 0 C--N 1.395 3.019 0 C-N-CA 121.92 1.747 . . . . 0.0 113.243 178.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -128.32 -86.45 0.51 Allowed Glycine 0 C--N 1.346 1.133 0 N-CA-C 111.854 -0.498 . . . . 0.0 111.854 177.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 64.26 147.68 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 125.492 1.517 . . . . 0.0 113.038 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -124.88 177.61 5.93 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.634 0.774 . . . . 0.0 110.174 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -82.89 105.84 14.22 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.113 0.565 . . . . 0.0 112.362 -173.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.59 38.71 4.9 Favored Glycine 0 N--CA 1.475 1.251 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.998 -177.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -122.73 107.59 12.09 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.385 1.074 . . . . 0.0 110.681 -176.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.463 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 16.4 ptt-85 -84.06 89.98 7.37 Favored 'General case' 0 CA--C 1.555 1.172 0 CA-C-O 122.027 0.918 . . . . 0.0 111.559 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -138.16 -163.77 1.51 Allowed 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 125.251 1.421 . . . . 0.0 108.844 175.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 26.0 p -55.9 81.09 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 122.167 0.984 . . . . 0.0 111.246 169.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -85.28 -25.84 26.99 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.919 1.288 . . . . 0.0 110.118 -175.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 52.4 t 68.02 123.36 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.041 1.336 . . . . 0.0 111.148 -173.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.422 ' N ' HG11 ' A' ' 41' ' ' VAL . . . -55.69 -24.47 34.52 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.79 0.836 . . . . 0.0 112.658 -177.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.4 t -54.12 -47.08 72.21 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.985 0.914 . . . . 0.0 112.693 173.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -41.55 85.42 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 123.531 0.732 . . . . 0.0 112.536 -178.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.47 ' NE1' HG21 ' A' ' 110' ' ' VAL . 9.8 t-105 -71.35 -43.69 66.49 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 124.043 0.937 . . . . 0.0 110.535 -177.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -65.77 -37.66 86.92 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.936 0.895 . . . . 0.0 111.633 175.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.72 -44.16 97.46 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.54 0.736 . . . . 0.0 111.06 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.51 -30.1 71.13 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.46 0.704 . . . . 0.0 111.461 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.481 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 86.8 t80 -68.77 -46.4 68.87 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 123.01 0.524 . . . . 0.0 111.299 174.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -71.79 -16.6 62.19 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.459 0.704 . . . . 0.0 112.242 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.542 ' HB1' ' HE2' ' A' ' 52' ' ' PHE . . . -75.21 -2.7 29.14 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 123.7 0.8 . . . . 0.0 111.589 168.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 84.61 15.65 67.83 Favored Glycine 0 C--N 1.355 1.623 0 C-N-CA 123.63 0.634 . . . . 0.0 113.72 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.2 mmm -118.81 -79.04 0.59 Allowed 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.142 0.577 . . . . 0.0 112.057 -171.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.481 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 63.99 102.26 0.04 OUTLIER Pre-proline 0 N--CA 1.493 1.683 0 C-N-CA 125.0 1.32 . . . . 0.0 113.8 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.404 ' HG3' ' HB3' ' A' ' 45' ' ' MET . 59.6 Cg_endo -67.94 168.98 17.32 Favored 'Trans proline' 0 N--CA 1.504 2.131 0 C-N-CA 123.84 3.027 . . . . 0.0 114.954 177.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.99 109.69 1.77 Allowed 'Trans proline' 0 C--N 1.379 2.177 0 C-N-CA 122.658 2.239 . . . . 0.0 112.197 168.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.7 p -95.2 152.31 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.222 0.609 . . . . 0.0 110.592 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.5 p -90.75 105.42 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.422 0 CA-C-O 121.734 0.778 . . . . 0.0 110.937 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.519 HD21 ' HA ' ' A' ' 116' ' ' GLN . 5.8 mp -69.32 -40.54 77.55 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.737 1.215 . . . . 0.0 112.262 -171.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -68.62 -27.54 66.11 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.367 0.667 . . . . 0.0 111.86 -176.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 30.6 t -84.09 -29.64 26.63 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.198 0.599 . . . . 0.0 110.685 174.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 90.6 m -74.63 101.49 4.26 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.17 0.588 . . . . 0.0 110.414 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -67.97 156.6 36.92 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.56 0.744 . . . . 0.0 111.126 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.606 ' HA ' HD13 ' A' ' 107' ' ' LEU . 0.6 OUTLIER -63.12 -14.32 47.18 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.092 0.957 . . . . 0.0 113.129 -174.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 40.4 t -57.16 -39.22 74.83 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.226 0.61 . . . . 0.0 111.814 171.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.43 -22.37 61.11 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.916 0.886 . . . . 0.0 112.877 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.606 HD13 ' HA ' ' A' ' 104' ' ' LYS . 7.2 mp -63.97 -22.4 66.91 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 123.93 0.892 . . . . 0.0 112.199 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -78.55 -15.08 58.98 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.251 0.62 . . . . 0.0 111.268 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -110.97 -17.06 13.38 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.621 1.168 . . . . 0.0 113.334 -175.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.47 HG21 ' NE1' ' A' ' 85' ' ' TRP . 7.4 p -144.52 -23.76 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.0 t 80.34 139.74 0.07 Allowed 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 125.461 1.504 . . . . 0.0 112.851 -176.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.82 -38.19 87.26 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.535 1.134 . . . . 0.0 112.298 173.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.87 -32.43 69.46 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.153 0.581 . . . . 0.0 112.303 -175.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.78 -39.34 76.68 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.894 174.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.425 ' HB3' ' HG ' ' A' ' 99' ' ' LEU . 64.5 mt -69.16 -45.39 70.17 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.586 0.754 . . . . 0.0 110.298 -172.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.519 ' HA ' HD21 ' A' ' 99' ' ' LEU . 61.1 mm-40 -62.64 -43.74 98.04 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.621 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -61.46 -29.83 70.21 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 115.264 -0.88 . . . . 0.0 113.216 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -91.67 -17.37 25.59 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.32 -65.87 0.96 Allowed 'General case' 0 N--CA 1.485 1.304 0 CA-C-O 121.253 0.549 . . . . 0.0 111.002 168.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 4.1 pp -113.59 152.24 45.24 Favored Pre-proline 0 CA--C 1.559 1.296 0 C-N-CA 124.569 1.148 . . . . 0.0 111.04 -178.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 120' ' ' LEU . 16.0 Cg_exo -68.38 96.53 0.48 Allowed 'Trans proline' 0 C--N 1.371 1.753 0 C-N-CA 122.593 2.196 . . . . 0.0 113.125 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.3 p -133.86 132.08 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.248 0.619 . . . . 0.0 110.078 170.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.2 tt -109.81 126.49 53.85 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.608 0.763 . . . . 0.0 110.026 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -145.72 12.54 1.3 Allowed 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.738 0.815 . . . . 0.0 110.295 172.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 63.73 105.87 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 125.422 1.489 . . . . 0.0 111.769 -176.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -66.8 131.56 46.18 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.285 0.634 . . . . 0.0 111.614 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -169.2 -31.39 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.378 0.671 . . . . 0.0 110.439 175.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -69.59 107.86 3.59 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.573 0.749 . . . . 0.0 110.932 172.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 38.3 m-70 -136.82 -44.53 0.58 Allowed 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 122.953 0.501 . . . . 0.0 112.195 -177.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 72.8 m80 . . . . . 0 N--CA 1.496 1.871 0 C-N-CA 124.528 1.131 . . . . 0.0 111.081 -164.691 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 mtt . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.448 0.166 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -72.98 -55.19 6.51 Favored Glycine 0 C--N 1.351 1.363 0 CA-C-N 116.103 -0.499 . . . . 0.0 114.009 -176.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -92.76 132.47 36.93 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.005 0.431 . . . . 0.0 110.952 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -163.43 159.88 32.51 Favored Glycine 0 CA--C 1.532 1.111 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.527 173.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -114.62 121.75 44.38 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 117.667 0.733 . . . . 0.0 109.98 173.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.407 ' ND2' ' HB2' ' A' ' 76' ' ' ASP . 14.9 m120 -65.59 157.15 30.58 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.789 0.836 . . . . 0.0 111.96 -175.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 5.1 m -66.53 -23.76 31.97 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-O 121.682 0.753 . . . . 0.0 109.933 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.2 mt -67.56 -34.52 77.23 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 114.167 -1.379 . . . . 0.0 110.494 177.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -88.98 -103.77 1.03 Allowed Glycine 0 C--N 1.35 1.325 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.329 169.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -167.24 137.36 2.93 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.755 0.822 . . . . 0.0 111.411 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -158.51 156.78 30.87 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.161 0.584 . . . . 0.0 110.894 175.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.39 -32.17 72.05 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.447 0.699 . . . . 0.0 110.375 177.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 62.11 26.88 16.19 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.002 1.321 . . . . 0.0 112.64 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.449 HG23 ' HA3' ' A' ' 27' ' ' GLY . 14.4 p -96.87 138.41 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.454 0.702 . . . . 0.0 111.515 -174.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 40.9 t -78.85 -36.05 42.95 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.303 0.641 . . . . 0.0 110.503 172.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.2 t -75.26 88.05 2.51 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.991 176.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 25.1 p -117.88 -55.29 2.28 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.544 0.738 . . . . 0.0 110.146 177.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.48 -45.87 0.2 Allowed Pre-proline 0 CA--C 1.568 1.668 0 C-N-CA 124.031 0.932 . . . . 0.0 112.053 172.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -81.85 162.15 18.59 Favored 'Trans proline' 0 C--N 1.396 3.066 0 C-N-CA 121.768 1.645 . . . . 0.0 113.401 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.0 mmt -67.07 -37.54 84.2 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.241 0.617 . . . . 0.0 111.324 176.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.3 m 61.18 81.32 0.19 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.756 1.222 . . . . 0.0 111.269 176.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.77 -130.19 14.3 Favored Glycine 0 CA--C 1.536 1.35 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.856 -169.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 93.4 m95 -130.93 -64.31 0.83 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.639 0.775 . . . . 0.0 109.842 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -153.82 111.86 3.56 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 122.928 0.491 . . . . 0.0 110.594 -177.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -136.89 -60.1 0.7 Allowed 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.537 1.135 . . . . 0.0 109.09 173.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.416 HD22 ' HE1' ' A' ' 28' ' ' PHE . 46.3 t30 -168.58 -49.35 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.762 1.225 . . . . 0.0 108.636 -178.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.449 ' HA3' HG23 ' A' ' 14' ' ' VAL . . . 161.69 23.58 0.02 OUTLIER Glycine 0 CA--C 1.531 1.058 0 CA-C-N 115.108 -0.951 . . . . 0.0 112.958 176.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.416 ' HE1' HD22 ' A' ' 26' ' ' ASN . 53.6 p90 -152.34 156.41 39.55 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 121.416 0.627 . . . . 0.0 111.641 -177.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 28.4 p -143.22 160.28 40.75 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.811 171.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -76.26 -75.22 0.2 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.972 0.509 . . . . 0.0 111.078 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 t -164.01 -177.48 5.07 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.946 0.498 . . . . 0.0 111.477 -179.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -77.83 150.09 34.27 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.579 0.752 . . . . 0.0 110.236 172.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 14.9 p -61.8 -29.28 45.95 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 C-N-CA 123.13 0.572 . . . . 0.0 111.96 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -74.77 -28.3 60.7 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.863 0.865 . . . . 0.0 112.03 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.69 94.02 5.64 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.525 0.679 . . . . 0.0 111.238 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.0 mmm180 -88.59 83.89 6.76 Favored 'General case' 0 CA--C 1.554 1.11 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.313 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.99 87.38 0.77 Allowed Glycine 0 CA--C 1.539 1.593 0 CA-C-N 115.845 -0.616 . . . . 0.0 113.293 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.6 t -89.44 -157.41 0.45 Allowed 'General case' 0 CA--C 1.568 1.638 0 C-N-CA 123.708 0.803 . . . . 0.0 110.601 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -111.59 24.82 12.31 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.307 -0.871 . . . . 0.0 111.039 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.0 p -95.05 110.19 22.14 Favored 'General case' 0 CA--C 1.563 1.447 0 O-C-N 121.578 -0.702 . . . . 0.0 112.16 -170.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.1 t -131.53 137.08 56.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.282 0.633 . . . . 0.0 110.261 174.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 74.7 m -131.03 111.24 11.84 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.775 0.83 . . . . 0.0 110.051 174.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.549 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -141.28 151.92 44.06 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.826 0.851 . . . . 0.0 109.54 -172.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.619 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 23.8 tt0 -119.86 108.35 14.26 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 122.245 -0.284 . . . . 0.0 111.642 -176.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.553 ' SD ' ' HG3' ' A' ' 84' ' ' ARG . 56.2 mtp -93.38 130.02 39.32 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.053 0.541 . . . . 0.0 110.228 170.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.8 p -83.3 167.71 17.35 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.568 0.747 . . . . 0.0 109.578 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -62.75 -37.01 84.9 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 118.403 0.547 . . . . 0.0 110.842 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -54.31 -55.53 27.49 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 124.018 0.927 . . . . 0.0 111.544 176.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -78.13 -29.98 49.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.465 -0.789 . . . . 0.0 112.796 -176.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.11 -38.87 60.98 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.471 0.708 . . . . 0.0 110.237 -177.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 28.1 mt -62.91 -47.68 82.21 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.634 0.774 . . . . 0.0 110.778 169.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -65.01 -42.05 94.79 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -174.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.6 t -56.43 -39.41 73.03 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 123.263 0.625 . . . . 0.0 110.773 177.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 49.7 mtp85 -78.56 -34.49 47.0 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.4 173.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -61.72 -20.15 63.19 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 123.96 0.904 . . . . 0.0 111.96 -166.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -82.86 90.9 7.0 Favored 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 167.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.96 -62.12 2.23 Favored Glycine 0 CA--C 1.543 1.799 0 N-CA-C 114.367 0.507 . . . . 0.0 114.367 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -95.89 35.89 1.35 Allowed 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 123.997 0.919 . . . . 0.0 111.873 -170.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -48.21 -39.09 20.0 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -168.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -59.71 95.49 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.507 0 CA-C-O 121.76 0.791 . . . . 0.0 110.913 174.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 24.4 ttt -59.79 -60.16 4.28 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 124.756 1.222 . . . . 0.0 111.709 -175.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.1 m -112.28 95.16 29.6 Favored Pre-proline 0 CA--C 1.555 1.155 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 174.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -62.88 -40.75 33.44 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 122.879 2.386 . . . . 0.0 113.158 -173.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 85.9 mtt180 -90.57 158.01 43.48 Favored Pre-proline 0 CA--C 1.556 1.207 0 C-N-CA 124.156 0.982 . . . . 0.0 111.153 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -66.88 -13.55 40.37 Favored 'Trans proline' 0 C--N 1.383 2.352 0 C-N-CA 122.29 1.994 . . . . 0.0 112.831 170.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.49 ' HB3' HD22 ' A' ' 68' ' ' ASN . 11.6 mp0 -77.06 157.52 31.06 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.776 0.83 . . . . 0.0 111.323 174.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -81.56 2.12 30.62 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.831 0.852 . . . . 0.0 112.85 -177.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.49 HD22 ' HB3' ' A' ' 66' ' ' GLU . 35.6 m-80 -81.85 95.17 7.23 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.305 0.642 . . . . 0.0 111.454 -175.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -134.95 146.65 59.53 Favored Pre-proline 0 N--CA 1.489 1.496 0 C-N-CA 123.617 0.767 . . . . 0.0 110.08 173.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.2 96.63 1.04 Allowed 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 122.095 1.863 . . . . 0.0 112.546 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 158.43 -175.49 35.54 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-N 116.156 -0.474 . . . . 0.0 112.842 178.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.498 HD23 HD23 ' A' ' 80' ' ' LEU . 4.2 mm? -97.0 178.12 5.38 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-O 121.665 0.745 . . . . 0.0 112.023 178.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.432 ' HD3' ' N ' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -99.52 22.92 10.09 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.139 -165.642 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 65.88 117.25 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 125.366 1.466 . . . . 0.0 113.022 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 67.57 40.9 90.68 Favored Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.627 -0.589 . . . . 0.0 111.627 -168.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.407 ' HB2' ' ND2' ' A' ' 6' ' ' ASN . 10.8 t70 -138.27 97.42 3.38 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 124.152 0.981 . . . . 0.0 109.013 -174.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.619 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 39.0 ptt85 -89.14 85.33 6.63 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 121.709 0.766 . . . . 0.0 112.716 -174.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 -159.26 120.42 3.27 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.474 0.71 . . . . 0.0 110.122 -173.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.0 t 62.47 9.83 3.63 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 170.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.549 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -67.6 110.63 3.78 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 44.1 t -61.44 132.41 53.34 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.372 0.669 . . . . 0.0 111.199 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.42 -22.81 62.0 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.6 m -58.27 -41.58 84.64 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 118.362 0.528 . . . . 0.0 112.04 172.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.553 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 6.9 tpm_? -69.2 -41.49 77.04 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.334 1.054 . . . . 0.0 111.841 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.463 ' NE1' HG11 ' A' ' 110' ' ' VAL . 0.5 OUTLIER -74.25 -54.6 7.38 Favored 'General case' 0 CA--C 1.563 1.457 0 C-N-CA 123.6 0.76 . . . . 0.0 110.841 179.571 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.492 ' HB2' HG12 ' A' ' 110' ' ' VAL . 32.4 tp60 -49.95 -40.68 44.54 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 177.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -61.79 -41.1 97.3 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 120.68 0.276 . . . . 0.0 111.049 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.03 -30.5 70.6 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.927 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.69 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 54.0 t80 -67.03 -43.45 82.74 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.75 0.82 . . . . 0.0 110.782 171.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -69.4 -31.59 70.06 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.167 0.587 . . . . 0.0 112.466 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -78.96 -11.51 60.01 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.654 0.782 . . . . 0.0 111.577 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 107.1 -16.79 38.62 Favored Glycine 0 C--N 1.352 1.439 0 N-CA-C 114.934 0.734 . . . . 0.0 114.934 170.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -73.97 -70.43 0.39 Allowed 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 117.918 0.859 . . . . 0.0 111.021 -177.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.69 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 60.52 97.98 0.04 OUTLIER Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 124.745 1.218 . . . . 0.0 113.291 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.445 ' HB2' ' O ' ' A' ' 44' ' ' GLU . 94.5 Cg_endo -71.28 168.97 21.89 Favored 'Trans proline' 0 CA--C 1.568 2.182 0 C-N-CA 123.391 2.727 . . . . 0.0 113.563 175.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -66.46 118.64 5.69 Favored 'Trans proline' 0 C--N 1.381 2.276 0 C-N-CA 122.421 2.081 . . . . 0.0 112.784 176.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.602 HG13 ' HB2' ' A' ' 119' ' ' ALA . 7.7 p -105.97 158.27 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 123.497 0.719 . . . . 0.0 109.323 173.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.534 HG11 ' HD2' ' A' ' 77' ' ' ARG . 3.4 p -115.65 108.24 24.76 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 O-C-N 121.675 -0.641 . . . . 0.0 112.508 -170.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.442 ' HG ' ' HB1' ' A' ' 119' ' ' ALA . 97.0 mt -69.07 -28.91 66.95 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -83.67 40.0 0.71 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.607 0.763 . . . . 0.0 111.748 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.45 ' HB3' HG13 ' A' ' 98' ' ' VAL . 22.4 t -170.12 -24.67 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 124.521 1.129 . . . . 0.0 110.852 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.401 ' OG1' ' HA ' ' A' ' 99' ' ' LEU . 33.6 p -74.77 -176.84 3.0 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.729 0.776 . . . . 0.0 112.186 172.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -148.76 171.85 15.56 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.03 -177.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.525 ' HA ' HD13 ' A' ' 107' ' ' LEU . 0.5 OUTLIER -62.74 -17.72 61.38 Favored 'General case' 0 CA--C 1.564 1.512 0 C-N-CA 124.256 1.022 . . . . 0.0 110.98 167.888 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.2 m -57.56 -36.18 71.33 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.495 1.118 . . . . 0.0 112.255 169.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.456 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -63.49 -36.36 83.51 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.948 0.499 . . . . 0.0 111.236 176.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.5 mp -68.05 5.75 0.86 Allowed 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 124.906 1.282 . . . . 0.0 113.584 -178.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -86.86 -23.72 25.16 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.526 0.73 . . . . 0.0 110.182 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -107.71 -50.92 2.98 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.717 1.207 . . . . 0.0 108.758 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.492 HG12 ' HB2' ' A' ' 86' ' ' GLN . 33.8 m -97.06 -172.67 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 CA-C-O 122.289 1.042 . . . . 0.0 111.919 176.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.1 t -113.97 158.52 21.04 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.347 158.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.509 ' HA ' HD12 ' A' ' 115' ' ' LEU . 2.5 tt -55.95 -34.98 66.16 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 122.518 0.327 . . . . 0.0 110.761 170.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.35 73.72 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.185 0.594 . . . . 0.0 112.308 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -73.09 -33.91 65.88 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 120.841 0.353 . . . . 0.0 110.183 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 112' ' ' LEU . 87.7 mt -68.35 -56.88 6.99 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 123.73 0.812 . . . . 0.0 110.634 178.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.429 ' HG2' HD11 ' A' ' 99' ' ' LEU . 7.1 mt-30 -64.62 -30.94 71.96 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.418 1.087 . . . . 0.0 112.315 -170.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -52.3 -30.42 28.1 Favored 'General case' 0 CA--C 1.563 1.443 0 C-N-CA 123.89 0.876 . . . . 0.0 112.87 171.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -135.72 27.7 3.31 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 123.886 0.874 . . . . 0.0 112.488 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.602 ' HB2' HG13 ' A' ' 97' ' ' VAL . . . -127.57 168.6 14.75 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -177.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -109.96 121.02 43.09 Favored Pre-proline 0 CA--C 1.561 1.394 0 CA-C-N 114.801 -1.09 . . . . 0.0 108.659 174.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -57.19 162.98 8.65 Favored 'Trans proline' 0 N--CA 1.506 2.242 0 C-N-CA 124.14 3.227 . . . . 0.0 116.243 -177.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.6 p -103.65 140.84 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.897 0.879 . . . . 0.0 111.167 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.71 72.6 8.76 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 121.992 0.901 . . . . 0.0 110.08 173.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -150.84 13.38 0.71 Allowed 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.791 1.236 . . . . 0.0 109.683 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -78.34 90.55 4.39 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.958 0.903 . . . . 0.0 111.431 -171.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -155.31 136.65 14.03 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.891 0.876 . . . . 0.0 110.572 174.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -89.25 157.2 18.32 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.147 0.579 . . . . 0.0 109.569 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -63.19 -39.03 93.47 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -172.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 66.65 179.63 0.21 Allowed 'General case' 0 N--CA 1.498 1.959 0 C-N-CA 124.289 1.035 . . . . 0.0 112.449 -173.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 40.0 t-80 . . . . . 0 N--CA 1.485 1.305 0 C-N-CA 123.223 0.609 . . . . 0.0 110.122 176.722 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 120.584 0.23 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.67 154.5 10.34 Favored Glycine 0 C--N 1.348 1.217 0 CA-C-N 116.649 -0.25 . . . . 0.0 112.964 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -170.74 149.59 3.14 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.504 0.722 . . . . 0.0 110.54 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.06 -139.79 9.53 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.095 0.378 . . . . 0.0 113.739 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -88.31 137.27 32.47 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.53 0.732 . . . . 0.0 110.344 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -124.68 177.26 6.06 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.705 0.802 . . . . 0.0 111.649 -174.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -82.99 -16.66 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.968 169.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 52.6 mt -72.35 -13.29 61.44 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.982 1.713 . . . . 0.0 113.857 -167.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.37 65.46 2.02 Favored Glycine 0 CA--C 1.539 1.559 0 C-N-CA 123.464 0.554 . . . . 0.0 112.77 176.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -164.91 -40.4 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.597 1.559 . . . . 0.0 109.374 -173.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 65.9 -77.79 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 126.124 1.77 . . . . 0.0 111.102 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.8 mt 55.38 -76.24 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 125.906 1.683 . . . . 0.0 113.776 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -81.78 60.01 4.49 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 124.579 1.152 . . . . 0.0 111.86 -175.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.422 HG22 ' H ' ' A' ' 16' ' ' CYS . 7.6 p -79.45 149.05 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.256 0 C-N-CA 123.738 0.815 . . . . 0.0 110.202 175.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 28' ' ' PHE . 75.0 m -58.5 -37.28 75.25 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 123.072 0.549 . . . . 0.0 111.956 177.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.568 ' SG ' HD13 ' A' ' 112' ' ' LEU . 81.6 m -150.04 149.29 30.11 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.302 0.641 . . . . 0.0 111.641 -178.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 71.3 m -93.31 33.04 1.25 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 123.841 0.857 . . . . 0.0 111.113 175.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.401 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . . . -134.67 140.56 35.76 Favored Pre-proline 0 CA--C 1.561 1.367 0 C-N-CA 123.574 0.75 . . . . 0.0 111.15 -172.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 18' ' ' ALA . 52.4 Cg_exo -59.05 7.55 0.07 OUTLIER 'Trans proline' 0 N--CA 1.513 2.652 0 C-N-CA 124.602 3.535 . . . . 0.0 118.231 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -88.08 -33.54 18.25 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 119.284 0.947 . . . . 0.0 111.064 168.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 84.9 m -147.17 93.19 2.21 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.517 1.127 . . . . 0.0 109.123 175.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.405 ' HA2' HG21 ' A' ' 14' ' ' VAL . . . -166.73 117.94 0.77 Allowed Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 -178.456 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 25.5 m-90 65.92 12.59 8.5 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.279 1.031 . . . . 0.0 113.613 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -52.01 -39.48 59.54 Favored 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -173.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.439 ' HG3' ' OD1' ' A' ' 26' ' ' ASN . 17.9 tpt180 -130.13 -74.01 0.55 Allowed 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 124.303 1.041 . . . . 0.0 109.586 176.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.439 ' OD1' ' HG3' ' A' ' 25' ' ' ARG . 1.6 p-10 -148.36 93.35 2.14 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.602 0.715 . . . . 0.0 109.319 173.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 67.11 -104.23 1.07 Allowed Glycine 0 C--N 1.347 1.147 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.957 -170.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.509 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 54.8 p90 -81.47 167.6 19.19 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.435 0.694 . . . . 0.0 112.0 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.421 ' HB2' ' HG3' ' A' ' 104' ' ' LYS . 56.5 m -95.83 95.76 8.49 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.984 0.514 . . . . 0.0 110.252 177.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -73.4 95.65 2.24 Favored 'General case' 0 CA--C 1.555 1.165 0 CA-C-O 121.141 0.496 . . . . 0.0 110.446 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -73.83 -39.31 64.14 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.825 0.85 . . . . 0.0 112.288 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -116.01 119.03 34.57 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.519 0.728 . . . . 0.0 109.712 173.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 29.7 m -66.31 -22.05 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 176.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -91.71 -36.78 13.4 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.072 0.949 . . . . 0.0 111.132 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.0 t70 53.21 85.33 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.717 1.207 . . . . 0.0 111.847 -169.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -176.29 -39.57 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.717 0.807 . . . . 0.0 111.905 175.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.52 79.9 0.01 OUTLIER Glycine 0 C--N 1.361 1.945 0 N-CA-C 115.809 1.084 . . . . 0.0 115.809 -165.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.2 m 60.51 -2.49 0.17 Allowed 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 125.664 1.585 . . . . 0.0 114.163 -175.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 62.34 139.11 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 125.381 1.472 . . . . 0.0 112.389 -169.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 40.7 p -94.22 102.74 14.77 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-O 121.325 0.583 . . . . 0.0 111.231 -176.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.435 HG11 ' HB2' ' A' ' 82' ' ' ALA . 21.4 t -135.16 102.22 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 C-N-CA 123.974 0.91 . . . . 0.0 109.334 171.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 61.6 m -108.03 104.3 13.72 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 170.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.427 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.73 144.01 32.5 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.325 1.05 . . . . 0.0 109.778 -173.449 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.503 ' HG3' ' HB3' ' A' ' 77' ' ' ARG . 1.7 mp0 -102.63 107.5 18.43 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 122.165 -0.335 . . . . 0.0 110.611 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.596 ' SD ' HD21 ' A' ' 80' ' ' LEU . 63.8 mtp -91.06 137.75 32.13 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 169.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.7 p -82.77 159.51 22.49 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 121.339 0.59 . . . . 0.0 111.713 -174.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -60.85 -28.6 68.95 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.54 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -50.98 -54.4 24.78 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.975 0.91 . . . . 0.0 112.096 174.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -74.86 -36.43 62.33 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.46 -26.8 65.67 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 76.0 mt -78.59 -34.39 46.83 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.69 0.796 . . . . 0.0 110.877 168.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -62.31 -31.49 72.11 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 122.552 0.341 . . . . 0.0 110.631 170.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.3 m -75.7 -42.34 51.17 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.412 0.685 . . . . 0.0 110.757 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.441 ' HG3' ' HA ' ' A' ' 59' ' ' ASP . 43.5 ttt-85 -71.32 -61.11 1.89 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.207 1.003 . . . . 0.0 112.537 -175.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -79.97 -15.98 56.16 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -170.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -82.46 -37.29 25.61 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.999 -0.438 . . . . 0.0 110.912 173.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -81.63 -72.61 1.24 Allowed Glycine 0 CA--C 1.537 1.452 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.414 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -172.06 -60.23 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.856 1.262 . . . . 0.0 108.69 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.441 ' HA ' ' HG3' ' A' ' 54' ' ' ARG . 7.1 p-10 -146.31 178.7 8.05 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.338 172.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.4 tp -158.64 -55.48 0.07 Allowed 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 173.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 55.3 mtt -81.24 86.97 6.14 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-N 114.393 -1.276 . . . . 0.0 108.121 167.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 92.0 m -60.6 123.91 76.37 Favored Pre-proline 0 N--CA 1.485 1.3 0 C-N-CA 123.78 0.832 . . . . 0.0 111.92 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -66.96 87.43 0.3 Allowed 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 122.941 2.427 . . . . 0.0 112.449 177.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -88.55 138.89 29.78 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 123.952 0.901 . . . . 0.0 110.992 177.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -77.36 8.04 3.47 Favored 'Trans proline' 0 C--N 1.38 2.215 0 C-N-CA 122.741 2.294 . . . . 0.0 113.816 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -156.04 144.1 19.78 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.877 0.871 . . . . 0.0 108.688 175.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -103.6 87.18 2.77 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.765 0.826 . . . . 0.0 110.593 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -85.01 -56.64 3.46 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.426 0.69 . . . . 0.0 112.543 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -94.2 114.31 62.95 Favored Pre-proline 0 N--CA 1.486 1.353 0 C-N-CA 123.309 0.643 . . . . 0.0 111.329 -175.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -75.7 -71.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.379 2.151 0 C-N-CA 122.566 2.177 . . . . 0.0 111.859 170.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 53.24 -104.84 0.22 Allowed Glycine 0 C--N 1.36 1.899 0 C-N-CA 123.704 0.668 . . . . 0.0 114.342 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.46 ' HB2' ' HB3' ' A' ' 76' ' ' ASP . 2.7 pt? -150.63 139.72 21.1 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.073 0.549 . . . . 0.0 110.717 175.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.16 85.84 1.47 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.723 0.809 . . . . 0.0 109.406 169.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 70.53 129.38 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.253 1.421 . . . . 0.0 113.68 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 83.53 -7.82 67.44 Favored Glycine 0 CA--C 1.543 1.809 0 N-CA-C 114.973 0.749 . . . . 0.0 114.973 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.46 ' HB3' ' HB2' ' A' ' 72' ' ' LEU . 23.5 t70 -113.02 148.18 35.66 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.33 0.652 . . . . 0.0 111.073 -178.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.503 ' HB3' ' HG3' ' A' ' 44' ' ' GLU . 27.1 ptt180 -111.12 101.76 10.26 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.544 0.738 . . . . 0.0 111.282 -177.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -163.41 118.83 1.68 Allowed 'General case' 0 N--CA 1.483 1.203 0 O-C-N 121.712 -0.617 . . . . 0.0 111.599 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.6 t 51.61 27.96 4.36 Favored 'General case' 0 N--CA 1.5 2.033 0 C-N-CA 123.93 0.892 . . . . 0.0 112.391 174.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.596 HD21 ' SD ' ' A' ' 45' ' ' MET . 3.1 tm? -66.3 126.69 29.55 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.939 0.895 . . . . 0.0 110.56 -171.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.418 ' SG ' ' HB2' ' A' ' 83' ' ' SER . 43.4 t -64.16 101.3 0.4 Allowed 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 122.924 0.49 . . . . 0.0 110.863 177.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.435 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -56.86 -24.74 53.79 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.86 0.864 . . . . 0.0 113.018 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.418 ' HB2' ' SG ' ' A' ' 81' ' ' CYS . 54.4 m -61.61 -48.88 78.9 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.851 0.46 . . . . 0.0 111.296 171.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -59.35 -39.01 81.83 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 122.707 0.403 . . . . 0.0 112.061 179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.748 ' HE1' HD23 ' A' ' 115' ' ' LEU . 13.1 t-105 -66.63 -52.71 42.13 Favored 'General case' 0 CA--C 1.569 1.689 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.132 174.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.467 ' HB2' HG12 ' A' ' 110' ' ' VAL . 34.2 tp60 -49.54 -47.28 49.17 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 176.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.4 -35.44 77.52 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.576 0.75 . . . . 0.0 111.903 177.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.407 ' HB1' ' HA ' ' A' ' 94' ' ' ALA . . . -61.9 -39.12 90.9 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.097 0.559 . . . . 0.0 111.89 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.603 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 68.8 t80 -60.42 -51.73 68.24 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.164 0.507 . . . . 0.0 110.771 175.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -71.6 -19.49 62.12 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.476 -177.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.28 -11.45 46.44 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.692 0.797 . . . . 0.0 112.36 175.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.96 10.4 85.12 Favored Glycine 0 CA--C 1.542 1.757 0 N-CA-C 114.091 0.396 . . . . 0.0 114.091 -176.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 94.2 mmm -112.83 27.98 9.17 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.346 1.058 . . . . 0.0 110.725 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.603 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -67.76 117.45 48.15 Favored Pre-proline 0 CA--C 1.558 1.276 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 -178.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 94' ' ' ALA . 52.6 Cg_endo -67.05 174.81 6.35 Favored 'Trans proline' 0 CA--C 1.566 2.093 0 C-N-CA 123.074 2.516 . . . . 0.0 113.079 168.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.1 145.62 55.7 Favored 'Trans proline' 0 C--N 1.376 1.981 0 C-N-CA 121.522 1.481 . . . . 0.0 112.169 166.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.402 HG23 ' HB1' ' A' ' 43' ' ' ALA . 11.8 p -131.62 153.37 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.735 0.814 . . . . 0.0 108.99 174.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.532 HG21 ' HB3' ' A' ' 101' ' ' SER . 30.8 m -85.63 165.84 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-O 121.144 0.497 . . . . 0.0 111.302 173.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 86.4 mt -107.13 -26.06 11.28 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.609 0.764 . . . . 0.0 110.676 169.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -74.39 -60.33 2.32 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.503 0.721 . . . . 0.0 111.479 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.532 ' HB3' HG21 ' A' ' 98' ' ' VAL . 40.8 t -77.35 -25.33 50.94 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 179.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.492 ' H ' HG23 ' A' ' 98' ' ' VAL . 88.6 m -73.83 105.39 5.09 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 172.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -78.26 160.61 27.81 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.454 -175.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.535 ' HA ' HD13 ' A' ' 107' ' ' LEU . 27.9 mmtp -71.66 -12.85 61.54 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -169.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 16.6 t -61.94 -25.54 67.65 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 122.983 0.513 . . . . 0.0 111.369 170.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.446 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -57.02 -33.99 67.73 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.626 0.77 . . . . 0.0 112.888 172.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.535 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.4 mp -65.73 5.64 0.43 Allowed 'General case' 0 N--CA 1.503 2.224 0 C-N-CA 124.813 1.245 . . . . 0.0 113.588 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 46.2 mtp180 -94.57 -19.15 20.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.714 0.805 . . . . 0.0 110.28 175.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 34.7 m-85 -106.94 -51.4 2.93 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.099 1.359 . . . . 0.0 108.673 178.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.467 HG12 ' HB2' ' A' ' 86' ' ' GLN . 33.0 m -92.55 -170.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.017 170.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.3 t -120.27 163.46 17.76 Favored 'General case' 0 C--O 1.242 0.688 0 CA-C-N 114.638 -1.164 . . . . 0.0 108.103 155.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.568 HD13 ' SG ' ' A' ' 16' ' ' CYS . 2.7 tt -56.79 -31.87 65.1 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.571 0.349 . . . . 0.0 111.238 173.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.2 -41.44 79.36 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.702 0.801 . . . . 0.0 112.756 178.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -70.09 -33.54 72.01 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.192 0.597 . . . . 0.0 110.519 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.748 HD23 ' HE1' ' A' ' 85' ' ' TRP . 80.4 mt -67.69 -54.88 15.89 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.639 178.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -63.45 -37.07 85.89 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.341 1.056 . . . . 0.0 112.056 -175.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.78 -21.94 12.71 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -130.12 21.5 5.31 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.6 0.76 . . . . 0.0 111.681 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -128.3 170.95 12.46 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.837 0.855 . . . . 0.0 111.926 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.46 149.89 50.18 Favored Pre-proline 0 N--CA 1.487 1.388 0 C-N-CA 123.101 0.56 . . . . 0.0 110.627 172.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.58 97.98 0.74 Allowed 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 122.29 1.993 . . . . 0.0 111.593 174.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 8.7 p -75.57 134.6 28.86 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.261 0.624 . . . . 0.0 111.316 179.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 16.3 tp -90.5 115.06 27.36 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.127 0.571 . . . . 0.0 109.706 174.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -84.99 178.04 7.72 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 120.987 0.423 . . . . 0.0 110.94 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -95.68 38.3 1.17 Allowed 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -172.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 61.1 t60 60.94 -78.9 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 125.0 1.32 . . . . 0.0 112.306 174.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -150.08 64.87 0.97 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.228 1.011 . . . . 0.0 108.762 176.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 79.9 t60 51.99 46.08 27.2 Favored 'General case' 0 CA--C 1.569 1.695 0 C-N-CA 124.157 0.983 . . . . 0.0 111.089 -177.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 41.8 t60 65.14 97.98 0.04 OUTLIER 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 125.279 1.432 . . . . 0.0 111.789 -174.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 . . . . . 0 CA--C 1.56 1.362 0 C-N-CA 123.716 0.807 . . . . 0.0 110.003 173.046 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.1 mtp . . . . . 0 N--CA 1.494 1.741 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 122.55 133.95 4.34 Favored Glycine 0 N--CA 1.475 1.283 0 CA-C-O 119.836 -0.425 . . . . 0.0 113.188 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 60.88 89.92 0.07 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 125.064 1.345 . . . . 0.0 112.391 176.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.22 106.8 3.27 Favored Glycine 0 CA--C 1.535 1.315 0 N-CA-C 111.97 -0.452 . . . . 0.0 111.97 173.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -90.92 153.72 19.98 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.425 0.69 . . . . 0.0 109.947 177.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -130.4 132.87 45.97 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.935 0.494 . . . . 0.0 110.834 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.4 m -75.13 -17.09 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 124.203 1.001 . . . . 0.0 109.743 175.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 39.1 mt -78.08 -39.89 40.2 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.976 -176.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -88.08 62.44 3.87 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-N 115.402 -0.817 . . . . 0.0 113.777 -177.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -157.98 -48.72 0.06 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.759 0.824 . . . . 0.0 110.29 176.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -86.72 158.77 19.35 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.618 0.767 . . . . 0.0 110.736 175.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -74.15 136.3 42.89 Favored 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 172.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -96.94 -26.15 15.15 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.439 0.696 . . . . 0.0 110.971 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.585 HG23 HG21 ' A' ' 21' ' ' THR . 9.8 p -102.76 173.29 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.566 1.587 0 C-N-CA 124.375 1.07 . . . . 0.0 111.062 -172.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.506 ' H ' HG22 ' A' ' 14' ' ' VAL . 10.4 t -147.07 -73.62 0.21 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.914 -0.491 . . . . 0.0 112.084 -167.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.6 t 69.85 6.01 5.52 Favored 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 125.307 1.443 . . . . 0.0 113.797 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.7 m -62.68 -58.43 7.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.017 0.527 . . . . 0.0 111.857 -178.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -173.86 -55.51 0.0 OUTLIER Pre-proline 0 CA--C 1.568 1.648 0 C-N-CA 124.114 0.966 . . . . 0.0 111.819 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -84.59 -17.18 5.29 Favored 'Trans proline' 0 C--N 1.392 2.855 0 C-N-CA 122.126 1.884 . . . . 0.0 114.453 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 66.3 mtt -125.43 146.53 49.58 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.688 0.795 . . . . 0.0 111.377 -176.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.585 HG21 HG23 ' A' ' 14' ' ' VAL . 66.3 p 51.86 -89.88 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 126.232 1.813 . . . . 0.0 112.865 -173.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 58.12 -83.68 0.01 OUTLIER Glycine 0 CA--C 1.548 2.153 0 N-CA-C 116.052 1.181 . . . . 0.0 116.052 171.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 27.9 m-90 -51.89 -53.17 43.77 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 125.508 1.523 . . . . 0.0 113.03 -177.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -68.39 105.52 2.2 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -79.8 73.06 6.55 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-O 121.979 0.895 . . . . 0.0 110.343 -178.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.423 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 25.4 t-20 -169.59 151.75 4.47 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.528 -1.214 . . . . 0.0 108.715 -173.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.05 -53.29 3.93 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-N 116.54 -0.3 . . . . 0.0 112.925 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.507 ' N ' HG21 ' A' ' 14' ' ' VAL . 52.5 p90 -74.91 -5.69 45.1 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 122.915 0.486 . . . . 0.0 111.969 175.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.423 ' SG ' ' HA ' ' A' ' 26' ' ' ASN . 78.2 m -54.81 92.1 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.846 1.259 . . . . 0.0 112.477 -178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -69.82 88.47 0.55 Allowed 'General case' 0 CA--C 1.551 1.012 0 CA-C-O 121.771 0.796 . . . . 0.0 111.155 179.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.2 t -117.57 -18.24 9.78 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.54 1.136 . . . . 0.0 110.033 172.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -64.93 -39.54 93.66 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.347 1.059 . . . . 0.0 111.252 174.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.2 t 62.63 -80.63 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 C-N-CA 125.497 1.519 . . . . 0.0 112.3 176.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.24 -0.98 32.12 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.446 0.698 . . . . 0.0 111.671 -176.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.0 t70 61.84 -164.25 0.25 Allowed 'General case' 0 CA--C 1.572 1.79 0 C-N-CA 124.409 1.084 . . . . 0.0 110.748 178.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 71.34 -67.18 0.27 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 125.496 1.519 . . . . 0.0 112.253 174.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.38 14.28 29.7 Favored Glycine 0 CA--C 1.541 1.71 0 CA-C-O 119.582 -0.565 . . . . 0.0 114.182 173.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.4 m 66.13 -80.26 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 125.23 1.412 . . . . 0.0 112.223 176.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.6 m80 56.78 31.29 19.23 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 124.424 1.089 . . . . 0.0 112.611 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.519 ' HB ' ' HB3' ' A' ' 105' ' ' SER . 1.7 m -92.0 98.5 11.6 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -168.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.531 HG22 ' HA ' ' A' ' 106' ' ' ALA . 34.5 t -138.41 100.4 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.978 0 C-N-CA 124.662 1.185 . . . . 0.0 110.206 -174.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 62.8 m -101.14 103.63 14.7 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 166.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.429 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -134.55 147.48 50.29 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 -176.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.436 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 26.1 tt0 -120.29 109.55 15.52 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.213 0.53 . . . . 0.0 111.258 -169.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.588 ' HB2' HD11 ' A' ' 50' ' ' LEU . 73.6 mmm -93.94 150.93 19.93 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.22 1.008 . . . . 0.0 110.656 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 70.2 p -82.94 155.88 23.79 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 171.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.565 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 24.5 tt0 -58.98 -27.37 65.33 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.837 0.455 . . . . 0.0 112.015 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -49.06 -38.4 24.06 Favored 'General case' 0 CA--C 1.566 1.591 0 C-N-CA 123.923 0.889 . . . . 0.0 111.816 170.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -73.56 -53.03 11.5 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 172.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.0 mp -66.76 -25.51 66.53 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -170.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.565 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 92.1 mt -73.57 -40.5 63.87 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.891 0.876 . . . . 0.0 110.76 171.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -60.71 -46.73 89.26 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.312 0.645 . . . . 0.0 110.958 174.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.1 t -63.75 -39.17 93.63 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.627 0.771 . . . . 0.0 111.805 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.489 ' HA ' ' HA ' ' A' ' 59' ' ' ASP . 6.0 ptm180 -78.89 -43.15 25.51 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 -177.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -82.56 -32.51 28.49 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.516 0.727 . . . . 0.0 111.517 -170.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.71 -34.92 10.73 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.835 0.454 . . . . 0.0 110.309 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -89.8 -105.53 1.17 Allowed Glycine 0 C--N 1.35 1.335 0 CA-C-N 116.262 -0.426 . . . . 0.0 113.65 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -161.6 23.69 0.12 Allowed 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 117.236 0.518 . . . . 0.0 111.847 -174.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.489 ' HA ' ' HA ' ' A' ' 54' ' ' ARG . 0.5 OUTLIER 75.36 -178.33 0.16 Allowed 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.616 1.567 . . . . 0.0 112.636 -178.261 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 tm? 176.14 -45.45 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 126.241 1.816 . . . . 0.0 107.761 -175.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 50.7 ttp -69.79 -40.11 76.21 Favored 'General case' 0 CA--C 1.557 1.226 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.53 -172.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.8 p -95.96 153.22 39.27 Favored Pre-proline 0 N--CA 1.491 1.618 0 C-N-CA 122.878 0.471 . . . . 0.0 111.394 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -77.39 39.32 0.73 Allowed 'Trans proline' 0 C--N 1.388 2.649 0 C-N-CA 123.362 2.708 . . . . 0.0 115.236 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 68.9 mtp180 -56.18 150.51 30.95 Favored Pre-proline 0 N--CA 1.487 1.382 0 C-N-CA 123.979 0.912 . . . . 0.0 112.27 174.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -59.99 -13.79 24.84 Favored 'Trans proline' 0 N--CA 1.512 2.582 0 C-N-CA 123.567 2.845 . . . . 0.0 114.337 -172.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -63.25 -45.43 91.6 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 123.877 0.871 . . . . 0.0 111.545 174.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -107.06 -29.42 9.41 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 123.786 0.834 . . . . 0.0 112.133 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 67.48 -67.72 0.17 Allowed 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 125.654 1.582 . . . . 0.0 112.646 -176.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -104.88 110.95 65.14 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.853 0.861 . . . . 0.0 110.609 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -83.41 172.1 10.67 Favored 'Trans proline' 0 CA--C 1.56 1.814 0 C-N-CA 122.881 2.388 . . . . 0.0 113.521 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -99.28 -121.53 4.58 Favored Glycine 0 C--N 1.351 1.407 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.961 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.418 ' HB3' ' O ' ' A' ' 78' ' ' TRP . 2.6 pt? -65.91 159.23 26.03 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.942 0.897 . . . . 0.0 113.17 178.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -87.24 177.98 7.0 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.563 164.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.19 87.69 1.95 Allowed 'General case' 0 CA--C 1.549 0.94 0 CA-C-O 121.18 0.514 . . . . 0.0 110.859 176.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 116.16 31.29 1.9 Allowed Glycine 0 CA--C 1.539 1.556 0 CA-C-N 115.67 -0.695 . . . . 0.0 113.776 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -122.15 113.78 19.97 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-N 117.28 0.54 . . . . 0.0 110.592 169.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.436 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 13.0 ptp180 -69.8 89.82 0.58 Allowed 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 121.935 0.874 . . . . 0.0 111.178 177.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.418 ' O ' ' HB3' ' A' ' 72' ' ' LEU . 26.4 t90 -177.61 140.81 0.27 Allowed 'General case' 0 N--CA 1.491 1.612 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.976 -171.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 44.9 t 50.79 31.85 6.47 Favored 'General case' 0 N--CA 1.508 2.459 0 C-N-CA 124.773 1.229 . . . . 0.0 113.702 167.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.462 HD22 ' HD2' ' A' ' 84' ' ' ARG . 3.0 tm? -81.62 -33.29 31.54 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 118.847 -0.597 . . . . 0.0 111.889 -171.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 37.6 t 65.12 121.8 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 123.463 0.705 . . . . 0.0 111.58 -175.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.513 ' H ' HG21 ' A' ' 41' ' ' VAL . . . -61.23 -29.88 70.1 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -170.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.5 m -57.76 -33.5 68.58 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.668 0.787 . . . . 0.0 112.551 176.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.462 ' HD2' HD22 ' A' ' 80' ' ' LEU . 30.2 ttm180 -73.43 -45.43 54.51 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.791 0.836 . . . . 0.0 111.324 -174.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.552 ' HE1' HD23 ' A' ' 115' ' ' LEU . 1.6 t-105 -74.23 -52.08 13.44 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.55 0.74 . . . . 0.0 111.277 176.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.435 ' OE1' HG12 ' A' ' 110' ' ' VAL . 34.2 tp60 -51.67 -37.73 51.86 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.044 0.938 . . . . 0.0 112.948 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -62.72 -42.74 99.81 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.768 0.427 . . . . 0.0 111.395 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.71 -33.8 76.45 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.338 0.655 . . . . 0.0 111.913 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -61.17 -51.4 69.22 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.51 0.724 . . . . 0.0 111.041 174.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -69.72 -25.56 63.91 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.411 0.685 . . . . 0.0 112.266 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.38 -14.39 58.99 Favored 'General case' 0 CA--C 1.557 1.232 0 C-N-CA 123.54 0.736 . . . . 0.0 111.699 171.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.73 -20.18 29.31 Favored Glycine 0 C--N 1.353 1.48 0 N-CA-C 114.448 0.539 . . . . 0.0 114.448 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 4.5 ppp? -84.56 5.18 28.76 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -171.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.462 ' HB1' ' CZ3' ' A' ' 85' ' ' TRP . . . -54.14 131.99 60.02 Favored Pre-proline 0 CA--C 1.564 1.518 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.9 174.89 10.49 Favored 'Trans proline' 0 CA--C 1.565 2.055 0 C-N-CA 123.484 2.789 . . . . 0.0 113.585 172.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.95 124.46 13.58 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.151 1.901 . . . . 0.0 112.446 166.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.09 137.86 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.581 0.752 . . . . 0.0 110.597 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.49 HG13 ' HB3' ' A' ' 101' ' ' SER . 4.5 p -68.44 103.4 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.572 1.812 0 CA-C-O 121.902 0.858 . . . . 0.0 112.066 179.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 86.7 mt -58.41 -40.89 83.67 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 124.845 1.258 . . . . 0.0 112.694 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -78.52 7.04 7.31 Favored 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -175.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.49 ' HB3' HG13 ' A' ' 98' ' ' VAL . 40.9 t -118.42 -25.31 6.55 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 122.952 0.501 . . . . 0.0 111.973 173.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.2 p -69.16 115.21 8.19 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.583 0.353 . . . . 0.0 111.14 177.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.6 mp0 -64.44 160.8 18.4 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.007 0.523 . . . . 0.0 111.978 175.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.418 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 3.3 tmtp? -66.06 -27.63 68.23 Favored 'General case' 0 CA--C 1.561 1.402 0 CA-C-O 121.191 0.52 . . . . 0.0 109.754 174.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.519 ' HB3' ' HB ' ' A' ' 40' ' ' THR . 45.3 t -60.12 -28.76 68.13 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.248 0.619 . . . . 0.0 111.794 173.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.531 ' HA ' HG22 ' A' ' 41' ' ' VAL . . . -65.2 -44.21 89.08 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 122.813 0.445 . . . . 0.0 111.282 171.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.427 ' HA ' HG23 ' A' ' 110' ' ' VAL . 9.5 mp -64.45 6.19 0.22 Allowed 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 125.463 1.505 . . . . 0.0 113.741 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -95.99 -14.71 22.8 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.475 0.71 . . . . 0.0 110.459 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -114.39 -41.21 3.49 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.664 1.186 . . . . 0.0 108.469 178.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.532 HG21 HD21 ' A' ' 115' ' ' LEU . 1.7 m -92.99 -168.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.861 0.839 . . . . 0.0 110.739 164.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.3 t -131.01 156.01 45.85 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.949 1.3 . . . . 0.0 107.886 160.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 tt -49.28 -39.21 29.9 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.995 0.518 . . . . 0.0 111.625 170.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.1 77.05 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.206 0.602 . . . . 0.0 112.495 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -68.43 -32.86 73.18 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.792 0.437 . . . . 0.0 111.025 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.552 HD23 ' HE1' ' A' ' 85' ' ' TRP . 29.5 mt -73.26 -55.64 6.16 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.902 -178.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -66.0 -24.31 66.75 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.78 1.232 . . . . 0.0 112.993 -176.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -53.21 -34.27 56.35 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 174.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 69.3 m-70 -115.19 -23.02 9.16 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.365 0.666 . . . . 0.0 112.415 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -83.29 -25.27 31.73 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.321 0.648 . . . . 0.0 112.157 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.412 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 4.2 mm? 68.48 139.6 0.06 OUTLIER Pre-proline 0 CA--C 1.561 1.372 0 C-N-CA 125.494 1.518 . . . . 0.0 112.557 -174.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 120' ' ' LEU . 6.5 Cg_exo -74.24 16.55 0.56 Allowed 'Trans proline' 0 C--N 1.382 2.296 0 C-N-CA 123.568 2.846 . . . . 0.0 115.252 -173.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 59.1 t 62.4 107.68 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.509 0 C-N-CA 125.328 1.451 . . . . 0.0 113.05 173.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.9 tt -65.8 -20.36 66.22 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.998 0.919 . . . . 0.0 112.715 -178.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -61.19 91.98 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.522 0.729 . . . . 0.0 112.654 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 77.3 t60 44.55 106.04 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 126.348 1.859 . . . . 0.0 115.571 170.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -95.25 -58.37 2.16 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.536 0.334 . . . . 0.0 110.616 169.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -143.1 -166.61 2.35 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 124.297 1.039 . . . . 0.0 110.393 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -102.37 -54.76 2.61 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 165.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 20.8 p80 -158.56 138.46 12.1 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.576 1.15 . . . . 0.0 108.862 169.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 . . . . . 0 CA--C 1.571 1.755 0 C-N-CA 124.65 1.18 . . . . 0.0 111.17 -169.371 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.2 -68.31 3.31 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 116.404 -0.362 . . . . 0.0 113.167 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -81.44 115.94 21.01 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.182 0.993 . . . . 0.0 111.292 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -163.46 106.06 0.27 Allowed Glycine 0 C--N 1.351 1.38 0 N-CA-C 112.388 -0.285 . . . . 0.0 112.388 175.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -106.46 157.96 17.26 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.772 0.829 . . . . 0.0 111.41 -176.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.412 ' N ' HD22 ' A' ' 6' ' ' ASN . 1.0 OUTLIER -95.96 177.65 5.68 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.383 0.673 . . . . 0.0 111.285 175.052 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 11.2 m -66.76 -18.45 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -174.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.418 HD22 ' H ' ' A' ' 8' ' ' LEU . 2.4 mm? -68.99 -30.34 68.73 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.876 0.871 . . . . 0.0 111.175 175.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 96.62 -78.1 0.72 Allowed Glycine 0 C--N 1.344 0.976 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.78 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -172.8 167.14 5.26 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.211 1.005 . . . . 0.0 111.588 178.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -158.93 104.82 1.74 Allowed 'General case' 0 CA--C 1.565 1.534 0 C-N-CA 124.125 0.97 . . . . 0.0 110.519 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 89.3 mt -114.39 70.01 0.72 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.153 -0.967 . . . . 0.0 110.898 -178.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -140.24 153.12 46.44 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 124.863 1.265 . . . . 0.0 109.721 175.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.414 HG21 ' H ' ' A' ' 28' ' ' PHE . 8.5 p -169.52 148.07 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -178.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 78.2 m -145.84 0.41 0.85 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.811 0.844 . . . . 0.0 111.979 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.4 t 59.54 129.24 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 124.929 1.291 . . . . 0.0 113.661 -168.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 77.0 m 75.97 -39.27 0.37 Allowed 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 125.62 1.568 . . . . 0.0 114.069 176.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.61 154.49 91.21 Favored Pre-proline 0 CA--C 1.561 1.39 0 C-N-CA 123.918 0.887 . . . . 0.0 112.292 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -68.02 -175.37 0.78 Allowed 'Trans proline' 0 C--N 1.385 2.466 0 C-N-CA 122.71 2.273 . . . . 0.0 112.997 172.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 51.7 mtm 72.92 -7.73 1.41 Allowed 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 124.99 1.316 . . . . 0.0 112.889 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.0 t -131.59 116.46 17.42 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.216 1.006 . . . . 0.0 109.844 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -175.59 -23.69 0.03 OUTLIER Glycine 0 C--N 1.346 1.133 0 CA-C-N 116.374 -0.376 . . . . 0.0 113.721 -175.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -76.51 -70.21 0.46 Allowed 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 122.699 0.4 . . . . 0.0 110.208 176.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -83.12 -57.86 3.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 122.062 -0.399 . . . . 0.0 111.131 172.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 50.3 ttm-85 72.5 -57.61 0.62 Allowed 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 125.64 1.576 . . . . 0.0 112.726 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 72.98 10.79 5.3 Favored 'General case' 0 N--CA 1.505 2.293 0 C-N-CA 125.097 1.359 . . . . 0.0 113.029 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.91 36.47 92.15 Favored Glycine 0 N--CA 1.482 1.762 0 N-CA-C 115.186 0.834 . . . . 0.0 115.186 176.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.414 ' H ' HG21 ' A' ' 14' ' ' VAL . 47.5 t80 62.93 -79.63 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.972 1.309 . . . . 0.0 111.909 -178.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 74.2 m -98.88 -90.13 0.3 Allowed 'General case' 0 CA--C 1.556 1.199 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 172.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.514 ' HG2' ' HB2' ' A' ' 105' ' ' SER . 1.8 mp0 -137.29 -61.34 0.65 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 124.461 1.104 . . . . 0.0 108.338 176.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 t -158.61 -39.39 0.06 Allowed 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 113.945 -1.48 . . . . 0.0 108.696 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 69.41 130.21 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 125.793 1.637 . . . . 0.0 113.366 166.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 21.4 t -96.01 -10.12 9.04 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.673 0 C-N-CA 123.597 0.759 . . . . 0.0 112.088 -174.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 72.37 -36.84 0.37 Allowed 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 126.429 1.892 . . . . 0.0 113.401 -177.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -98.38 40.51 1.18 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.89 0.876 . . . . 0.0 110.609 171.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 69.38 149.61 0.08 Allowed 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 125.678 1.591 . . . . 0.0 113.166 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 152.26 -112.13 0.52 Allowed Glycine 0 CA--C 1.535 1.295 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.151 -178.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.478 ' HB3' ' NE2' ' A' ' 30' ' ' GLN . 67.9 m 63.38 8.57 3.56 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 174.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 30.9 m170 -86.11 84.97 7.37 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.374 0.67 . . . . 0.0 110.066 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 103' ' ' GLU . 4.9 t -130.76 103.41 6.58 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.364 0.666 . . . . 0.0 110.695 -175.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.6 t -138.34 111.89 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 C-N-CA 123.255 0.622 . . . . 0.0 110.353 -178.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 72.2 m -101.42 106.41 17.55 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 171.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.546 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -139.53 147.92 41.9 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.36 0.664 . . . . 0.0 109.689 -175.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -106.61 112.79 25.94 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.461 0.304 . . . . 0.0 111.375 -172.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.477 ' SD ' ' HA ' ' A' ' 85' ' ' TRP . 29.7 mtm -110.0 137.68 47.43 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.044 170.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.1 p -83.7 167.98 16.69 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.602 0.761 . . . . 0.0 111.689 -171.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.404 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 28.4 tt0 -61.12 -30.37 70.33 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.506 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -49.56 -55.33 13.85 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.962 0.905 . . . . 0.0 111.509 174.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -76.22 -37.6 57.53 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' A' ' 45' ' ' MET . 10.9 mp -67.41 -33.74 75.8 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 118.351 0.523 . . . . 0.0 111.706 -177.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 68.6 mt -72.61 -27.88 62.43 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.239 0.616 . . . . 0.0 111.245 170.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -73.83 -34.07 64.41 Favored 'General case' 0 CA--C 1.563 1.47 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 172.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 73.3 m -66.76 -31.09 71.51 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.312 0.645 . . . . 0.0 112.599 -175.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.543 ' HB2' ' HA ' ' A' ' 59' ' ' ASP . 36.4 ptt180 -70.44 -27.53 64.32 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.063 0.545 . . . . 0.0 111.472 177.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -76.15 -34.44 59.39 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 122.618 0.367 . . . . 0.0 110.174 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -81.21 82.71 7.02 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.712 0.805 . . . . 0.0 110.055 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 116.35 -82.14 0.32 Allowed Glycine 0 N--CA 1.478 1.496 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.505 178.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -156.31 149.15 23.97 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 123.358 0.663 . . . . 0.0 111.256 -176.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.543 ' HA ' ' HB2' ' A' ' 54' ' ' ARG . 9.8 p-10 -90.25 41.36 1.05 Allowed 'General case' 0 CA--C 1.565 1.531 0 C-N-CA 123.874 0.869 . . . . 0.0 113.223 -174.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -66.05 -40.27 90.82 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 172.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 13.9 tpt 75.13 -58.62 0.57 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 125.757 1.623 . . . . 0.0 112.578 175.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 84.9 m -59.73 123.81 73.21 Favored Pre-proline 0 CA--C 1.556 1.201 0 C-N-CA 124.205 1.002 . . . . 0.0 111.302 175.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.47 176.93 9.45 Favored 'Trans proline' 0 C--N 1.375 1.938 0 C-N-CA 122.22 1.946 . . . . 0.0 112.503 176.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 70.15 157.8 0.16 Allowed Pre-proline 0 N--CA 1.498 1.96 0 C-N-CA 124.592 1.157 . . . . 0.0 112.891 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -77.21 33.02 0.43 Allowed 'Trans proline' 0 C--N 1.381 2.274 0 C-N-CA 122.528 2.152 . . . . 0.0 113.477 170.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -123.02 131.11 53.57 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.316 1.447 . . . . 0.0 108.692 178.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -100.42 -6.45 25.65 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -170.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -76.54 84.28 3.23 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 -177.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 65.41 142.4 0.07 OUTLIER Pre-proline 0 N--CA 1.494 1.766 0 C-N-CA 125.554 1.542 . . . . 0.0 114.26 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -68.16 93.53 0.4 Allowed 'Trans proline' 0 C--N 1.383 2.369 0 C-N-CA 122.381 2.054 . . . . 0.0 111.53 172.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -65.14 -41.33 97.07 Favored Glycine 0 C--N 1.35 1.317 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.7 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -94.88 102.73 14.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.191 0.596 . . . . 0.0 110.118 174.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -97.93 -167.67 1.55 Allowed 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.87 112.27 5.45 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.79 -1.38 58.09 Favored Glycine 0 N--CA 1.475 1.272 0 CA-C-N 115.704 -0.68 . . . . 0.0 113.883 177.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.03 104.42 6.55 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.184 0.516 . . . . 0.0 111.675 178.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.572 ' HD3' HG11 ' A' ' 98' ' ' VAL . 13.7 ptt180 -81.19 91.65 6.2 Favored 'General case' 0 CA--C 1.557 1.221 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.03 175.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -168.51 120.88 0.82 Allowed 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.232 0.613 . . . . 0.0 110.271 176.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 48.5 t 51.62 25.23 2.69 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 124.166 0.986 . . . . 0.0 112.648 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.546 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.4 tm? -66.86 123.4 20.05 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.081 0.952 . . . . 0.0 109.536 -177.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.444 ' SG ' ' HB3' ' A' ' 83' ' ' SER . 42.6 t -59.01 102.35 0.12 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.224 0.609 . . . . 0.0 110.924 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.96 -26.89 62.89 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.922 0.889 . . . . 0.0 112.223 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.444 ' HB3' ' SG ' ' A' ' 81' ' ' CYS . 45.7 t -67.25 -41.46 85.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.566 0.746 . . . . 0.0 111.483 172.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 56.4 ttm-85 -73.89 -31.62 63.2 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.004 0.522 . . . . 0.0 111.843 179.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.624 ' HE1' HD23 ' A' ' 115' ' ' LEU . 6.0 t-105 -64.45 -42.1 96.16 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 169.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.433 HE21 ' HG2' ' A' ' 90' ' ' GLU . 22.5 tp60 -58.18 -38.08 76.0 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.708 0.403 . . . . 0.0 110.85 174.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 83' ' ' SER . 41.6 mm-40 -62.18 -39.13 91.66 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.893 0.477 . . . . 0.0 111.774 176.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.53 -41.23 96.51 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.152 0.501 . . . . 0.0 111.393 174.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.759 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 40.2 t80 -67.41 -42.59 82.99 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.41 -176.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.433 ' HG2' HE21 ' A' ' 86' ' ' GLN . 14.4 mm-40 -77.03 -32.24 56.9 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.324 0.649 . . . . 0.0 111.988 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.88 -22.93 62.22 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.028 0.531 . . . . 0.0 111.74 176.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 106.33 -11.01 43.44 Favored Glycine 0 N--CA 1.476 1.328 0 CA-C-O 119.717 -0.491 . . . . 0.0 114.275 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . 0.414 ' N ' ' SD ' ' A' ' 93' ' ' MET . 1.1 mpt? -66.79 -66.91 0.49 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 117.41 0.605 . . . . 0.0 109.947 176.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.759 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 48.14 87.34 0.13 Allowed Pre-proline 0 CA--C 1.558 1.269 0 C-N-CA 125.135 1.374 . . . . 0.0 114.018 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -64.85 158.22 52.23 Favored 'Trans proline' 0 CA--C 1.566 2.076 0 C-N-CA 123.18 2.586 . . . . 0.0 113.409 172.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -68.29 109.44 2.0 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.362 2.042 . . . . 0.0 112.35 173.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.7 p -95.99 137.01 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 123.672 0.789 . . . . 0.0 110.916 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.572 HG11 ' HD3' ' A' ' 77' ' ' ARG . 5.5 p -77.34 107.77 9.4 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.741 0 C-N-CA 123.953 0.901 . . . . 0.0 113.076 -174.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 98.6 mt -67.79 -36.81 81.1 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.823 0.849 . . . . 0.0 112.52 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -78.43 20.51 0.41 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.624 0.77 . . . . 0.0 112.769 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.0 t -142.79 -44.23 0.31 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.688 0.795 . . . . 0.0 111.324 175.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.7 m -56.88 121.49 10.02 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 123.862 0.865 . . . . 0.0 112.737 -173.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 40' ' ' THR . 1.9 mp0 -74.14 166.8 22.79 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.034 0.933 . . . . 0.0 113.071 -173.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.402 ' HA ' HD13 ' A' ' 107' ' ' LEU . 32.9 mmtp -68.59 -13.42 62.33 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.101 0.96 . . . . 0.0 113.034 -177.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.514 ' HB2' ' HG2' ' A' ' 30' ' ' GLN . 33.5 t -57.35 -48.68 78.38 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 122.971 0.509 . . . . 0.0 110.613 172.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.58 -32.49 63.09 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.536 0.734 . . . . 0.0 112.82 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.455 ' HG ' ' HB2' ' A' ' 112' ' ' LEU . 8.6 mp -66.16 -22.81 66.38 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.007 0.523 . . . . 0.0 112.371 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.2 mtt85 -89.32 -7.49 55.23 Favored 'General case' 0 CA--C 1.561 1.393 0 C-N-CA 123.686 0.794 . . . . 0.0 112.78 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -117.9 -57.97 2.05 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 123.331 0.652 . . . . 0.0 112.057 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.45 HG21 ' CD1' ' A' ' 85' ' ' TRP . 13.3 p -98.66 -25.75 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 C-N-CA 123.589 0.756 . . . . 0.0 111.767 -176.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 46.8 t 77.58 149.46 0.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 125.689 1.596 . . . . 0.0 112.394 -173.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.555 ' HA ' HD12 ' A' ' 115' ' ' LEU . 4.6 tt -61.31 -37.12 82.08 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.713 1.205 . . . . 0.0 113.021 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.47 -34.8 76.08 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -173.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.35 -34.0 72.12 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.103 0.961 . . . . 0.0 111.481 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.624 HD23 ' HE1' ' A' ' 85' ' ' TRP . 57.4 mt -69.15 -48.01 63.45 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 121.943 0.877 . . . . 0.0 110.434 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -70.26 -37.87 74.99 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.848 -175.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -57.69 -16.74 11.79 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -132.35 39.12 3.42 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.392 0.677 . . . . 0.0 111.56 173.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -153.25 -63.09 0.15 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.175 0.59 . . . . 0.0 111.294 170.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 59.1 tp -142.55 111.13 5.82 Favored Pre-proline 0 N--CA 1.486 1.366 0 C-N-CA 123.81 0.844 . . . . 0.0 109.355 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -77.22 81.56 2.59 Favored 'Trans proline' 0 CA--C 1.56 1.781 0 C-N-CA 122.707 2.271 . . . . 0.0 112.934 -171.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.503 HG22 ' H ' ' A' ' 124' ' ' GLU . 14.2 p -64.74 138.53 22.96 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.321 0 C-N-CA 123.909 0.884 . . . . 0.0 111.424 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.0 pp -101.18 -6.13 24.67 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.744 0.418 . . . . 0.0 111.677 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.503 ' H ' HG22 ' A' ' 122' ' ' VAL . 30.7 mp0 -84.2 31.15 0.51 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.654 1.181 . . . . 0.0 111.782 175.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -66.64 114.16 5.36 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.88 0.472 . . . . 0.0 109.767 172.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 69.8 m80 -121.25 145.75 47.52 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.493 0.717 . . . . 0.0 111.29 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 67.8 t60 -78.29 111.12 13.94 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.234 1.014 . . . . 0.0 110.367 -177.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 12.8 m170 62.22 -81.71 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 124.432 1.093 . . . . 0.0 111.725 -173.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 -174.87 -41.61 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.73 1.212 . . . . 0.0 109.901 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 80.1 t60 . . . . . 0 CA--C 1.558 1.282 0 C-N-CA 124.73 1.212 . . . . 0.0 109.664 -177.096 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.3 mtt . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 120.852 0.358 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -150.44 -154.07 6.34 Favored Glycine 0 N--CA 1.473 1.135 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.293 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -150.8 -177.3 5.92 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 117.346 0.573 . . . . 0.0 111.911 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.07 149.71 19.38 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.783 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -89.36 115.17 26.63 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -168.38 113.74 0.64 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.899 0.88 . . . . 0.0 110.236 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.73 ' H ' ' HB2' ' A' ' 11' ' ' ASP . 21.6 t 75.28 -48.21 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.394 0 C-N-CA 126.689 1.995 . . . . 0.0 112.736 175.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 pp -53.46 -25.24 15.41 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.591 1.556 . . . . 0.0 112.825 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -150.3 59.83 0.43 Allowed Glycine 0 C--N 1.343 0.94 0 N-CA-C 110.415 -1.074 . . . . 0.0 110.415 174.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 76.06 160.31 0.22 Allowed 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 125.56 1.544 . . . . 0.0 111.684 -177.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.73 ' HB2' ' H ' ' A' ' 7' ' ' VAL . 27.5 t70 -171.06 94.32 0.18 Allowed 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.02 -177.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 72.0 mt 53.5 39.47 30.05 Favored 'General case' 0 CA--C 1.558 1.273 0 C-N-CA 124.711 1.204 . . . . 0.0 113.695 169.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -72.38 152.03 42.28 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.153 0.581 . . . . 0.0 111.211 175.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.609 HG13 ' H ' ' A' ' 29' ' ' CYS . 7.5 p -68.41 98.72 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.389 0 CA-C-O 122.503 1.144 . . . . 0.0 111.133 -176.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 54.0 t -111.42 -3.91 15.06 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.099 0.96 . . . . 0.0 112.128 -172.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.8 t 75.94 -22.84 0.26 Allowed 'General case' 0 N--CA 1.503 2.193 0 C-N-CA 125.58 1.552 . . . . 0.0 113.856 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 83.7 m -59.84 -33.86 72.34 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 124.206 1.002 . . . . 0.0 112.755 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -123.48 129.02 25.03 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 123.322 0.649 . . . . 0.0 110.824 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -65.13 115.49 3.33 Favored 'Trans proline' 0 C--N 1.379 2.143 0 C-N-CA 123.156 2.571 . . . . 0.0 112.224 174.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 59.9 ttp 61.93 89.1 0.08 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.852 1.261 . . . . 0.0 111.655 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.5 p -90.84 136.47 33.05 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.751 0.82 . . . . 0.0 110.898 178.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 71.05 -86.32 0.39 Allowed Glycine 0 C--N 1.354 1.538 0 O-C-N 123.108 0.255 . . . . 0.0 112.595 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -137.66 -44.68 0.54 Allowed 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.632 0.773 . . . . 0.0 109.519 172.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -149.34 -69.18 0.21 Allowed 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.793 0.837 . . . . 0.0 110.876 173.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? 59.68 -79.55 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 124.449 1.1 . . . . 0.0 110.33 -163.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 64.4 t30 67.18 138.42 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 125.763 1.625 . . . . 0.0 113.036 173.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.89 -19.05 10.39 Favored Glycine 0 N--CA 1.48 1.588 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.917 -176.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 64.94 83.3 0.17 Allowed 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 125.369 1.468 . . . . 0.0 111.99 177.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.609 ' H ' HG13 ' A' ' 14' ' ' VAL . 53.2 t -80.65 103.11 10.27 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.793 0.837 . . . . 0.0 110.291 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -118.69 35.62 4.72 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-O 122.142 0.972 . . . . 0.0 109.376 -177.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 13.9 t -128.63 165.55 20.61 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.38 -177.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -68.8 123.24 20.4 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.047 0.539 . . . . 0.0 112.431 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.57 -11.44 14.0 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.316 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.076 166.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -66.31 -14.06 61.46 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 124.787 1.235 . . . . 0.0 111.972 173.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 72.69 11.12 5.52 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.21 1.404 . . . . 0.0 112.504 174.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.427 ' HA ' ' HE ' ' A' ' 36' ' ' ARG . 10.1 mmp_? -85.53 -23.51 27.66 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.458 -0.777 . . . . 0.0 112.472 -178.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.55 -71.15 1.87 Allowed Glycine 0 CA--C 1.537 1.447 0 N-CA-C 114.127 0.411 . . . . 0.0 114.127 172.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.7 m -72.27 80.8 1.0 Allowed 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.545 0.738 . . . . 0.0 111.414 178.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 -171.48 1.13 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 124.562 1.145 . . . . 0.0 110.72 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.8 p -92.26 115.59 28.22 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 121.462 0.649 . . . . 0.0 111.093 -169.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.646 HG11 ' HB2' ' A' ' 82' ' ' ALA . 18.6 t -127.23 127.81 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.686 0.794 . . . . 0.0 109.954 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.409 ' SG ' ' HA ' ' A' ' 78' ' ' TRP . 93.6 m -136.39 108.86 7.38 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 168.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.577 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -140.43 150.77 44.25 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.123 0.969 . . . . 0.0 109.22 -170.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.448 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 20.2 tt0 -114.76 124.5 51.94 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.984 0.421 . . . . 0.0 111.812 -177.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.417 ' HE3' ' HB3' ' A' ' 45' ' ' MET . 67.1 mmm -108.21 138.46 44.45 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.079 0.951 . . . . 0.0 109.775 175.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 7.0 t -85.5 156.44 20.78 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.865 0.466 . . . . 0.0 110.398 174.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.541 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 37.6 tt0 -61.25 -29.29 69.75 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.065 0.546 . . . . 0.0 111.624 -175.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -48.3 -45.92 35.54 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 124.327 1.051 . . . . 0.0 111.845 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -76.93 -39.96 48.85 Favored 'General case' 0 CA--C 1.558 1.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.274 174.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.28 -26.1 68.34 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.541 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 95.9 mt -74.27 -47.47 34.72 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.691 0.796 . . . . 0.0 109.763 172.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -58.4 -31.77 68.01 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.642 0.777 . . . . 0.0 111.9 174.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.9 t -60.52 -36.2 77.81 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.535 0.734 . . . . 0.0 110.857 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.548 ' HB2' ' HB3' ' A' ' 59' ' ' ASP . 20.9 ttt180 -75.33 -50.64 15.38 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.946 0.898 . . . . 0.0 111.012 174.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -65.02 -18.07 64.98 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.518 0.727 . . . . 0.0 112.925 -176.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 -94.23 -56.42 2.84 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.298 0.639 . . . . 0.0 110.18 172.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -124.84 -88.62 0.78 Allowed Glycine 0 C--N 1.349 1.28 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.417 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.409 ' N ' HD22 ' A' ' 58' ' ' ASN . 0.0 OUTLIER -154.75 152.12 29.51 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.537 0.735 . . . . 0.0 111.162 -178.941 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.548 ' HB3' ' HB2' ' A' ' 54' ' ' ARG . 4.4 p-10 -105.01 168.41 9.07 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.173 0.589 . . . . 0.0 109.757 171.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 95.6 mt -121.22 7.3 10.22 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.214 0.605 . . . . 0.0 111.138 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.46 14.8 24.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -170.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 81.4 m -71.19 118.97 70.69 Favored Pre-proline 0 N--CA 1.492 1.67 0 C-N-CA 122.736 0.415 . . . . 0.0 110.88 170.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.6 108.75 0.56 Allowed 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 123.187 2.592 . . . . 0.0 113.557 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 37.0 mtp180 -92.64 129.6 39.85 Favored Pre-proline 0 N--CA 1.485 1.284 0 C-N-CA 123.301 0.64 . . . . 0.0 110.754 176.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -65.79 -23.19 55.83 Favored 'Trans proline' 0 C--N 1.382 2.29 0 C-N-CA 122.951 2.434 . . . . 0.0 113.351 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -64.64 -33.02 74.96 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.595 1.158 . . . . 0.0 112.133 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -117.08 -17.48 10.3 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.673 0.789 . . . . 0.0 112.16 -176.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 66.62 -67.1 0.16 Allowed 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 125.432 1.493 . . . . 0.0 111.119 -167.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -74.38 122.5 87.66 Favored Pre-proline 0 CA--C 1.563 1.452 0 C-N-CA 124.114 0.966 . . . . 0.0 111.098 178.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -86.53 -152.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.375 1.973 0 C-N-CA 123.197 2.598 . . . . 0.0 112.877 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -80.4 -162.76 27.4 Favored Glycine 0 CA--C 1.537 1.459 0 CA-C-N 116.768 -0.196 . . . . 0.0 113.435 174.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -67.45 138.91 56.98 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.639 0.776 . . . . 0.0 112.299 -174.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -106.01 -179.92 4.08 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.371 1.068 . . . . 0.0 111.865 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -83.14 123.64 29.72 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.236 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 109.86 -10.46 32.14 Favored Glycine 0 N--CA 1.477 1.429 0 CA-C-N 116.743 -0.208 . . . . 0.0 113.521 -174.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -85.61 83.98 7.73 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.306 0.642 . . . . 0.0 111.211 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.448 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -85.04 86.28 7.4 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-O 121.236 0.541 . . . . 0.0 111.57 179.592 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.409 ' HA ' ' SG ' ' A' ' 42' ' ' CYS . 42.3 t90 179.32 122.62 0.05 Allowed 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.916 0.886 . . . . 0.0 109.449 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 84.9 m 57.9 25.81 12.56 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 124.138 0.975 . . . . 0.0 113.209 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.577 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.8 tm? -66.38 124.16 21.97 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.389 0.676 . . . . 0.0 109.423 175.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 59.0 m -61.39 105.68 0.54 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.309 0.644 . . . . 0.0 109.506 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.646 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -59.22 -23.63 62.47 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -169.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.9 m -63.77 -30.19 71.31 Favored 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 123.325 0.65 . . . . 0.0 112.347 175.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -57.3 -47.43 81.5 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 124.304 1.041 . . . . 0.0 110.291 171.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.72 ' HE1' HD23 ' A' ' 115' ' ' LEU . 13.5 t-105 -71.74 -41.26 68.68 Favored 'General case' 0 CA--C 1.565 1.532 0 CA-C-N 114.325 -1.307 . . . . 0.0 111.964 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -63.4 -48.08 79.32 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.959 0.904 . . . . 0.0 111.114 -177.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.73 -28.59 67.77 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.348 0.659 . . . . 0.0 111.57 178.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.55 -41.06 96.57 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.208 0.603 . . . . 0.0 111.67 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.764 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 84.9 t80 -67.09 -48.36 68.41 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.977 176.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.28 -25.19 67.94 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.67 0.788 . . . . 0.0 112.354 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.55 -22.62 50.76 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.639 0.775 . . . . 0.0 111.78 175.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.92 -4.74 42.12 Favored Glycine 0 C--N 1.351 1.402 0 N-CA-C 114.259 0.464 . . . . 0.0 114.259 176.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . 0.443 ' N ' ' SD ' ' A' ' 93' ' ' MET . 1.5 mpt? -84.57 -73.62 0.42 Allowed 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 117.314 0.557 . . . . 0.0 109.963 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.764 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 58.07 95.17 0.05 OUTLIER Pre-proline 0 CA--C 1.565 1.541 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 178.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -55.62 161.58 7.6 Favored 'Trans proline' 0 CA--C 1.564 1.981 0 C-N-CA 123.748 2.965 . . . . 0.0 114.972 169.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.01 117.42 5.09 Favored 'Trans proline' 0 C--N 1.372 1.795 0 C-N-CA 122.332 2.021 . . . . 0.0 111.759 169.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.491 HG11 ' HA ' ' A' ' 115' ' ' LEU . 14.2 p -99.68 159.71 3.54 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 123.691 0.796 . . . . 0.0 110.609 -177.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 m -92.67 99.98 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 124.215 1.006 . . . . 0.0 112.346 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.608 HD11 ' HG2' ' A' ' 116' ' ' GLN . 4.7 mt -74.23 -16.81 60.95 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.305 -0.872 . . . . 0.0 111.717 170.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -74.42 -12.31 60.47 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 123.817 0.847 . . . . 0.0 112.205 174.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.9 t -128.37 -40.53 1.61 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.016 0.526 . . . . 0.0 112.079 -175.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 55.0 p -55.34 99.3 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 CA-C-O 121.172 0.51 . . . . 0.0 111.838 171.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.544 ' HG3' ' H ' ' A' ' 105' ' ' SER . 12.7 tp10 -66.17 154.6 39.3 Favored 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 123.937 0.895 . . . . 0.0 110.781 172.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -56.54 -23.27 38.82 Favored 'General case' 0 CA--C 1.565 1.525 0 C-N-CA 124.237 1.015 . . . . 0.0 112.055 177.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.544 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 25.1 m -58.2 -27.66 64.1 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.99 0.916 . . . . 0.0 112.649 176.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.492 ' HA ' HG22 ' A' ' 41' ' ' VAL . . . -61.78 -23.43 66.18 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.229 1.012 . . . . 0.0 113.045 178.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.411 HD21 ' HB2' ' A' ' 112' ' ' LEU . 9.6 mp -67.37 -3.7 8.97 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -178.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -70.88 -33.38 70.54 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 122.059 -0.401 . . . . 0.0 111.533 167.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.574 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 49.5 m-85 -112.43 -23.43 10.32 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.054 0.942 . . . . 0.0 111.582 -171.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.496 ' HB ' ' HB1' ' A' ' 82' ' ' ALA . 4.9 p -129.69 -178.43 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.456 0 C-N-CA 123.832 0.853 . . . . 0.0 109.613 177.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . 0.472 ' H ' HG22 ' A' ' 110' ' ' VAL . 27.2 p -109.89 164.2 12.81 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.494 -0.754 . . . . 0.0 110.739 170.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.411 ' HB2' HD21 ' A' ' 107' ' ' LEU . 4.6 tt -66.02 -39.45 90.23 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.433 0.693 . . . . 0.0 111.075 171.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.5 -33.83 74.46 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.437 0.695 . . . . 0.0 112.282 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.93 -50.22 73.27 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.269 0.628 . . . . 0.0 111.074 169.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.72 HD23 ' HE1' ' A' ' 85' ' ' TRP . 20.2 mt -65.8 -48.77 70.62 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.077 -172.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.608 ' HG2' HD11 ' A' ' 99' ' ' LEU . 7.0 mt-30 -71.49 -26.81 62.84 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.1 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -61.35 -35.76 78.32 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 173.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -126.47 27.71 6.1 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.338 0.655 . . . . 0.0 112.215 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -166.09 172.19 11.61 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.157 0.983 . . . . 0.0 110.643 172.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.1 pp -117.48 142.82 31.0 Favored Pre-proline 0 N--CA 1.484 1.272 0 C-N-CA 123.081 0.553 . . . . 0.0 110.515 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.501 ' HB2' HD13 ' A' ' 123' ' ' LEU . 51.6 Cg_endo -66.4 129.93 22.6 Favored 'Trans proline' 0 C--N 1.376 1.997 0 C-N-CA 122.293 1.995 . . . . 0.0 111.803 177.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.5 p -85.93 53.58 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.642 0 CA-C-O 123.478 1.609 . . . . 0.0 111.807 -173.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.501 HD13 ' HB2' ' A' ' 121' ' ' PRO . 10.3 mp -90.1 82.63 6.06 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.05 173.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.21 34.68 4.73 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.839 0.856 . . . . 0.0 112.007 -174.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -132.08 90.34 2.8 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 121.719 0.771 . . . . 0.0 111.346 -177.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -91.85 -175.96 4.29 Favored 'General case' 0 CA--C 1.576 1.944 0 C-N-CA 124.141 0.976 . . . . 0.0 110.327 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 27.7 m80 66.53 41.82 3.02 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 124.712 1.205 . . . . 0.0 112.188 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 -132.25 96.46 3.88 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.728 0.811 . . . . 0.0 110.345 173.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 21.1 p-80 -77.28 90.81 3.75 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 170.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 66.4 m80 . . . . . 0 CA--C 1.569 1.678 0 C-N-CA 124.322 1.049 . . . . 0.0 110.872 -171.237 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.402 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 110.858 -0.053 . . . . 0.0 110.858 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.87 118.44 7.55 Favored Glycine 0 CA--C 1.534 1.253 0 N-CA-C 112.146 -0.382 . . . . 0.0 112.146 174.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -96.13 130.9 43.05 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.57 0.748 . . . . 0.0 111.868 -175.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -118.76 -165.25 13.17 Favored Glycine 0 N--CA 1.477 1.391 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.285 173.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -160.17 138.64 10.3 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.861 0.464 . . . . 0.0 111.777 179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -81.25 148.97 29.21 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.972 0.509 . . . . 0.0 110.658 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 m -65.89 -18.82 24.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 C-N-CA 123.726 0.81 . . . . 0.0 112.147 -177.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 78.7 mt -73.1 -49.45 28.39 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.759 1.224 . . . . 0.0 112.429 -166.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 175.4 -96.97 0.11 Allowed Glycine 0 N--CA 1.475 1.253 0 CA-C-N 116.836 -0.165 . . . . 0.0 113.039 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -130.79 143.75 50.96 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.585 0.754 . . . . 0.0 111.735 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -165.29 49.4 0.1 Allowed 'General case' 0 CA--C 1.558 1.278 0 CA-C-O 122.38 1.086 . . . . 0.0 108.515 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.64 HD23 ' H ' ' A' ' 12' ' ' LEU . 2.1 pt? -90.34 32.16 0.96 Allowed 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.59 -171.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -79.72 69.37 6.02 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-O 121.708 0.766 . . . . 0.0 110.396 174.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.468 HG23 ' HD2' ' A' ' 28' ' ' PHE . 6.7 p -158.09 120.76 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 124.181 0.992 . . . . 0.0 110.247 -177.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.673 ' H ' ' HB2' ' A' ' 28' ' ' PHE . 61.9 m -67.83 -59.63 3.15 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.388 0.675 . . . . 0.0 110.933 175.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.5 t 61.46 -173.18 0.14 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.39 1.076 . . . . 0.0 112.344 176.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.8 t 71.66 -67.62 0.25 Allowed 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 125.391 1.476 . . . . 0.0 113.973 170.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.61 138.82 76.42 Favored Pre-proline 0 CA--C 1.564 1.507 0 C-N-CA 123.964 0.906 . . . . 0.0 112.764 -178.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.12 -35.24 76.6 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 122.974 2.449 . . . . 0.0 113.875 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 23.6 ttt -73.35 -12.02 60.68 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 122.98 0.512 . . . . 0.0 111.861 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.0 m -63.25 -22.36 66.82 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.035 0.534 . . . . 0.0 111.241 174.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.69 -84.22 1.23 Allowed Glycine 0 C--N 1.352 1.422 0 CA-C-O 119.986 -0.341 . . . . 0.0 112.672 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 36.9 t90 -172.49 -71.73 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.682 0.793 . . . . 0.0 110.664 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -160.82 99.28 1.24 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.976 0.91 . . . . 0.0 108.884 -176.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -91.66 -70.02 0.71 Allowed 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.349 0.66 . . . . 0.0 110.36 -176.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -162.7 44.24 0.13 Allowed 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.479 0.712 . . . . 0.0 109.182 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 70.35 102.11 0.04 OUTLIER Glycine 0 C--N 1.354 1.557 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.81 -173.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.673 ' HB2' ' H ' ' A' ' 15' ' ' CYS . 46.3 m-85 -75.9 81.8 2.8 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.155 0.582 . . . . 0.0 111.226 -172.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 60.2 m -63.92 -71.93 0.16 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 122.614 0.365 . . . . 0.0 110.217 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 72.09 -39.8 0.46 Allowed 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 125.426 1.49 . . . . 0.0 114.438 171.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.669 ' HA ' HG21 ' A' ' 40' ' ' THR . 5.7 t -61.6 104.57 0.44 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.334 1.054 . . . . 0.0 112.658 -176.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.405 ' HB3' ' O ' ' A' ' 35' ' ' ASP . 13.9 m-20 -63.65 -31.44 72.61 Favored 'General case' 0 N--CA 1.478 0.925 0 CA-C-N 115.203 -0.908 . . . . 0.0 112.52 177.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 57.3 t 65.75 -70.13 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.386 0 C-N-CA 125.364 1.466 . . . . 0.0 110.88 -173.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -146.76 -2.64 0.63 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.405 ' O ' ' HB3' ' A' ' 32' ' ' ASP . 27.8 m-20 -109.63 160.93 15.86 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -174.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 53.81 -87.76 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 125.306 1.442 . . . . 0.0 113.42 178.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.651 ' HA3' ' HD3' ' A' ' 108' ' ' ARG . . . 112.33 92.22 2.03 Favored Glycine 0 C--N 1.351 1.38 0 N-CA-C 110.686 -0.965 . . . . 0.0 110.686 -165.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.8 t -118.72 -60.72 1.74 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.878 0.871 . . . . 0.0 111.929 -170.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.1 t60 -170.46 60.25 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 120.832 0.348 . . . . 0.0 111.684 -176.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.669 HG21 ' HA ' ' A' ' 31' ' ' THR . 26.1 p -140.48 103.07 4.47 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.261 -0.899 . . . . 0.0 111.778 177.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 31.6 t -136.8 107.45 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 C-N-CA 124.659 1.184 . . . . 0.0 109.102 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 93.5 m -113.28 110.72 20.84 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.702 -0.624 . . . . 0.0 111.271 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.54 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -139.12 149.9 45.04 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.934 1.294 . . . . 0.0 108.392 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.591 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 22.1 tt0 -121.53 114.88 21.84 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.139 0.495 . . . . 0.0 111.447 -178.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.433 ' HB2' HD11 ' A' ' 50' ' ' LEU . 72.2 mmm -89.0 142.82 27.31 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.216 1.006 . . . . 0.0 111.205 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 51.9 p -86.58 151.3 23.57 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.059 0.544 . . . . 0.0 109.641 178.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -54.87 -33.49 61.93 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 123.218 0.607 . . . . 0.0 112.465 -174.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -49.12 -46.95 45.71 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 125.231 1.412 . . . . 0.0 111.911 174.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -77.89 -33.99 51.7 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.433 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.2 mp -71.25 -31.79 67.95 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 120.869 0.366 . . . . 0.0 110.448 174.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 48.7 mt -75.54 -29.9 59.56 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.028 0.931 . . . . 0.0 111.52 174.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -65.03 -49.28 70.77 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.3 t -57.6 -42.9 84.14 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.563 0.745 . . . . 0.0 110.805 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -60.75 -46.67 89.54 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.063 0.945 . . . . 0.0 111.349 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -68.94 -32.67 72.45 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.553 0.741 . . . . 0.0 111.71 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -64.06 -34.01 77.05 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.726 0.81 . . . . 0.0 111.295 -177.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 150.61 51.81 0.02 OUTLIER Glycine 0 N--CA 1.478 1.493 0 CA-C-N 116.343 -0.39 . . . . 0.0 112.676 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -154.37 169.28 24.08 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.403 0.681 . . . . 0.0 110.402 -173.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -162.42 142.95 9.99 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.878 0.471 . . . . 0.0 110.629 171.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.2 tp -175.98 -54.99 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.506 1.122 . . . . 0.0 109.812 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 8.1 tmm? -76.7 91.71 3.48 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.913 -177.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.7 p -135.69 137.4 25.6 Favored Pre-proline 0 N--CA 1.487 1.394 0 C-N-CA 124.32 1.048 . . . . 0.0 110.488 178.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -71.02 92.08 0.64 Allowed 'Trans proline' 0 C--N 1.381 2.261 0 C-N-CA 122.809 2.339 . . . . 0.0 112.56 175.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -117.07 87.91 24.74 Favored Pre-proline 0 N--CA 1.482 1.164 0 C-N-CA 124.105 0.962 . . . . 0.0 109.78 176.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -68.06 -27.42 35.97 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.725 2.283 . . . . 0.0 114.073 -172.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -70.31 -34.76 73.09 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.181 0.592 . . . . 0.0 111.69 -177.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -107.01 -56.41 2.2 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.395 0.678 . . . . 0.0 111.006 -177.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 60.1 84.53 0.12 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.909 1.284 . . . . 0.0 111.998 174.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -92.25 114.25 61.66 Favored Pre-proline 0 N--CA 1.482 1.16 0 C-N-CA 122.931 0.492 . . . . 0.0 111.201 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.54 81.96 2.61 Favored 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 122.795 2.33 . . . . 0.0 112.939 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -106.8 30.38 9.51 Favored Glycine 0 N--CA 1.481 1.661 0 CA-C-N 116.085 -0.507 . . . . 0.0 113.16 176.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.8 tt 60.67 104.56 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 125.176 1.39 . . . . 0.0 110.91 -174.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.0 ptpp? -112.83 -171.84 1.94 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 122.972 0.509 . . . . 0.0 110.835 -177.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.39 116.34 3.87 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.345 0.658 . . . . 0.0 111.558 176.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.49 22.31 14.73 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 114.164 0.425 . . . . 0.0 114.164 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -114.45 96.22 5.65 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.199 0.599 . . . . 0.0 110.129 169.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.591 ' HB2' ' HB2' ' A' ' 44' ' ' GLU . 56.2 ttp180 -92.26 85.8 5.54 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 174.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 6.7 m-90 -167.4 119.48 0.91 Allowed 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 124.195 0.998 . . . . 0.0 109.071 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 31.1 p 44.93 33.76 1.08 Allowed 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.651 1.18 . . . . 0.0 113.143 175.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.54 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.0 tm? -63.28 118.08 7.51 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.161 0.984 . . . . 0.0 110.117 -176.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 41.4 t -53.1 119.22 4.45 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.593 0.757 . . . . 0.0 110.552 175.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.66 -31.59 26.17 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.834 0.853 . . . . 0.0 112.848 -174.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 73.1 m -57.27 -36.89 71.57 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 176.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.436 ' HG2' HD21 ' A' ' 80' ' ' LEU . 11.3 tpp180 -59.83 -53.35 58.94 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.194 0.597 . . . . 0.0 111.83 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.533 ' CD1' HG21 ' A' ' 110' ' ' VAL . 2.8 t-105 -75.26 -51.51 13.11 Favored 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 123.597 0.759 . . . . 0.0 111.007 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.588 ' HB2' HG23 ' A' ' 110' ' ' VAL . 47.0 tp60 -61.65 -42.25 98.64 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.603 0.761 . . . . 0.0 112.928 -172.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -69.86 -30.37 67.82 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 117.706 0.23 . . . . 0.0 111.594 -178.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.99 -34.85 78.41 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 122.92 0.488 . . . . 0.0 110.755 170.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.608 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 80.6 t80 -72.55 -43.49 63.39 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.998 0.919 . . . . 0.0 111.462 176.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 86' ' ' GLN . 49.8 mt-10 -66.52 -38.27 86.84 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.858 0.863 . . . . 0.0 111.404 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.13 -20.41 62.32 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.751 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 122.94 -20.87 7.57 Favored Glycine 0 C--N 1.357 1.738 0 N-CA-C 115.179 0.831 . . . . 0.0 115.179 170.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -81.76 -79.97 0.16 Allowed 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 117.721 0.761 . . . . 0.0 111.751 -171.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.608 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 65.91 124.51 0.03 OUTLIER Pre-proline 0 N--CA 1.499 1.999 0 C-N-CA 125.022 1.329 . . . . 0.0 114.409 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -77.39 172.08 16.55 Favored 'Trans proline' 0 CA--C 1.567 2.14 0 C-N-CA 122.959 2.439 . . . . 0.0 113.011 172.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.35 108.27 2.16 Favored 'Trans proline' 0 CA--C 1.565 2.058 0 C-N-CA 122.106 1.87 . . . . 0.0 112.324 169.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.6 p -96.65 151.14 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 123.576 0.75 . . . . 0.0 110.633 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.6 HG21 ' HB3' ' A' ' 101' ' ' SER . 19.2 m -75.84 162.75 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 CA-C-O 121.559 0.695 . . . . 0.0 111.637 173.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 96.3 mt -118.9 -9.42 10.1 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.782 0.833 . . . . 0.0 110.631 168.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -87.15 -47.57 8.77 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.95 0.9 . . . . 0.0 110.341 -171.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.6 ' HB3' HG21 ' A' ' 98' ' ' VAL . 42.3 t -85.71 -32.48 21.9 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.969 179.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 19.4 m -59.61 114.6 2.81 Favored 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 122.657 0.383 . . . . 0.0 111.64 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -79.34 168.24 19.78 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.552 0.741 . . . . 0.0 112.864 -173.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -67.96 -25.23 65.34 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.998 0.919 . . . . 0.0 112.146 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 43.7 t -62.4 -32.98 73.89 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 122.664 0.386 . . . . 0.0 111.633 177.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.16 -34.89 70.79 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.707 0.803 . . . . 0.0 112.057 174.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.6 ' HG ' ' HB2' ' A' ' 112' ' ' LEU . 6.9 mp -64.57 -10.26 24.9 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.937 0.895 . . . . 0.0 113.388 -175.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.651 ' HD3' ' HA3' ' A' ' 37' ' ' GLY . 65.0 mtp85 -94.78 -28.5 15.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.494 0.717 . . . . 0.0 111.927 173.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -96.47 -53.81 3.47 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.145 0.578 . . . . 0.0 111.148 -173.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.588 HG23 ' HB2' ' A' ' 86' ' ' GLN . 14.0 p -100.13 -24.06 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 C-N-CA 123.91 0.884 . . . . 0.0 111.567 -178.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 43.4 t 69.53 147.32 0.06 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.102 1.361 . . . . 0.0 112.636 -173.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.6 ' HB2' ' HG ' ' A' ' 107' ' ' LEU . 5.8 tt -61.23 -40.78 95.28 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.168 178.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.17 -38.81 84.33 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.138 0.575 . . . . 0.0 112.127 -172.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -69.12 -33.19 73.07 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.524 0.729 . . . . 0.0 111.036 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.516 HD23 ' HE1' ' A' ' 85' ' ' TRP . 39.9 mt -66.03 -55.82 14.72 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 121.95 0.881 . . . . 0.0 109.916 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.661 ' HB3' ' HA ' ' A' ' 122' ' ' VAL . 13.0 mt-30 -68.55 -24.77 64.67 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 113.896 -1.502 . . . . 0.0 113.146 -173.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.53 -23.36 64.52 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 113.151 0.796 . . . . 0.0 113.151 175.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 11.1 m80 -116.53 -16.56 10.77 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 123.303 0.641 . . . . 0.0 112.57 174.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.03 167.82 18.45 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.659 0.384 . . . . 0.0 110.419 170.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.527 ' HB3' ' HD3' ' A' ' 121' ' ' PRO . 0.2 OUTLIER -67.83 -60.81 4.92 Favored Pre-proline 0 CA--C 1.584 2.286 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -174.223 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.527 ' HD3' ' HB3' ' A' ' 120' ' ' LEU . 40.9 Cg_endo -86.34 86.36 0.9 Allowed 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 122.952 2.435 . . . . 0.0 113.796 -173.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.661 ' HA ' ' HB3' ' A' ' 116' ' ' GLN . 6.5 p -79.92 136.3 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.223 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.792 174.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tt -140.29 136.85 33.69 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.891 0.876 . . . . 0.0 109.551 -173.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -76.97 138.89 39.92 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.056 0.942 . . . . 0.0 112.724 -175.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 22.4 m-70 -129.29 179.41 5.8 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.596 1.158 . . . . 0.0 110.681 175.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -105.47 -166.28 1.2 Allowed 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.955 0.902 . . . . 0.0 111.641 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -67.53 135.72 53.44 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.661 0.784 . . . . 0.0 111.959 -175.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 28.0 p80 -128.82 141.89 51.15 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.836 0.854 . . . . 0.0 110.235 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -169.15 166.11 10.89 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.715 0.806 . . . . 0.0 110.263 -176.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 51.0 t-80 . . . . . 0 N--CA 1.489 1.486 0 C-N-CA 125.089 1.356 . . . . 0.0 111.401 173.144 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.1 mtm . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 120.444 0.164 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.96 -161.92 44.2 Favored Glycine 0 C--N 1.351 1.385 0 CA-C-N 116.432 -0.349 . . . . 0.0 113.557 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -168.69 -179.47 3.81 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.587 0.755 . . . . 0.0 110.95 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -125.56 -155.32 8.98 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.295 172.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -89.11 129.14 35.77 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.507 0.723 . . . . 0.0 109.872 177.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -120.77 -173.07 2.51 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.273 0.629 . . . . 0.0 111.309 -175.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 16.9 t -92.13 35.82 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.802 0 C-N-CA 124.461 1.105 . . . . 0.0 111.36 -170.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -80.2 -14.1 58.71 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 121.393 -0.817 . . . . 0.0 112.819 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.14 70.13 0.46 Allowed Glycine 0 N--CA 1.482 1.71 0 N-CA-C 114.375 0.51 . . . . 0.0 114.375 -171.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -144.88 -168.3 2.89 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.744 0.817 . . . . 0.0 110.713 179.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 t70 70.15 -176.67 0.2 Allowed 'General case' 0 CA--C 1.564 1.504 0 C-N-CA 124.886 1.275 . . . . 0.0 112.073 170.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 89.0 mt -64.1 126.04 26.44 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.748 0.819 . . . . 0.0 112.219 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.9 -153.96 0.41 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 124.198 0.999 . . . . 0.0 110.053 176.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.486 HG13 ' HB ' ' A' ' 21' ' ' THR . 6.4 p -87.74 129.01 39.76 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.416 0 O-C-N 121.88 -0.513 . . . . 0.0 110.566 167.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 48.2 t -123.22 10.06 9.28 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.379 0.672 . . . . 0.0 110.953 170.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.607 ' HB2' ' HA ' ' A' ' 28' ' ' PHE . 42.0 t -69.71 140.07 53.47 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.13 0.572 . . . . 0.0 111.358 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 65.4 m 62.2 53.54 2.87 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.307 1.043 . . . . 0.0 110.759 -175.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 72.32 159.73 0.16 Allowed Pre-proline 0 N--CA 1.49 1.534 0 C-N-CA 125.41 1.484 . . . . 0.0 113.101 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -49.69 -7.11 0.08 OUTLIER 'Trans proline' 0 C--N 1.382 2.317 0 C-N-CA 123.8 3.0 . . . . 0.0 116.369 167.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 33.6 ttm -74.33 65.41 1.21 Allowed 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 123.886 0.874 . . . . 0.0 110.635 174.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.486 ' HB ' HG13 ' A' ' 14' ' ' VAL . 45.3 p -135.1 155.65 50.36 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.228 1.011 . . . . 0.0 111.224 -173.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -94.02 -104.71 1.8 Allowed Glycine 0 CA--C 1.526 0.739 0 N-CA-C 111.454 -0.658 . . . . 0.0 111.454 172.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 74.4 t90 -153.17 110.1 3.45 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.135 0.574 . . . . 0.0 109.561 177.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -132.78 146.66 52.03 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.924 0.889 . . . . 0.0 110.638 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 -74.83 120.96 21.09 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.504 0.722 . . . . 0.0 110.642 177.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 65.58 -2.52 0.83 Allowed 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 124.329 1.052 . . . . 0.0 113.738 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.83 -22.92 28.34 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 115.522 0.969 . . . . 0.0 115.522 -170.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.607 ' HA ' ' HB2' ' A' ' 16' ' ' CYS . 85.0 t80 -71.86 -51.99 19.62 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.47 0.708 . . . . 0.0 111.445 173.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 69.9 m -95.31 -174.0 3.08 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 123.783 0.833 . . . . 0.0 112.088 -179.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -130.11 126.22 37.03 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.02 0.928 . . . . 0.0 109.575 170.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 50.2 m -86.09 98.0 10.62 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 121.45 0.643 . . . . 0.0 110.004 176.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -94.59 29.4 2.3 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.591 0.756 . . . . 0.0 111.927 -179.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t 63.12 -76.63 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 C-N-CA 124.574 1.15 . . . . 0.0 111.116 -173.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -150.42 -3.34 0.36 Allowed 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 124.226 1.01 . . . . 0.0 111.206 177.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -70.96 -30.93 67.36 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.545 1.138 . . . . 0.0 112.733 -173.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 61.99 98.86 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 124.658 1.183 . . . . 0.0 111.777 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.57 68.23 1.49 Allowed Glycine 0 N--CA 1.473 1.103 0 CA-C-N 116.526 -0.306 . . . . 0.0 112.663 -175.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.8 t -135.09 -167.35 1.98 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.972 0.909 . . . . 0.0 109.833 -176.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 28.9 p-80 -142.78 125.69 16.16 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 121.932 -0.48 . . . . 0.0 110.894 177.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.497 HG23 ' HG2' ' A' ' 103' ' ' GLU . 3.5 t -140.2 135.21 32.16 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.396 1.078 . . . . 0.0 109.452 174.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.758 HG21 ' HB2' ' A' ' 82' ' ' ALA . 40.1 t -120.89 111.27 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 123.189 0.596 . . . . 0.0 110.329 -175.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 82.5 m -105.97 107.54 18.6 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.58 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.6 151.31 41.38 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.911 0.884 . . . . 0.0 109.272 -176.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -126.95 115.3 19.05 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 122.458 0.303 . . . . 0.0 110.244 -173.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 63.9 mmm -98.91 152.77 19.4 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.217 0.607 . . . . 0.0 111.671 -174.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.679 HG22 ' HB3' ' A' ' 95' ' ' PRO . 6.8 t -89.11 157.48 18.29 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.468 0.707 . . . . 0.0 110.635 175.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 61.2 tt0 -53.57 -32.18 49.8 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.897 0.879 . . . . 0.0 112.419 -177.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -51.4 -44.88 62.32 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.143 0.977 . . . . 0.0 111.456 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -74.31 -47.42 34.77 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 177.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.419 ' HG ' ' HA ' ' A' ' 73' ' ' LYS . 2.4 mm? -65.28 -32.88 74.76 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.294 0.497 . . . . 0.0 111.543 -174.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.6 mt -76.63 -31.85 57.65 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.118 0.567 . . . . 0.0 112.139 173.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -57.62 -48.77 78.53 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 123.053 0.541 . . . . 0.0 110.666 171.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 37.4 t -69.73 -43.64 71.92 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.601 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -74.38 -33.54 63.08 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -173.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -63.86 -33.32 75.42 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.994 0.518 . . . . 0.0 111.488 -178.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -157.69 90.4 1.08 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.58 0.752 . . . . 0.0 109.411 177.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 148.15 -101.49 0.23 Allowed Glycine 0 N--CA 1.479 1.539 0 CA-C-N 116.579 -0.282 . . . . 0.0 113.711 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -113.67 125.9 54.65 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.88 0.872 . . . . 0.0 110.765 -174.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -59.81 -66.21 0.55 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 122.935 0.494 . . . . 0.0 111.7 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.564 HD11 ' HD3' ' A' ' 84' ' ' ARG . 69.0 mt 72.47 -48.36 0.68 Allowed 'General case' 0 N--CA 1.5 2.062 0 C-N-CA 125.783 1.633 . . . . 0.0 114.474 175.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 82.6 mtp -56.24 -66.59 0.41 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.742 1.217 . . . . 0.0 113.448 -161.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.1 m -146.92 90.13 5.5 Favored Pre-proline 0 N--CA 1.482 1.171 0 C-N-CA 122.668 0.387 . . . . 0.0 110.96 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -85.71 -174.52 1.62 Allowed 'Trans proline' 0 CA--C 1.556 1.587 0 C-N-CA 123.208 2.605 . . . . 0.0 111.466 163.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.47 ' HD2' ' HA ' ' A' ' 67' ' ' PHE . 12.7 ttp180 -158.14 107.26 1.72 Allowed Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 122.226 0.21 . . . . 0.0 111.185 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -78.09 -37.32 0.83 Allowed 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 122.706 2.271 . . . . 0.0 113.064 175.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -129.46 -77.55 0.55 Allowed 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.837 0.855 . . . . 0.0 109.505 -176.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.47 ' HA ' ' HD2' ' A' ' 64' ' ' ARG . 79.2 t80 -156.66 -70.46 0.1 Allowed 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.521 0.728 . . . . 0.0 110.016 175.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -86.19 76.96 9.66 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.111 0.565 . . . . 0.0 110.898 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -171.88 106.29 0.37 Allowed Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 123.747 0.819 . . . . 0.0 110.096 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -91.36 -160.22 0.09 OUTLIER 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 123.098 2.532 . . . . 0.0 112.447 171.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -117.4 -103.09 2.23 Favored Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.244 -0.342 . . . . 0.0 112.244 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -159.35 118.49 2.93 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.833 0.853 . . . . 0.0 110.245 -176.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.419 ' HA ' ' HG ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -130.0 -161.35 1.11 Allowed 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.078 0.551 . . . . 0.0 111.06 -176.165 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.56 118.24 6.78 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.643 0.777 . . . . 0.0 113.036 -174.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 79.23 35.99 28.6 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-N 115.085 -0.961 . . . . 0.0 113.347 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -118.31 98.9 6.52 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.506 0.723 . . . . 0.0 111.216 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -76.74 87.39 3.36 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 166.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -175.39 127.17 0.26 Allowed 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.944 -173.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 39.4 t 59.12 16.09 4.56 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.859 1.264 . . . . 0.0 113.776 171.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.58 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -75.05 108.83 8.04 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -175.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 62.2 m -65.1 135.31 55.37 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.449 0.7 . . . . 0.0 111.14 178.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.758 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -51.32 -49.37 61.48 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.187 0.995 . . . . 0.0 113.31 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.6 m -57.3 -29.52 63.98 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.931 0.892 . . . . 0.0 112.943 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.564 ' HD3' HD11 ' A' ' 60' ' ' LEU . 0.8 OUTLIER -70.06 -51.55 31.03 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.431 0.692 . . . . 0.0 110.767 -177.174 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 3.8 t-105 -62.93 -41.32 99.45 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 123.665 0.786 . . . . 0.0 110.802 172.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.409 ' HA ' HE21 ' A' ' 86' ' ' GLN . 0.0 OUTLIER -58.52 -41.77 86.18 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.374 1.069 . . . . 0.0 111.997 -176.357 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -62.43 -37.33 85.43 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.722 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.7 -39.01 89.94 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.285 0.634 . . . . 0.0 111.65 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.565 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 75.4 t80 -68.23 -51.82 41.05 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.1 0.56 . . . . 0.0 111.23 175.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.86 -19.15 65.68 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.438 0.695 . . . . 0.0 112.42 -174.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.85 -26.97 21.35 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 123.153 0.581 . . . . 0.0 111.529 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 129.18 -21.76 5.15 Favored Glycine 0 N--CA 1.482 1.751 0 N-CA-C 115.697 1.039 . . . . 0.0 115.697 171.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -72.42 -67.89 0.51 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 118.17 0.985 . . . . 0.0 111.456 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.565 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 54.87 81.07 0.27 Allowed Pre-proline 0 CA--C 1.564 1.496 0 C-N-CA 124.641 1.176 . . . . 0.0 113.139 -177.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.679 ' HB3' HG22 ' A' ' 46' ' ' THR . 93.9 Cg_exo -53.4 163.95 2.26 Favored 'Trans proline' 0 N--CA 1.504 2.105 0 C-N-CA 124.352 3.368 . . . . 0.0 115.804 173.418 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -63.86 103.53 0.42 Allowed 'Trans proline' 0 C--N 1.384 2.429 0 C-N-CA 122.927 2.418 . . . . 0.0 112.667 174.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.6 p -94.26 138.01 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 123.299 0.64 . . . . 0.0 109.949 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 7.5 p -79.13 89.11 1.3 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-O 121.852 0.834 . . . . 0.0 112.862 -171.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.461 HD21 ' HB3' ' A' ' 115' ' ' LEU . 2.8 mm? -60.65 -34.37 74.2 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 124.628 1.171 . . . . 0.0 113.544 -177.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -71.33 -12.24 61.33 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 179.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 50.4 m -128.54 -7.11 5.18 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.248 0.619 . . . . 0.0 112.576 -176.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 99.5 m -72.62 120.96 18.97 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 122.552 0.341 . . . . 0.0 110.156 175.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.592 ' HG3' ' H ' ' A' ' 105' ' ' SER . 13.8 tp10 -64.55 149.71 48.21 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 123.131 0.572 . . . . 0.0 111.587 178.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -68.0 -34.18 76.02 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.369 0.667 . . . . 0.0 110.865 177.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.592 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 84.9 p -61.96 -23.86 66.64 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 122.902 0.481 . . . . 0.0 111.987 175.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.02 -36.06 74.33 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.044 0.538 . . . . 0.0 112.356 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.1 mp -55.73 -13.7 1.85 Allowed 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 124.978 1.311 . . . . 0.0 113.431 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -61.95 -34.48 76.2 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.422 1.089 . . . . 0.0 112.376 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -109.76 -21.82 12.21 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.578 1.151 . . . . 0.0 110.247 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.461 HG11 HD21 ' A' ' 115' ' ' LEU . 48.7 t -109.67 -51.67 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 CA-C-N 114.048 -1.433 . . . . 0.0 112.715 -159.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 26.6 m 71.26 140.86 0.05 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 125.746 1.618 . . . . 0.0 112.79 -168.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.42 -39.8 92.1 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.274 1.03 . . . . 0.0 113.372 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -59.6 -32.5 70.45 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.86 0.464 . . . . 0.0 111.73 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.89 -36.95 85.01 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 124.382 1.073 . . . . 0.0 111.185 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.461 ' HB3' HD21 ' A' ' 99' ' ' LEU . 71.5 mt -75.0 -51.58 13.24 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.637 1.175 . . . . 0.0 110.874 -177.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -70.78 -23.06 62.33 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 114.4 -1.273 . . . . 0.0 112.321 -175.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -50.07 -28.68 7.5 Favored 'General case' 0 CA--C 1.562 1.412 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 171.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -128.73 22.63 5.85 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.507 0.723 . . . . 0.0 112.261 175.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -144.23 -164.37 1.88 Allowed 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.239 0.615 . . . . 0.0 110.577 174.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.457 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 4.3 mm? -72.07 134.18 83.28 Favored Pre-proline 0 CA--C 1.56 1.331 0 O-C-N 122.136 -0.352 . . . . 0.0 111.64 177.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 120' ' ' LEU . 36.8 Cg_endo -88.6 164.69 6.42 Favored 'Trans proline' 0 C--N 1.375 1.922 0 C-N-CA 123.348 2.698 . . . . 0.0 113.81 -175.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 4.1 p -79.84 109.84 14.83 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 CA-C-O 121.896 0.855 . . . . 0.0 112.167 -175.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.0 tt -67.03 152.73 45.25 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.894 0.878 . . . . 0.0 108.817 168.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.89 142.14 51.11 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.441 -0.787 . . . . 0.0 111.357 178.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -101.42 -41.42 6.66 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.485 0.714 . . . . 0.0 111.269 175.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 66.1 m-70 -114.4 90.94 3.46 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 122.779 0.431 . . . . 0.0 111.186 177.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 -80.48 -15.8 55.85 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 120.899 0.38 . . . . 0.0 110.54 172.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -110.83 167.71 10.03 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.148 0.979 . . . . 0.0 111.316 176.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -151.26 168.2 25.46 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.531 0.733 . . . . 0.0 111.836 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 . . . . . 0 N--CA 1.492 1.634 0 C-N-CA 123.622 0.769 . . . . 0.0 112.498 173.988 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.1 mtp . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 120.681 0.277 . . . . 0.0 111.563 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 66.13 46.66 78.58 Favored Glycine 0 C--N 1.353 1.504 0 CA-C-N 116.044 -0.525 . . . . 0.0 114.208 175.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.9 tp60 -123.26 98.97 6.11 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.597 0.759 . . . . 0.0 110.511 179.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.21 -174.69 42.14 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-N 115.97 -0.559 . . . . 0.0 113.028 174.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -90.38 140.48 29.67 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.101 0.56 . . . . 0.0 111.117 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -110.33 154.84 22.93 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.011 0.924 . . . . 0.0 110.16 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 m -66.45 -26.25 37.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-O 121.769 0.795 . . . . 0.0 110.804 177.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 80.3 mt -73.72 -19.35 60.83 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-N 114.28 -1.327 . . . . 0.0 112.02 -177.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.97 -14.14 80.43 Favored Glycine 0 CA--C 1.541 1.703 0 CA-C-N 115.553 -0.749 . . . . 0.0 114.47 177.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -153.04 127.44 9.26 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 117.661 0.73 . . . . 0.0 111.378 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -165.79 177.58 7.12 Favored 'General case' 0 CA--C 1.565 1.555 0 C-N-CA 123.649 0.779 . . . . 0.0 110.381 -177.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.7 mp -56.42 130.06 43.25 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 124.066 0.946 . . . . 0.0 111.945 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.99 -177.89 6.15 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.161 0.984 . . . . 0.0 111.753 -178.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.5 p -68.17 134.73 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.337 0 CA-C-O 121.327 0.584 . . . . 0.0 111.975 -179.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.542 ' SG ' ' HA3' ' A' ' 27' ' ' GLY . 78.0 m -84.75 -55.99 3.82 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.554 0.742 . . . . 0.0 110.333 176.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.548 ' H ' ' HB2' ' A' ' 28' ' ' PHE . 53.7 t 75.83 -43.34 0.48 Allowed 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 170.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 52.3 t -61.5 -42.92 99.53 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.556 0.742 . . . . 0.0 112.867 -173.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -108.88 138.69 20.4 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 123.106 0.562 . . . . 0.0 110.48 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.39 -53.19 2.54 Favored 'Trans proline' 0 C--N 1.381 2.238 0 C-N-CA 122.752 2.301 . . . . 0.0 112.661 174.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 57.0 mtt -83.22 88.43 6.92 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.44 0.696 . . . . 0.0 110.519 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 37.6 p -129.98 77.8 1.81 Allowed 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.758 0.823 . . . . 0.0 109.88 178.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.45 -42.4 3.15 Favored Glycine 0 CA--C 1.535 1.294 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.693 -176.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 15.0 t90 79.76 -42.85 0.26 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 125.894 1.678 . . . . 0.0 112.245 174.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -84.52 52.59 2.41 Favored 'General case' 0 CA--C 1.572 1.811 0 C-N-CA 124.436 1.094 . . . . 0.0 110.248 174.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HG3' ' SG ' ' A' ' 29' ' ' CYS . 9.3 ttp180 52.97 49.73 19.54 Favored 'General case' 0 CA--C 1.569 1.682 0 C-N-CA 125.502 1.521 . . . . 0.0 113.191 177.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -77.32 -47.94 18.69 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.205 0.526 . . . . 0.0 110.384 172.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.542 ' HA3' ' SG ' ' A' ' 15' ' ' CYS . . . -137.74 -71.52 0.05 OUTLIER Glycine 0 C--N 1.342 0.915 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.595 175.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.548 ' HB2' ' H ' ' A' ' 16' ' ' CYS . 87.9 t80 -101.71 137.16 40.39 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.599 0.76 . . . . 0.0 110.074 177.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.552 ' SG ' ' HG3' ' A' ' 25' ' ' ARG . 26.2 p -159.03 155.11 26.86 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.63 0.772 . . . . 0.0 110.713 176.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -84.93 71.16 10.94 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.949 0.5 . . . . 0.0 110.455 177.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.462 HG23 ' H ' ' A' ' 32' ' ' ASP . 4.8 t -174.85 -65.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.545 1.138 . . . . 0.0 110.014 174.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.462 ' H ' HG23 ' A' ' 31' ' ' THR . 1.9 m-20 -106.54 120.31 41.6 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.867 0.867 . . . . 0.0 110.007 -177.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 34.0 m -75.25 -37.7 39.74 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.148 0 C-N-CA 123.26 0.624 . . . . 0.0 111.237 177.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -179.07 -57.19 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.716 1.206 . . . . 0.0 109.702 -178.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -67.59 155.51 38.97 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.894 0.878 . . . . 0.0 111.725 177.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -59.22 121.91 12.54 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 124.089 0.956 . . . . 0.0 112.3 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -132.3 -93.41 0.56 Allowed Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 175.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 59.6 m 62.04 169.45 0.12 Allowed 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 125.124 1.37 . . . . 0.0 114.035 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.9 m80 58.82 32.22 22.01 Favored 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 124.064 0.945 . . . . 0.0 112.784 -179.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.415 ' O ' ' HB3' ' A' ' 105' ' ' SER . 65.8 p -98.99 116.13 30.51 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.883 1.273 . . . . 0.0 111.938 -176.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.538 HG11 ' HB2' ' A' ' 82' ' ' ALA . 46.5 t -137.89 117.96 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.746 -0.596 . . . . 0.0 111.126 176.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 57.8 m -116.74 108.22 15.62 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 168.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.637 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -137.69 148.23 45.52 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -176.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.5 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 28.0 tt0 -115.49 116.56 28.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.843 0.354 . . . . 0.0 111.77 -171.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 52.5 mmm -103.5 123.41 46.85 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.272 175.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 79.3 p -81.39 167.04 19.87 Favored 'General case' 0 C--O 1.246 0.895 0 C-N-CA 123.13 0.572 . . . . 0.0 110.549 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -58.03 -29.57 65.45 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.382 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -49.64 -56.13 11.17 Favored 'General case' 0 CA--C 1.567 1.622 0 C-N-CA 124.826 1.25 . . . . 0.0 112.377 177.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -70.55 -38.81 74.21 Favored 'General case' 0 N--CA 1.493 1.686 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 176.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.9 mp -66.34 -25.09 66.66 Favored 'General case' 0 CA--C 1.566 1.569 0 O-C-N 122.129 -0.357 . . . . 0.0 111.481 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 39.3 mt -75.13 -35.44 61.68 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.227 1.011 . . . . 0.0 110.555 172.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.449 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 89.6 t80 -60.64 -51.34 69.81 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.95 0.5 . . . . 0.0 110.286 171.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.9 m -58.99 -33.04 70.24 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 124.193 0.997 . . . . 0.0 111.646 177.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.7 ttt180 -61.82 -52.22 65.05 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.758 175.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -74.84 -13.04 60.52 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 5.2 mmp_? -77.46 -13.4 59.93 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 172.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 139.63 7.69 1.01 Allowed Glycine 0 N--CA 1.482 1.739 0 N-CA-C 115.068 0.787 . . . . 0.0 115.068 174.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -117.86 -171.65 2.1 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-N 117.795 0.798 . . . . 0.0 111.614 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.4 p-10 -157.57 86.41 0.93 Allowed 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.983 0.913 . . . . 0.0 109.759 171.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.34 -26.94 60.45 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.635 0.774 . . . . 0.0 111.524 -174.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.51 ' SD ' ' N ' ' A' ' 61' ' ' MET . 0.2 OUTLIER -75.49 -31.27 60.13 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.534 0.734 . . . . 0.0 110.158 173.722 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.2 m 62.86 84.39 0.19 Allowed Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 124.743 1.217 . . . . 0.0 111.647 177.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -85.55 45.96 1.65 Allowed 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 123.577 2.851 . . . . 0.0 110.381 172.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.429 ' HG2' ' H ' ' A' ' 66' ' ' GLU . 10.0 ttm180 -138.7 133.0 16.5 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 114.278 -1.328 . . . . 0.0 109.98 -161.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.83 -23.11 30.85 Favored 'Trans proline' 0 C--N 1.372 1.797 0 C-N-CA 122.662 2.241 . . . . 0.0 113.123 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.429 ' H ' ' HG2' ' A' ' 64' ' ' ARG . 21.0 mm-40 -75.09 156.38 36.12 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.255 0.622 . . . . 0.0 111.573 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -89.57 51.72 2.17 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.766 0.826 . . . . 0.0 112.139 -168.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -92.72 -0.59 57.25 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.523 0.729 . . . . 0.0 112.355 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -70.84 132.29 87.0 Favored Pre-proline 0 CA--C 1.564 1.509 0 C-N-CA 123.495 0.718 . . . . 0.0 112.31 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -79.92 154.54 22.93 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.483 2.122 . . . . 0.0 112.751 172.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.72 -36.65 93.6 Favored Glycine 0 CA--C 1.54 1.599 0 N-CA-C 114.386 0.514 . . . . 0.0 114.386 -178.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -74.56 123.34 24.61 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.303 0.641 . . . . 0.0 110.662 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -99.0 173.69 6.71 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.8 0.84 . . . . 0.0 110.602 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.7 105.56 4.34 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.211 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 108.27 27.66 4.95 Favored Glycine 0 CA--C 1.535 1.333 0 CA-C-N 115.814 -0.63 . . . . 0.0 113.581 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -105.47 111.18 23.79 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.186 0.594 . . . . 0.0 111.237 171.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.5 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 11.9 ptt85 -83.1 88.05 6.9 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 165.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 74.4 t-105 -172.46 121.1 0.42 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.289 -173.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 43.4 t 54.56 19.24 2.32 Favored 'General case' 0 N--CA 1.499 1.978 0 C-N-CA 124.702 1.201 . . . . 0.0 113.708 170.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.637 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -71.4 124.11 23.85 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.36 0.664 . . . . 0.0 109.772 -175.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 52.0 t -62.14 110.5 1.62 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.177 0.591 . . . . 0.0 110.162 174.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.538 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -57.22 -26.7 61.13 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 113.885 1.069 . . . . 0.0 113.885 -171.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 78.6 p -68.64 -30.47 69.19 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.132 0.573 . . . . 0.0 112.228 176.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -72.85 -31.36 64.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.576 0.75 . . . . 0.0 111.027 175.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.528 ' HD1' HG11 ' A' ' 110' ' ' VAL . 8.8 t-105 -67.29 -53.97 24.99 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.259 0.624 . . . . 0.0 110.114 171.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.453 HE21 ' HG3' ' A' ' 90' ' ' GLU . 18.2 tp60 -56.88 -34.97 68.39 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.865 0.866 . . . . 0.0 112.263 177.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -52.41 -39.02 60.44 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.674 0.79 . . . . 0.0 111.826 175.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.06 -36.31 81.75 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.443 0.697 . . . . 0.0 112.727 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -67.42 -46.46 73.1 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 120.913 0.387 . . . . 0.0 110.391 173.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.453 ' HG3' HE21 ' A' ' 86' ' ' GLN . 42.1 mt-10 -66.2 -19.62 65.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.834 0.854 . . . . 0.0 111.827 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.08 -25.77 31.73 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.208 1.003 . . . . 0.0 111.708 171.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 111.17 -12.88 28.8 Favored Glycine 0 CA--C 1.537 1.465 0 CA-C-N 116.235 -0.439 . . . . 0.0 114.052 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 58.8 mtp -89.17 -81.61 0.27 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.725 0.81 . . . . 0.0 111.659 -174.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 59.86 99.5 0.04 OUTLIER Pre-proline 0 CA--C 1.564 1.505 0 C-N-CA 125.184 1.394 . . . . 0.0 114.226 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -57.18 166.47 4.26 Favored 'Trans proline' 0 CA--C 1.567 2.172 0 C-N-CA 124.098 3.199 . . . . 0.0 114.655 171.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.58 129.27 20.81 Favored 'Trans proline' 0 CA--C 1.567 2.144 0 C-N-CA 122.168 1.912 . . . . 0.0 112.996 171.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.8 p -116.61 151.39 18.42 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.158 0 C-N-CA 123.945 0.898 . . . . 0.0 111.096 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.6 m -88.33 97.61 6.94 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 124.262 1.025 . . . . 0.0 113.5 -171.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 22.8 mt -59.97 -24.33 64.33 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.134 -0.979 . . . . 0.0 112.305 172.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -67.81 -32.38 72.89 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 124.144 0.977 . . . . 0.0 112.738 178.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.8 t -115.4 -45.69 2.91 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -174.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.1 m -48.12 112.75 0.62 Allowed 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 123.571 0.748 . . . . 0.0 112.398 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -83.5 175.42 9.81 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -169.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.636 ' HA ' HD13 ' A' ' 107' ' ' LEU . 14.7 mmmm -67.76 -21.09 65.28 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 124.043 0.937 . . . . 0.0 113.197 -175.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.415 ' HB3' ' O ' ' A' ' 40' ' ' THR . 31.3 t -68.54 -29.72 68.36 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 176.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -61.2 -31.19 70.95 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.05 0.54 . . . . 0.0 112.453 176.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.636 HD13 ' HA ' ' A' ' 104' ' ' LYS . 8.1 mp -61.38 -28.03 68.95 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 124.019 0.928 . . . . 0.0 111.935 176.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -74.5 -5.78 44.66 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.889 0.876 . . . . 0.0 112.624 -177.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -120.92 -45.67 2.37 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.031 0.932 . . . . 0.0 110.721 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.528 HG11 ' HD1' ' A' ' 85' ' ' TRP . 0.6 OUTLIER -103.6 -35.38 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 C-N-CA 122.917 0.487 . . . . 0.0 111.9 -172.777 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . 0.406 ' O ' HG23 ' A' ' 110' ' ' VAL . 39.3 t 77.05 134.68 0.06 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.616 1.567 . . . . 0.0 110.849 -166.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 tt -44.93 -28.16 0.63 Allowed 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 124.734 1.214 . . . . 0.0 113.827 -177.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.73 -37.26 70.74 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.613 0.765 . . . . 0.0 113.0 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -72.85 -40.98 65.25 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 120.891 0.377 . . . . 0.0 110.813 177.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.517 HD23 ' HE1' ' A' ' 85' ' ' TRP . 67.7 mt -57.6 -46.46 84.03 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.601 0.76 . . . . 0.0 111.74 177.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -76.06 -34.35 59.59 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.699 0.8 . . . . 0.0 112.409 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -57.72 -28.05 63.52 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.174 0.589 . . . . 0.0 112.435 173.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -126.48 26.62 6.31 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.789 0.836 . . . . 0.0 111.938 -177.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.53 157.2 34.26 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.055 172.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.37 146.64 86.75 Favored Pre-proline 0 CA--C 1.559 1.3 0 C-N-CA 122.691 0.396 . . . . 0.0 111.198 173.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -60.6 117.07 3.8 Favored 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 123.353 2.702 . . . . 0.0 112.593 -176.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 93.8 t 65.85 107.53 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 C-N-CA 124.613 1.165 . . . . 0.0 111.695 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 46.3 tp -72.07 -55.65 6.98 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.058 0.543 . . . . 0.0 110.748 177.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.3 144.25 51.16 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.128 0.971 . . . . 0.0 110.337 -178.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 11.1 p80 -72.69 91.19 1.44 Allowed 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 121.504 0.668 . . . . 0.0 110.618 178.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -68.35 138.16 55.17 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.432 -179.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 7.5 p80 -151.96 134.84 15.62 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.702 1.201 . . . . 0.0 109.294 -170.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 17.7 t60 58.76 38.92 24.73 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.653 0.781 . . . . 0.0 110.559 -177.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 69.76 5.42 5.21 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 125.478 1.511 . . . . 0.0 113.458 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 6.0 p-80 . . . . . 0 CA--C 1.574 1.881 0 C-N-CA 124.099 0.959 . . . . 0.0 111.01 176.348 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.1 mmt . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.598 0.237 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.79 -95.2 2.25 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 116.257 -0.429 . . . . 0.0 112.785 178.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.614 ' HB3' ' HG3' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -70.35 153.91 42.49 Favored 'General case' 0 CA--C 1.565 1.541 0 C-N-CA 124.1 0.96 . . . . 0.0 110.95 -179.283 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.04 -145.81 0.53 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 115.457 0.943 . . . . 0.0 115.457 -173.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -147.9 152.28 37.3 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 122.033 -0.687 . . . . 0.0 111.91 -176.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -109.9 -172.7 2.09 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.669 0.788 . . . . 0.0 111.523 -176.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.6 m -74.55 -6.48 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 C-N-CA 123.716 0.806 . . . . 0.0 112.529 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.5 mt -67.84 -22.14 65.15 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.195 1.398 . . . . 0.0 113.411 -167.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 88.9 -60.98 3.8 Favored Glycine 0 C--N 1.345 1.047 0 N-CA-C 111.652 -0.579 . . . . 0.0 111.652 -176.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -151.76 140.12 20.46 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.995 0.918 . . . . 0.0 109.954 175.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -144.1 163.63 32.99 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.219 0.608 . . . . 0.0 110.397 -172.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.1 tt -153.95 86.93 1.19 Allowed 'General case' 0 CA--C 1.562 1.411 0 CA-C-O 120.849 0.357 . . . . 0.0 110.396 -173.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -97.39 86.63 3.92 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 123.9 0.88 . . . . 0.0 111.089 176.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.559 HG21 ' HB3' ' A' ' 38' ' ' SER . 14.2 p -106.4 157.93 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 C-N-CA 123.668 0.787 . . . . 0.0 112.406 -173.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.2 m -132.89 -51.44 0.9 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.112 0.565 . . . . 0.0 109.509 167.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.417 ' SG ' ' N ' ' A' ' 17' ' ' CYS . 32.9 t 56.07 -172.4 0.07 Allowed 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 124.137 0.975 . . . . 0.0 113.238 175.009 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.417 ' N ' ' SG ' ' A' ' 16' ' ' CYS . 49.9 t 73.99 -63.41 0.43 Allowed 'General case' 0 N--CA 1.499 2.015 0 C-N-CA 125.203 1.401 . . . . 0.0 112.647 175.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.81 145.08 86.39 Favored Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.368 0.667 . . . . 0.0 111.191 173.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -53.17 109.12 0.32 Allowed 'Trans proline' 0 C--N 1.383 2.357 0 C-N-CA 123.179 2.586 . . . . 0.0 114.16 178.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 52.0 ttm 58.79 85.31 0.1 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 125.473 1.509 . . . . 0.0 112.418 178.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.0 t -155.1 150.65 27.41 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.495 0.718 . . . . 0.0 110.917 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.89 148.46 15.26 Favored Glycine 0 C--N 1.349 1.282 0 N-CA-C 111.899 -0.48 . . . . 0.0 111.899 -169.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -63.69 112.62 2.92 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.613 0.72 . . . . 0.0 112.038 -178.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -70.0 -12.48 61.64 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 125.185 1.394 . . . . 0.0 112.296 -176.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.614 ' HG3' ' HB3' ' A' ' 3' ' ' GLN . 0.1 OUTLIER -77.34 -60.69 2.26 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 124.164 0.986 . . . . 0.0 110.782 178.472 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -112.79 -32.07 6.53 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.701 0.8 . . . . 0.0 112.624 -170.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.58 -85.09 1.09 Allowed Glycine 0 CA--C 1.528 0.89 0 N-CA-C 114.498 0.559 . . . . 0.0 114.498 -174.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -62.65 -54.95 31.83 Favored 'General case' 0 CA--C 1.56 1.345 0 C-N-CA 123.406 0.683 . . . . 0.0 111.279 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 66.5 m 61.25 -173.85 0.13 Allowed 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 172.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -91.91 65.36 4.88 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.68 165.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 37.8 m -85.16 79.72 9.47 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.557 176.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -94.35 -101.14 0.15 Allowed 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.675 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 14.0 p -101.79 5.91 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.351 0 C-N-CA 123.416 0.686 . . . . 0.0 110.757 -174.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -109.84 -69.15 0.88 Allowed 'General case' 0 CA--C 1.555 1.165 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -174.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -78.18 178.48 7.56 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -163.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -109.07 17.17 21.95 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 124.505 1.122 . . . . 0.0 112.241 176.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -77.45 -149.67 3.71 Favored Glycine 0 N--CA 1.48 1.571 0 N-CA-C 112.621 -0.191 . . . . 0.0 112.621 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.559 ' HB3' HG21 ' A' ' 14' ' ' VAL . 59.0 p -72.64 101.37 3.02 Favored 'General case' 0 N--CA 1.486 1.327 0 O-C-N 122.242 -0.564 . . . . 0.0 111.649 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.496 ' HB3' ' HB3' ' A' ' 105' ' ' SER . 94.2 m-70 -75.73 151.39 37.63 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.057 174.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.9 t -123.9 131.63 53.61 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.403 0.681 . . . . 0.0 111.076 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.452 HG11 ' HB2' ' A' ' 82' ' ' ALA . 48.5 t -129.85 101.4 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 123.65 0.78 . . . . 0.0 109.311 176.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 75.5 m -96.96 105.68 17.87 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.674 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -138.58 137.31 36.87 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.82 0.848 . . . . 0.0 108.954 -177.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.471 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 14.4 tt0 -117.78 108.83 15.84 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.124 0.487 . . . . 0.0 110.977 -168.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.477 ' HB2' HD11 ' A' ' 50' ' ' LEU . 59.3 mmm -91.55 132.6 36.18 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.817 0.847 . . . . 0.0 109.359 -179.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.655 HG22 ' HB3' ' A' ' 95' ' ' PRO . 8.0 t -80.12 155.29 27.56 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 175.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.467 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 37.1 tt0 -51.83 -31.23 26.66 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 118.902 -0.571 . . . . 0.0 112.291 -174.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -49.86 -43.79 49.3 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.802 0.841 . . . . 0.0 112.427 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -71.57 -38.21 70.96 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.593 0.357 . . . . 0.0 111.804 175.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.477 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.0 mp -71.04 -21.54 62.25 Favored 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 122.491 0.317 . . . . 0.0 111.742 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 47' ' ' GLU . 90.4 mt -72.72 -31.61 65.11 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 124.177 0.991 . . . . 0.0 109.565 169.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -74.86 -31.42 61.63 Favored 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 123.49 0.716 . . . . 0.0 111.465 168.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.9 m -70.11 -36.68 75.03 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.387 0.675 . . . . 0.0 111.781 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -71.69 -32.97 68.41 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 120.939 0.4 . . . . 0.0 110.51 172.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -71.03 -30.19 66.32 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.263 1.025 . . . . 0.0 111.067 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -80.18 -55.33 5.0 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.45 0.7 . . . . 0.0 110.49 174.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -120.15 -88.04 1.06 Allowed Glycine 0 C--N 1.351 1.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 112.745 -177.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -153.27 156.83 39.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.576 0.751 . . . . 0.0 109.961 -174.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -57.89 151.81 17.33 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.742 0.817 . . . . 0.0 111.978 177.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 42.1 tp -138.86 -37.85 0.52 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.239 0.616 . . . . 0.0 111.085 178.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.11 -38.48 56.85 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -175.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 52.6 m 58.95 92.25 0.07 OUTLIER Pre-proline 0 N--CA 1.489 1.509 0 C-N-CA 124.224 1.01 . . . . 0.0 111.475 -176.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -71.5 58.87 2.52 Favored 'Trans proline' 0 CA--C 1.569 2.268 0 C-N-CA 123.425 2.75 . . . . 0.0 113.567 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.413 ' HB3' ' HD2' ' A' ' 65' ' ' PRO . 44.1 mtm180 -139.69 167.2 19.42 Favored Pre-proline 0 CA--C 1.563 1.463 0 C-N-CA 125.146 1.379 . . . . 0.0 109.835 -178.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 64' ' ' ARG . 59.6 Cg_endo -68.87 -1.83 8.43 Favored 'Trans proline' 0 C--N 1.389 2.683 0 C-N-CA 122.682 2.255 . . . . 0.0 113.386 175.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -64.41 97.14 0.18 Allowed 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.736 0.815 . . . . 0.0 111.584 172.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -110.5 75.74 0.94 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 168.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -102.2 21.78 14.37 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.454 -178.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 59.94 82.32 0.23 Allowed Pre-proline 0 CA--C 1.56 1.338 0 C-N-CA 124.97 1.308 . . . . 0.0 111.039 -172.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.59 -17.77 20.4 Favored 'Trans proline' 0 C--N 1.377 2.04 0 C-N-CA 122.484 2.123 . . . . 0.0 112.817 177.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 78.55 93.56 0.29 Allowed Glycine 0 C--N 1.351 1.366 0 CA-C-O 119.65 -0.528 . . . . 0.0 112.05 -178.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.1 tp 64.91 108.85 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.362 1.065 . . . . 0.0 111.926 -175.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -136.62 -172.07 3.07 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.336 0.654 . . . . 0.0 111.359 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.12 126.11 28.14 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.422 0.689 . . . . 0.0 111.89 -176.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 77.01 28.59 58.38 Favored Glycine 0 C--N 1.349 1.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 113.971 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -131.51 102.94 6.14 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 123.601 0.761 . . . . 0.0 110.905 178.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.471 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 11.5 ptt180 -85.57 88.88 7.58 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.881 0.848 . . . . 0.0 111.905 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -160.05 119.73 2.86 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.144 0.977 . . . . 0.0 109.353 -177.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 85.9 m 57.98 20.65 6.97 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.157 0.983 . . . . 0.0 113.179 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.674 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.5 tm? -68.02 115.97 8.12 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 48.4 m -63.32 114.79 4.04 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 123.649 0.593 . . . . 0.0 109.434 177.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.584 ' HB1' HG13 ' A' ' 110' ' ' VAL . . . -51.83 -35.51 44.75 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.822 0.849 . . . . 0.0 112.695 -176.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.7 m -57.55 -34.95 69.69 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.855 0.862 . . . . 0.0 112.688 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -74.69 -29.5 61.24 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 177.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -67.83 -51.74 44.93 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 169.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.74 ' HB2' HG12 ' A' ' 110' ' ' VAL . 13.3 tp60 -49.9 -35.6 24.25 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.891 0.876 . . . . 0.0 112.79 171.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -56.02 -44.01 78.32 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.934 0.894 . . . . 0.0 111.974 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.72 83.57 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.917 0.887 . . . . 0.0 113.095 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.37 -47.08 87.5 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.313 0.577 . . . . 0.0 110.69 173.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -69.49 -28.39 66.02 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.123 0.969 . . . . 0.0 112.114 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.7 -25.79 49.66 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.279 0.632 . . . . 0.0 111.308 174.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.76 29.82 25.43 Favored Glycine 0 CA--C 1.537 1.444 0 CA-C-N 116.101 -0.499 . . . . 0.0 113.822 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 23.1 ptm -139.6 25.26 2.4 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.209 0.604 . . . . 0.0 111.83 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -40.13 112.6 0.85 Allowed Pre-proline 0 CA--C 1.572 1.802 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 177.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.655 ' HB3' HG22 ' A' ' 46' ' ' THR . 54.3 Cg_exo -60.48 161.61 20.08 Favored 'Trans proline' 0 C--N 1.382 2.296 0 C-N-CA 123.745 2.963 . . . . 0.0 114.157 168.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -73.83 115.1 4.21 Favored 'Trans proline' 0 C--N 1.374 1.9 0 C-N-CA 122.138 1.892 . . . . 0.0 111.237 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 9.0 p -97.17 164.55 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-O 121.394 0.616 . . . . 0.0 109.846 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p -107.86 96.9 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.325 0 C-N-CA 123.882 0.873 . . . . 0.0 110.448 -178.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 25.6 mt -52.27 -41.17 62.63 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 124.248 1.019 . . . . 0.0 113.165 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.423 ' HB3' HG11 ' A' ' 122' ' ' VAL . 18.7 pt20 -74.14 -1.27 19.57 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -176.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.8 t -122.5 -26.18 4.62 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.516 0.726 . . . . 0.0 111.154 172.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 30.4 m -76.3 104.07 6.64 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.19 0.596 . . . . 0.0 109.922 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -65.8 152.32 44.63 Favored 'General case' 0 CA--C 1.564 1.518 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.612 -175.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.16 -14.58 56.05 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 125.155 1.382 . . . . 0.0 112.551 -179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.496 ' HB3' ' HB3' ' A' ' 39' ' ' HIS . 54.9 m -55.82 -31.14 62.42 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.996 0.918 . . . . 0.0 111.259 169.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.432 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -56.32 -41.24 75.68 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.741 0.817 . . . . 0.0 112.004 175.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.7 -13.81 6.91 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 124.216 1.006 . . . . 0.0 113.502 -177.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -86.62 -8.7 57.25 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.469 0.708 . . . . 0.0 111.483 -179.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.507 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 44.8 m-85 -123.24 -45.41 2.1 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.826 1.251 . . . . 0.0 109.306 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.74 HG12 ' HB2' ' A' ' 86' ' ' GLN . 13.9 m -85.81 -167.81 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 CA-C-O 122.135 0.969 . . . . 0.0 111.608 167.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 43.9 t -115.03 150.85 35.23 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 114.323 -1.308 . . . . 0.0 108.713 156.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 5.1 tt -48.69 -39.28 23.91 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.079 0.552 . . . . 0.0 111.629 173.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.93 -31.49 65.0 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.15 0.98 . . . . 0.0 113.248 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -64.4 -46.05 85.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.043 0.537 . . . . 0.0 111.058 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.653 HD21 HG21 ' A' ' 110' ' ' VAL . 8.1 mt -66.17 -48.85 69.39 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.815 0.817 . . . . 0.0 109.83 -175.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -74.04 -24.84 59.6 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.26 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.95 -34.05 62.9 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 123.62 0.768 . . . . 0.0 112.704 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.28 33.62 3.06 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.1 0.56 . . . . 0.0 111.546 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -151.37 130.27 12.5 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.227 0.611 . . . . 0.0 110.147 171.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 4.6 mm? -80.55 144.27 56.6 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 123.065 0.546 . . . . 0.0 111.686 -176.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 120' ' ' LEU . 28.2 Cg_exo -62.8 100.0 0.23 Allowed 'Trans proline' 0 C--N 1.381 2.263 0 C-N-CA 123.329 2.686 . . . . 0.0 112.435 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.423 HG11 ' HB3' ' A' ' 100' ' ' GLN . 7.8 p -68.49 143.46 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.328 0 C-N-CA 123.914 0.886 . . . . 0.0 111.356 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 7.8 tt -69.94 112.22 6.2 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.515 0.674 . . . . 0.0 111.439 -175.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -106.74 -60.42 1.67 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.627 1.171 . . . . 0.0 108.914 172.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 44.9 t60 -178.92 109.96 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.083 1.353 . . . . 0.0 108.265 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 50.5 p-80 -92.13 121.53 33.76 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 121.319 0.581 . . . . 0.0 110.889 175.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -143.3 123.21 13.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.813 0.845 . . . . 0.0 109.155 171.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -139.41 161.58 37.13 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.552 0.741 . . . . 0.0 109.405 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -143.65 136.79 27.74 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.764 0.426 . . . . 0.0 110.416 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 . . . . . 0 CA--C 1.562 1.433 0 C-N-CA 123.033 0.533 . . . . 0.0 109.758 170.335 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptm . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 120.561 0.219 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.85 -5.21 51.01 Favored Glycine 0 CA--C 1.537 1.468 0 CA-C-N 116.415 -0.357 . . . . 0.0 113.522 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.47 133.32 46.72 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.627 0.771 . . . . 0.0 109.819 177.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.81 107.13 1.92 Allowed Glycine 0 C--N 1.352 1.472 0 O-C-N 123.189 0.305 . . . . 0.0 113.112 178.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -126.96 127.85 45.49 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.303 1.041 . . . . 0.0 110.032 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -100.0 162.48 12.95 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.543 0.737 . . . . 0.0 110.891 176.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.7 m -62.43 -24.26 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 C-N-CA 124.105 0.962 . . . . 0.0 113.567 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.696 ' H ' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -87.85 -11.86 46.6 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.19 0.596 . . . . 0.0 112.451 -179.633 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 72.32 100.84 0.07 OUTLIER Glycine 0 CA--C 1.541 1.676 0 O-C-N 123.141 0.275 . . . . 0.0 113.391 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -136.68 156.42 48.55 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.264 0.626 . . . . 0.0 112.035 -175.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -159.67 17.68 0.16 Allowed 'General case' 0 CA--C 1.559 1.322 0 CA-C-O 121.61 0.719 . . . . 0.0 110.518 177.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 89.9 mt -105.25 166.9 10.08 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.163 0.985 . . . . 0.0 110.135 173.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.4 141.01 43.31 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 122.59 0.356 . . . . 0.0 110.837 176.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.5 p -176.51 147.54 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.635 0.774 . . . . 0.0 110.91 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.407 ' HB3' HG21 ' A' ' 21' ' ' THR . 42.4 t -83.29 -63.77 1.29 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.631 0.372 . . . . 0.0 110.377 169.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 56.9 m -148.47 152.26 36.6 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.504 0.722 . . . . 0.0 110.516 177.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 26.4 p -84.13 -1.06 54.3 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.624 0.77 . . . . 0.0 111.85 176.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.19 141.26 46.28 Favored Pre-proline 0 CA--C 1.558 1.285 0 C-N-CA 123.754 0.822 . . . . 0.0 111.95 -177.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.98 -15.56 28.05 Favored 'Trans proline' 0 C--N 1.384 2.442 0 C-N-CA 123.547 2.832 . . . . 0.0 114.926 177.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 51.6 ttm -68.56 -42.31 78.52 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.535 0.334 . . . . 0.0 111.302 175.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.407 HG21 ' HB3' ' A' ' 15' ' ' CYS . 47.8 m -72.48 -51.19 21.17 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.027 0.531 . . . . 0.0 110.583 170.174 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.6 150.5 24.52 Favored Glycine 0 CA--C 1.536 1.375 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.687 -176.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 13.3 m-90 -92.48 101.56 14.01 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.781 0.832 . . . . 0.0 109.631 -178.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.519 ' HB3' ' HG3' ' A' ' 30' ' ' GLN . 89.7 m-85 -81.51 66.03 6.89 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.275 0.63 . . . . 0.0 111.35 -177.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? 59.52 -77.44 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 125.25 1.42 . . . . 0.0 111.724 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -72.29 -63.28 1.18 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.835 0.854 . . . . 0.0 110.055 178.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -165.94 -55.76 0.03 OUTLIER Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.878 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -138.34 -33.79 0.67 Allowed 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.622 0.369 . . . . 0.0 111.271 173.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 28.3 p -97.43 116.61 29.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.489 0.316 . . . . 0.0 110.792 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.519 ' HG3' ' HB3' ' A' ' 24' ' ' TYR . 54.1 mt-30 -84.76 -51.88 6.46 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.627 0.771 . . . . 0.0 111.26 177.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.24 74.75 5.81 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 121.558 0.694 . . . . 0.0 110.522 173.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -169.41 164.3 10.61 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 114.4 -1.273 . . . . 0.0 110.403 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 28.7 m -91.44 27.41 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.566 1.574 0 C-N-CA 124.374 1.07 . . . . 0.0 111.174 173.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 52.46 23.65 2.63 Favored 'General case' 0 N--CA 1.506 2.357 0 C-N-CA 127.103 2.161 . . . . 0.0 113.544 -174.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -117.07 116.08 26.63 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.225 1.01 . . . . 0.0 109.326 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 51.96 10.83 0.12 Allowed 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 126.766 2.026 . . . . 0.0 116.121 -179.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.0 127.6 0.42 Allowed Glycine 0 CA--C 1.544 1.888 0 N-CA-C 115.405 0.922 . . . . 0.0 115.405 168.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 97.8 p 50.92 34.16 10.0 Favored 'General case' 0 N--CA 1.501 2.08 0 C-N-CA 125.411 1.485 . . . . 0.0 114.6 168.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -79.95 89.81 5.33 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.569 0.748 . . . . 0.0 111.374 -177.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.77 111.08 9.65 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 123.04 0.536 . . . . 0.0 111.459 178.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.585 HG11 ' HB2' ' A' ' 82' ' ' ALA . 40.9 t -128.13 120.51 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 169.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 81.5 m -116.61 109.14 16.83 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-O 121.192 0.52 . . . . 0.0 109.86 173.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.622 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -132.06 150.38 52.17 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.332 1.053 . . . . 0.0 108.512 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -117.58 109.18 16.37 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.968 0.413 . . . . 0.0 110.236 -176.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.553 ' HE1' ' HE3' ' A' ' 85' ' ' TRP . 60.5 mmm -84.97 131.42 34.48 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.481 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 5.4 t -81.95 153.71 26.13 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 174.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -49.06 -30.04 5.84 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.489 1.116 . . . . 0.0 113.106 -175.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -49.62 -48.41 49.06 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.65 1.18 . . . . 0.0 112.293 175.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.455 ' HB2' ' HG3' ' A' ' 95' ' ' PRO . 59.8 t80 -68.95 -41.35 78.15 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.034 0.533 . . . . 0.0 112.04 176.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.463 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.3 mp -70.94 -29.45 65.47 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 122.592 0.357 . . . . 0.0 111.713 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 67.9 mt -76.38 -32.86 58.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.695 0.798 . . . . 0.0 110.527 171.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -68.27 -32.19 72.18 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.08 0.552 . . . . 0.0 111.08 171.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 70.0 m -63.67 -49.59 72.58 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.327 0.651 . . . . 0.0 110.658 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.43 ' HD2' ' SD ' ' A' ' 61' ' ' MET . 16.3 ptm180 -72.14 -22.83 61.26 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 177.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -76.48 -28.82 56.63 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 123.781 0.832 . . . . 0.0 111.931 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -130.08 -59.17 1.06 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -175.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -76.11 -88.96 0.27 Allowed Glycine 0 CA--C 1.541 1.697 0 N-CA-C 114.128 0.411 . . . . 0.0 114.128 -174.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.429 HD21 ' HB3' ' A' ' 68' ' ' ASN . 44.3 t-20 -140.36 142.62 35.53 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.719 0.808 . . . . 0.0 109.935 -179.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -66.83 87.11 0.13 Allowed 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 122.288 1.042 . . . . 0.0 111.738 177.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 34.5 tp -65.52 -11.92 48.01 Favored 'General case' 0 CA--C 1.562 1.427 0 C-N-CA 125.267 1.427 . . . . 0.0 112.946 -176.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.43 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 20.5 ptp -126.01 39.36 3.96 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.656 0.783 . . . . 0.0 112.191 -174.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 14.1 t -86.65 152.18 53.96 Favored Pre-proline 0 N--CA 1.489 1.486 0 C-N-CA 122.854 0.462 . . . . 0.0 110.538 171.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -60.82 -166.32 0.04 OUTLIER 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.863 2.376 . . . . 0.0 113.404 166.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 70.71 159.34 0.16 Allowed Pre-proline 0 N--CA 1.501 2.113 0 C-N-CA 124.605 1.162 . . . . 0.0 111.6 -175.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo -58.18 -55.6 2.13 Favored 'Trans proline' 0 C--N 1.39 2.75 0 C-N-CA 122.135 1.89 . . . . 0.0 111.333 173.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 69.04 148.76 0.07 Allowed 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 125.485 1.514 . . . . 0.0 113.823 171.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -122.75 -19.61 6.17 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.224 1.01 . . . . 0.0 112.077 -179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.429 ' HB3' HD21 ' A' ' 58' ' ' ASN . 95.0 m-20 -53.58 -34.31 57.9 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -174.32 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 32.3 p90 -138.18 156.21 73.92 Favored Pre-proline 0 N--CA 1.481 1.102 0 C-N-CA 123.582 0.753 . . . . 0.0 111.504 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.15 175.04 10.17 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.449 2.099 . . . . 0.0 111.587 166.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -75.96 -119.86 0.14 Allowed Glycine 0 CA--C 1.537 1.452 0 C-N-CA 121.795 -0.24 . . . . 0.0 113.435 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.3 mm? 56.2 91.08 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.881 1.273 . . . . 0.0 112.093 -178.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.48 174.06 6.45 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.371 -176.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.03 116.74 4.74 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.611 0.765 . . . . 0.0 112.242 -173.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 102.34 14.73 27.36 Favored Glycine 0 CA--C 1.536 1.347 0 N-CA-C 114.456 0.543 . . . . 0.0 114.456 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -122.55 103.8 8.94 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 117.783 0.791 . . . . 0.0 111.815 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.411 ' HB3' HG11 ' A' ' 98' ' ' VAL . 0.0 OUTLIER -86.75 91.98 8.8 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.365 0.603 . . . . 0.0 111.324 168.712 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 73.3 t90 -166.71 121.01 1.07 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.278 0.631 . . . . 0.0 109.323 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 73.4 m 52.78 24.81 3.44 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 175.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.622 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.3 tm? -72.29 105.25 3.98 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 175.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 49.5 t -55.72 120.66 7.64 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 123.551 0.532 . . . . 0.0 110.567 175.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.585 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -56.84 -22.72 38.7 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.842 0.857 . . . . 0.0 113.131 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 64.6 m -54.1 -39.98 66.88 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.078 0.551 . . . . 0.0 112.348 170.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -66.84 -44.56 80.75 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.92 0.888 . . . . 0.0 111.552 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.652 ' HE1' HD23 ' A' ' 115' ' ' LEU . 5.3 t-105 -70.53 -54.02 13.82 Favored 'General case' 0 CA--C 1.566 1.559 0 C-N-CA 123.215 0.606 . . . . 0.0 110.99 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.699 ' HB2' HG12 ' A' ' 110' ' ' VAL . 6.5 tp60 -49.64 -42.51 45.33 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.31 0.644 . . . . 0.0 112.303 175.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.23 -32.7 62.49 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 123.56 0.744 . . . . 0.0 112.752 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.93 -43.12 91.13 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.111 0.564 . . . . 0.0 111.839 175.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -69.83 -41.24 75.22 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.483 0.713 . . . . 0.0 111.232 176.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 9.4 mm-40 -65.35 -23.71 67.06 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.458 0.703 . . . . 0.0 111.372 178.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.05 -25.63 29.7 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.865 0.866 . . . . 0.0 111.523 172.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 117.7 -12.92 13.36 Favored Glycine 0 N--CA 1.48 1.572 0 N-CA-C 114.187 0.435 . . . . 0.0 114.187 177.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 91.1 mmm -83.92 -80.84 0.18 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.336 0.654 . . . . 0.0 111.773 -176.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.46 92.17 0.07 OUTLIER Pre-proline 0 N--CA 1.487 1.422 0 C-N-CA 124.664 1.185 . . . . 0.0 113.043 -174.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.455 ' HG3' ' HB2' ' A' ' 49' ' ' PHE . 67.6 Cg_endo -77.6 179.27 6.67 Favored 'Trans proline' 0 CA--C 1.574 2.492 0 C-N-CA 123.215 2.61 . . . . 0.0 112.734 174.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -62.06 127.8 22.27 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 121.953 1.768 . . . . 0.0 113.971 174.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.7 p -104.01 145.4 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 124.119 0.968 . . . . 0.0 109.884 173.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 77' ' ' ARG . 7.5 p -85.67 89.44 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.842 0 CA-C-O 122.192 0.996 . . . . 0.0 111.873 -176.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.623 HD12 ' H ' ' A' ' 120' ' ' LEU . 7.9 mt -64.36 -24.06 67.51 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -177.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -73.27 -6.72 47.86 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 177.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 34.8 t -123.3 -12.99 7.76 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.679 0.791 . . . . 0.0 112.022 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 91.1 m -85.67 127.09 34.4 Favored 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 123.424 0.689 . . . . 0.0 112.171 -175.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -91.04 165.67 13.4 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.528 0.731 . . . . 0.0 111.518 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -63.32 -17.34 62.46 Favored 'General case' 0 CA--C 1.564 1.519 0 C-N-CA 124.398 1.079 . . . . 0.0 113.867 177.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 64.2 m -61.23 -24.91 66.7 Favored 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 122.696 0.398 . . . . 0.0 111.898 173.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.401 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -55.09 -38.9 68.68 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.418 0.687 . . . . 0.0 111.782 172.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.431 HD21 ' HB2' ' A' ' 112' ' ' LEU . 8.8 mp -67.47 3.4 1.33 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 124.647 1.179 . . . . 0.0 113.47 -176.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -95.72 -2.85 47.04 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.101 0.56 . . . . 0.0 110.357 174.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 75.6 m-85 -130.39 -53.24 1.1 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.122 1.369 . . . . 0.0 108.542 -177.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.699 HG12 ' HB2' ' A' ' 86' ' ' GLN . 17.0 m -89.07 177.87 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-O 122.256 1.027 . . . . 0.0 112.348 172.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.0 t -97.13 148.87 22.6 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 113.924 -1.489 . . . . 0.0 108.888 156.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.431 ' HB2' HD21 ' A' ' 107' ' ' LEU . 1.8 tt -57.99 -34.29 69.82 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 120.98 0.419 . . . . 0.0 109.958 170.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.91 -30.22 65.72 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.694 0.797 . . . . 0.0 112.524 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -71.57 -37.69 71.02 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.346 0.594 . . . . 0.0 110.131 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.652 HD23 ' HE1' ' A' ' 85' ' ' TRP . 75.9 mt -66.62 -50.0 64.44 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.652 0.781 . . . . 0.0 110.98 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.666 HE22 ' HB ' ' A' ' 122' ' ' VAL . 14.7 mt-30 -75.04 -37.7 61.65 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.065 -0.971 . . . . 0.0 112.582 -173.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -59.31 -25.65 64.33 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.469 173.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -120.05 19.84 12.22 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 123.526 0.731 . . . . 0.0 112.14 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -155.05 -101.69 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 170.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.623 ' H ' HD12 ' A' ' 99' ' ' LEU . 3.7 mm? -117.94 133.95 23.34 Favored Pre-proline 0 N--CA 1.483 1.193 0 C-N-CA 123.563 0.745 . . . . 0.0 111.444 -171.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -87.63 135.37 3.53 Favored 'Trans proline' 0 CA--C 1.561 1.83 0 C-N-CA 123.16 2.574 . . . . 0.0 112.968 -176.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.666 ' HB ' HE22 ' A' ' 116' ' ' GLN . 7.5 p -75.39 153.17 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 C-N-CA 122.884 0.474 . . . . 0.0 110.821 176.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.582 HD13 ' H ' ' A' ' 123' ' ' LEU . 0.0 OUTLIER -115.89 171.85 7.51 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.402 0.681 . . . . 0.0 110.108 170.276 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.92 161.42 27.52 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.724 0.81 . . . . 0.0 110.746 -177.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -71.2 111.88 6.9 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.44 176.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -83.86 127.07 33.57 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.968 0.507 . . . . 0.0 111.745 -175.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -156.76 167.44 30.46 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.817 0.847 . . . . 0.0 110.892 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -65.48 121.65 15.37 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.675 0.39 . . . . 0.0 110.743 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -79.68 101.91 8.66 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.507 0.723 . . . . 0.0 111.512 -174.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 . . . . . 0 N--CA 1.488 1.455 0 C-N-CA 125.287 1.435 . . . . 0.0 112.608 176.099 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -148.49 80.01 0.21 Allowed Glycine 0 N--CA 1.477 1.38 0 CA-C-N 116.382 -0.372 . . . . 0.0 112.783 -176.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -73.19 -27.38 61.59 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.928 0.891 . . . . 0.0 111.773 177.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.62 108.76 2.55 Favored Glycine 0 C--N 1.354 1.577 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.618 174.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -139.65 170.46 15.86 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.874 0.87 . . . . 0.0 111.672 -174.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -114.29 150.3 34.64 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.627 0.771 . . . . 0.0 111.405 178.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -78.2 -12.57 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 123.9 0.88 . . . . 0.0 111.053 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 78.3 mt -84.63 -40.8 17.02 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.564 1.146 . . . . 0.0 111.981 -176.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.77 58.59 4.75 Favored Glycine 0 N--CA 1.481 1.678 0 CA-C-N 116.263 -0.426 . . . . 0.0 114.131 -177.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -157.18 -49.78 0.07 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.087 0.955 . . . . 0.0 110.778 -178.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -77.37 158.78 29.93 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.513 0.725 . . . . 0.0 111.611 -178.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.4 mp -79.29 132.02 36.33 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.413 0.685 . . . . 0.0 110.961 179.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -65.87 -31.1 71.85 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.768 0.827 . . . . 0.0 112.682 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.421 HG22 ' H ' ' A' ' 16' ' ' CYS . 7.2 p -138.09 139.1 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 124.193 0.997 . . . . 0.0 110.746 -175.21 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 51.1 t -99.52 -16.55 18.26 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.287 0.635 . . . . 0.0 111.847 177.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.421 ' H ' HG22 ' A' ' 14' ' ' VAL . 49.8 t -74.48 77.15 1.93 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-O 121.521 0.676 . . . . 0.0 112.336 -176.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.0 m -116.8 -66.85 1.04 Allowed 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 168.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.57 -48.15 0.47 Allowed Pre-proline 0 CA--C 1.57 1.724 0 CA-C-O 118.605 -0.712 . . . . 0.0 111.802 173.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -82.24 172.71 11.45 Favored 'Trans proline' 0 C--N 1.392 2.844 0 C-N-CA 122.127 1.884 . . . . 0.0 113.236 173.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 42.0 mtt -105.45 90.94 3.57 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.146 0.979 . . . . 0.0 109.026 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 56.5 p -107.87 79.23 1.26 Allowed 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.696 0.76 . . . . 0.0 110.569 -177.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 69.59 -145.51 42.24 Favored Glycine 0 C--N 1.355 1.632 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.875 -171.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.456 ' HE3' ' HB2' ' A' ' 124' ' ' GLU . 20.5 m0 -111.4 -64.98 1.22 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 167.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -174.97 87.83 0.04 OUTLIER 'General case' 0 C--N 1.36 1.058 0 C-N-CA 123.659 0.784 . . . . 0.0 110.482 174.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.497 ' NH2' HG11 ' A' ' 122' ' ' VAL . 37.1 ttm105 -125.93 -71.75 0.68 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.298 0.639 . . . . 0.0 110.41 174.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -93.79 1.57 56.44 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.11 0.564 . . . . 0.0 110.873 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.41 -50.84 4.41 Favored Glycine 0 C--N 1.356 1.668 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.937 -175.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -148.05 152.99 38.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.185 0.994 . . . . 0.0 110.814 177.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.1 m 66.78 161.72 0.16 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 168.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -170.02 21.62 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 115.25 -0.887 . . . . 0.0 112.196 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.4 t -155.47 155.74 34.03 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -85.12 -14.24 47.71 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.626 1.171 . . . . 0.0 112.072 175.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 97.1 t 71.83 -66.2 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 C-N-CA 124.958 1.303 . . . . 0.0 111.535 -175.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -80.85 105.58 12.19 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.519 0.728 . . . . 0.0 110.487 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -118.55 -9.9 10.19 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.149 0.98 . . . . 0.0 113.241 -176.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 76.12 -30.09 0.18 Allowed 'General case' 0 N--CA 1.501 2.123 0 C-N-CA 125.334 1.454 . . . . 0.0 114.246 -177.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -93.77 -0.13 66.86 Favored Glycine 0 CA--C 1.54 1.651 0 CA-C-O 119.147 -0.807 . . . . 0.0 114.321 -177.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.7 p 71.15 -5.67 1.49 Allowed 'General case' 0 N--CA 1.512 2.631 0 C-N-CA 126.378 1.871 . . . . 0.0 113.705 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 p-80 -148.65 99.99 3.06 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.654 0.782 . . . . 0.0 109.786 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.7 t -96.2 116.51 29.12 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.555 0.742 . . . . 0.0 111.235 -175.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.459 HG21 ' HB2' ' A' ' 82' ' ' ALA . 48.2 t -139.75 106.18 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.549 0.74 . . . . 0.0 109.871 -179.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 76.2 m -95.8 105.93 18.0 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.527 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -144.97 150.54 37.12 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.232 1.013 . . . . 0.0 108.793 -179.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -122.84 119.03 29.35 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 117.938 0.335 . . . . 0.0 110.632 -176.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 56.9 mtp -109.93 158.01 18.66 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.931 0.893 . . . . 0.0 111.274 178.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.41 ' OG1' ' HG2' ' A' ' 48' ' ' GLU . 25.6 p -96.86 158.85 15.23 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.971 0.908 . . . . 0.0 111.073 -177.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.594 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 23.7 tt0 -62.75 -29.12 70.45 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.973 -178.173 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.41 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 12.3 pt-20 -52.34 -45.41 65.65 Favored 'General case' 0 CA--C 1.565 1.548 0 C-N-CA 123.45 0.7 . . . . 0.0 112.73 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -79.38 -37.79 36.46 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 173.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.1 -20.16 64.91 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.73 -0.607 . . . . 0.0 111.616 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.594 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 76.4 mt -73.46 -30.74 63.37 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.536 1.134 . . . . 0.0 110.939 168.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.533 ' HE2' ' SD ' ' A' ' 93' ' ' MET . 13.7 m-85 -64.49 -47.65 78.15 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 118.319 0.509 . . . . 0.0 110.783 169.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.2 t -55.42 -35.19 65.12 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.43 0.633 . . . . 0.0 111.577 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.527 HH11 HD22 ' A' ' 51' ' ' LEU . 25.6 ttt180 -71.67 -60.15 2.38 Favored 'General case' 0 CA--C 1.564 1.516 0 C-N-CA 124.032 0.933 . . . . 0.0 112.016 173.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -85.19 -4.9 59.32 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.677 0.791 . . . . 0.0 112.273 -163.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -111.91 -24.68 9.83 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.467 0.707 . . . . 0.0 109.626 175.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -81.96 -112.28 0.41 Allowed Glycine 0 CA--C 1.538 1.505 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.849 176.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -130.47 20.58 5.19 Favored 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 123.909 0.883 . . . . 0.0 111.459 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.6 t70 67.74 157.33 0.13 Allowed 'General case' 0 CA--C 1.564 1.496 0 C-N-CA 125.008 1.323 . . . . 0.0 112.718 -175.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.446 ' H ' ' HG3' ' A' ' 54' ' ' ARG . 50.7 tp -154.68 -57.57 0.11 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.516 0.726 . . . . 0.0 110.314 178.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 66.8 mtm -101.34 92.04 4.76 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.489 0.715 . . . . 0.0 111.986 -171.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.9 p -134.01 163.34 51.89 Favored Pre-proline 0 N--CA 1.495 1.796 0 C-N-CA 124.334 1.054 . . . . 0.0 110.871 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -61.89 85.88 0.1 OUTLIER 'Trans proline' 0 C--N 1.392 2.852 0 C-N-CA 122.612 2.208 . . . . 0.0 112.214 172.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -129.17 153.95 80.46 Favored Pre-proline 0 N--CA 1.48 1.044 0 C-N-CA 124.945 1.298 . . . . 0.0 110.376 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.26 -53.28 2.03 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.435 2.09 . . . . 0.0 111.307 169.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 64.17 153.36 0.05 Allowed 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 125.767 1.627 . . . . 0.0 114.039 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -97.97 -84.54 0.38 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.25 0.62 . . . . 0.0 112.119 -177.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -157.96 99.97 1.7 Allowed 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 121.251 0.548 . . . . 0.0 110.635 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -128.76 98.46 24.72 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 123.923 0.889 . . . . 0.0 109.047 174.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -84.54 -171.41 1.0 Allowed 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.959 2.439 . . . . 0.0 113.805 178.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 104.0 -157.86 17.09 Favored Glycine 0 N--CA 1.479 1.528 0 N-CA-C 114.345 0.498 . . . . 0.0 114.345 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.71 117.96 13.94 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.168 0.987 . . . . 0.0 111.052 -177.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -113.63 -53.8 2.66 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.539 0.736 . . . . 0.0 110.733 179.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 170.41 137.45 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 126.436 1.894 . . . . 0.0 109.634 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 68.87 26.33 74.69 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 116.69 -0.232 . . . . 0.0 113.118 -174.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -110.1 115.47 29.81 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.791 0.836 . . . . 0.0 110.065 176.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -99.17 84.89 3.11 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 171.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -158.76 116.63 2.88 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.244 0.618 . . . . 0.0 109.798 -175.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.0 t 43.84 33.86 0.8 Allowed 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 124.462 1.105 . . . . 0.0 113.218 175.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.527 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -62.85 123.42 18.44 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.97 0.908 . . . . 0.0 109.968 -174.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 63.0 m -62.6 105.44 0.64 Allowed 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.459 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -55.59 -26.05 41.71 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.208 1.003 . . . . 0.0 112.692 -177.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 65.2 m -58.87 -42.26 89.04 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.687 0.795 . . . . 0.0 112.474 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.7 mmt85 -69.68 -40.56 76.3 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.671 0.788 . . . . 0.0 112.04 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.619 ' HE1' HD23 ' A' ' 115' ' ' LEU . 15.9 t-105 -64.7 -54.14 36.37 Favored 'General case' 0 CA--C 1.559 1.296 0 C-N-CA 122.535 0.334 . . . . 0.0 110.162 175.502 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.744 ' HB2' HG12 ' A' ' 110' ' ' VAL . 29.5 tp60 -48.85 -43.64 38.9 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.906 0.882 . . . . 0.0 112.718 174.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -67.46 -33.48 75.21 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.839 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.22 -37.05 82.94 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 122.836 0.454 . . . . 0.0 111.361 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.647 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 81.5 t80 -58.13 -52.13 66.81 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.55 170.215 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -66.13 -23.97 66.59 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.749 0.819 . . . . 0.0 112.392 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.12 -5.89 59.32 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.783 0.833 . . . . 0.0 112.516 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.67 10.68 72.55 Favored Glycine 0 CA--C 1.538 1.496 0 N-CA-C 114.249 0.46 . . . . 0.0 114.249 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . 0.533 ' SD ' ' HE2' ' A' ' 52' ' ' PHE . 97.2 mmm -97.98 -75.39 0.55 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.649 0.78 . . . . 0.0 110.902 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.647 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 53.95 82.85 0.24 Allowed Pre-proline 0 CA--C 1.565 1.553 0 C-N-CA 125.0 1.32 . . . . 0.0 113.494 -178.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -56.89 160.15 12.94 Favored 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.677 2.918 . . . . 0.0 114.557 170.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -63.79 106.32 0.62 Allowed 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 122.776 2.318 . . . . 0.0 113.234 174.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 10.6 p -96.05 154.25 3.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 C-N-CA 123.481 0.712 . . . . 0.0 110.261 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.562 HG21 ' HB3' ' A' ' 101' ' ' SER . 27.7 m -73.1 141.98 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.446 0 C-N-CA 123.472 0.709 . . . . 0.0 111.864 173.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 73.1 mt -105.32 -8.62 18.12 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 123.265 0.626 . . . . 0.0 111.252 167.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.15 2.73 29.53 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.531 1.132 . . . . 0.0 112.312 -170.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.562 ' HB3' HG21 ' A' ' 98' ' ' VAL . 21.8 t -132.51 -51.64 0.93 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.884 0.874 . . . . 0.0 110.989 -179.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 98.3 m -38.11 123.6 1.13 Allowed 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 125.222 1.409 . . . . 0.0 113.87 -177.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -83.54 174.54 10.49 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.314 1.045 . . . . 0.0 113.419 -171.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -61.32 -38.74 87.95 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.402 1.081 . . . . 0.0 112.468 177.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 39.3 t -63.36 -28.12 69.78 Favored 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.805 -176.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.482 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -64.55 -47.14 79.88 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.15 0.58 . . . . 0.0 111.725 173.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.62 -15.78 13.11 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 124.369 1.068 . . . . 0.0 113.117 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -75.93 -39.27 56.5 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.503 0.721 . . . . 0.0 110.189 178.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -87.38 -36.31 17.85 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.696 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.744 HG12 ' HB2' ' A' ' 86' ' ' GLN . 26.8 m -97.55 -56.42 5.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 -176.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . 0.408 ' N ' HG23 ' A' ' 110' ' ' VAL . 38.4 t 83.67 134.11 0.05 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 125.924 1.689 . . . . 0.0 110.579 -151.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.655 ' HA ' HD12 ' A' ' 115' ' ' LEU . 1.7 tt -50.07 -30.64 11.31 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.281 1.032 . . . . 0.0 113.628 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.85 -36.11 71.86 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.179 0.592 . . . . 0.0 112.436 -178.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.65 -31.07 57.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.755 0.822 . . . . 0.0 110.637 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.655 HD12 ' HA ' ' A' ' 112' ' ' LEU . 56.9 mt -63.88 -56.18 17.25 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 123.879 0.872 . . . . 0.0 110.013 173.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -65.72 -28.72 69.26 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.074 0.95 . . . . 0.0 112.371 -175.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -49.17 -38.53 25.94 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -138.36 39.49 2.27 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-O 121.224 0.535 . . . . 0.0 111.818 178.183 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -114.59 -172.24 2.08 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.55 0.74 . . . . 0.0 111.094 170.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.3 pp -61.74 141.13 95.23 Favored Pre-proline 0 CA--C 1.564 1.493 0 C-N-CA 123.223 0.609 . . . . 0.0 112.298 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.82 128.96 16.73 Favored 'Trans proline' 0 C--N 1.371 1.758 0 C-N-CA 122.83 2.353 . . . . 0.0 111.884 172.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.497 HG11 ' NH2' ' A' ' 25' ' ' ARG . 9.1 p -149.43 141.36 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 123.099 0.56 . . . . 0.0 110.974 -175.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.6 81.65 2.0 Allowed 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 122.206 1.003 . . . . 0.0 110.533 176.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.456 ' HB2' ' HE3' ' A' ' 23' ' ' TRP . 41.2 mt-10 -72.46 131.72 42.94 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.116 -178.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -76.31 121.37 22.88 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.944 0.497 . . . . 0.0 110.985 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 22.3 m80 -77.44 -25.03 50.24 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.709 0.804 . . . . 0.0 111.754 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 45.3 m80 59.55 -89.79 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 125.257 1.423 . . . . 0.0 111.537 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 25.5 t60 63.12 -75.7 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.711 1.605 . . . . 0.0 113.174 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 68.95 126.53 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 125.591 1.556 . . . . 0.0 110.759 -173.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 . . . . . 0 CA--C 1.568 1.654 0 C-N-CA 123.936 0.894 . . . . 0.0 110.674 -171.314 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.484 1.264 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.65 128.87 1.25 Allowed Glycine 0 C--N 1.35 1.344 0 CA-C-N 116.424 -0.353 . . . . 0.0 112.75 179.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -141.6 104.68 4.6 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.014 0.926 . . . . 0.0 109.884 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.07 114.91 4.18 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 116.63 -0.259 . . . . 0.0 113.377 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -134.09 126.75 30.74 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.041 0.537 . . . . 0.0 110.936 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -168.49 140.64 2.82 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.182 0.993 . . . . 0.0 110.029 176.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 20.0 t 67.18 -57.77 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.646 0 C-N-CA 126.361 1.865 . . . . 0.0 113.307 -176.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.2 pp -65.85 -5.53 9.37 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.319 1.448 . . . . 0.0 114.427 -179.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -59.39 -22.55 56.43 Favored Glycine 0 CA--C 1.543 1.828 0 N-CA-C 115.374 0.909 . . . . 0.0 115.374 -176.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.2 pm0 -153.0 165.07 36.73 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.548 0.739 . . . . 0.0 109.906 176.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -155.0 148.06 24.75 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.404 0.682 . . . . 0.0 111.48 -177.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 18.2 tp -142.67 12.84 1.91 Allowed 'General case' 0 CA--C 1.555 1.154 0 CA-C-O 121.596 0.713 . . . . 0.0 110.051 170.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -80.35 -53.06 6.97 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 121.026 0.441 . . . . 0.0 110.004 177.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.46 HG13 ' H ' ' A' ' 15' ' ' CYS . 5.6 p -116.71 -68.36 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.6 0 C-N-CA 123.141 0.576 . . . . 0.0 112.258 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.46 ' H ' HG13 ' A' ' 14' ' ' VAL . 83.3 m 47.91 51.42 14.4 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 124.216 1.006 . . . . 0.0 113.242 -174.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.4 t -76.63 130.72 38.21 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.288 177.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 53.4 t 69.02 -63.73 0.36 Allowed 'General case' 0 N--CA 1.497 1.903 0 C-N-CA 125.202 1.401 . . . . 0.0 112.791 179.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.89 159.94 37.16 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 124.518 1.127 . . . . 0.0 110.859 178.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -70.96 169.96 19.18 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.264 1.976 . . . . 0.0 112.075 166.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 83.2 mtp 66.44 14.79 9.88 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.576 1.15 . . . . 0.0 113.495 175.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 42.5 p -79.89 114.59 18.92 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 118.388 0.54 . . . . 0.0 110.52 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -80.0 -101.64 0.28 Allowed Glycine 0 CA--C 1.534 1.275 0 CA-C-N 116.734 -0.212 . . . . 0.0 112.586 178.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 56.5 p-90 -150.51 168.04 25.41 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.264 0.626 . . . . 0.0 111.242 178.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -166.07 -57.54 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.007 0.923 . . . . 0.0 109.425 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -118.35 -75.52 0.58 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.088 0.555 . . . . 0.0 111.605 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -123.37 91.19 3.43 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.341 0.657 . . . . 0.0 110.36 -171.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.52 -75.78 1.0 Allowed Glycine 0 N--CA 1.48 1.591 0 CA-C-N 116.524 -0.307 . . . . 0.0 113.266 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.433 ' HA ' HG11 ' A' ' 14' ' ' VAL . 45.4 p90 -73.53 -176.92 2.47 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.933 0.893 . . . . 0.0 111.828 174.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 64.3 m -72.99 -91.07 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.613 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.789 172.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.485 ' NE2' ' SG ' ' A' ' 79' ' ' CYS . 13.8 pt20 -159.17 24.9 0.2 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 121.543 0.687 . . . . 0.0 111.172 -177.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.8 t -88.03 7.61 30.48 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.342 1.057 . . . . 0.0 113.109 -169.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -101.81 -76.75 0.56 Allowed 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.127 0.571 . . . . 0.0 110.515 178.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.4 p -147.16 -40.64 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 C-N-CA 124.127 0.971 . . . . 0.0 109.71 173.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 63.61 -77.01 0.03 OUTLIER 'General case' 0 CA--C 1.56 1.362 0 C-N-CA 125.914 1.686 . . . . 0.0 112.005 -171.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -140.03 -175.41 4.22 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 124.236 1.014 . . . . 0.0 110.741 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -83.86 36.12 0.54 Allowed 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 123.56 0.744 . . . . 0.0 112.435 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -96.49 -128.72 5.86 Favored Glycine 0 C--N 1.35 1.325 0 O-C-N 122.094 -0.379 . . . . 0.0 113.75 -176.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 t -80.25 -11.32 59.74 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.614 0.766 . . . . 0.0 112.974 -175.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 70.1 m80 62.94 -163.38 0.27 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.479 1.112 . . . . 0.0 112.339 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.406 ' O ' ' HB2' ' A' ' 105' ' ' SER . 18.2 p -94.82 102.9 14.78 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-O 121.558 0.694 . . . . 0.0 110.966 -171.253 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.766 HG11 ' HB2' ' A' ' 82' ' ' ALA . 39.6 t -127.78 101.14 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.095 0.558 . . . . 0.0 109.831 174.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.5 m -111.38 106.59 15.57 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 171.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.427 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -139.32 150.67 45.65 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.36 1.064 . . . . 0.0 108.919 -176.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -116.62 108.54 16.07 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 122.065 -0.397 . . . . 0.0 110.584 -172.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.538 ' HB2' HD11 ' A' ' 50' ' ' LEU . 85.3 mmm -95.29 153.91 17.44 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.651 0.78 . . . . 0.0 111.024 177.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.411 ' OG1' ' HG2' ' A' ' 48' ' ' GLU . 73.0 p -90.94 156.47 17.96 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.898 0.879 . . . . 0.0 111.084 177.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.42 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 34.8 tt0 -62.7 -28.71 70.13 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.206 0.602 . . . . 0.0 112.146 -177.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.411 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 7.8 pt-20 -54.11 -38.05 64.97 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 122.825 0.45 . . . . 0.0 110.875 173.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.534 ' HB2' ' HG2' ' A' ' 95' ' ' PRO . 74.8 t80 -77.4 -45.59 25.4 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 123.658 0.783 . . . . 0.0 112.031 173.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' A' ' 45' ' ' MET . 9.0 mp -64.08 -41.12 97.42 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -174.171 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.42 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 88.6 mt -65.12 -31.33 72.48 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.768 0.427 . . . . 0.0 111.353 174.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -67.32 -44.07 80.05 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 123.647 0.779 . . . . 0.0 111.461 172.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 97.7 p -73.64 -30.39 62.92 Favored 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 123.499 0.72 . . . . 0.0 111.68 -179.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.545 ' HA ' HD12 ' A' ' 60' ' ' LEU . 8.2 mpt_? -67.73 -47.25 69.84 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.937 0.895 . . . . 0.0 110.569 174.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -69.57 -28.12 65.71 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 124.103 0.961 . . . . 0.0 111.536 176.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -58.01 -45.25 87.19 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.534 1.133 . . . . 0.0 110.566 175.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.43 -72.8 1.27 Allowed Glycine 0 CA--C 1.536 1.357 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.389 175.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 59.4 t30 -162.74 -72.61 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.297 0.639 . . . . 0.0 110.512 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -141.58 -51.43 0.42 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.316 0.647 . . . . 0.0 111.071 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 54' ' ' ARG . 87.5 mt 66.68 -21.91 0.1 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 116.302 1.964 . . . . 0.0 116.302 170.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -158.06 -48.53 0.06 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 119.321 0.964 . . . . 0.0 112.215 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 85.4 m 65.28 133.26 0.04 OUTLIER Pre-proline 0 N--CA 1.496 1.858 0 C-N-CA 124.152 0.981 . . . . 0.0 112.763 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -59.06 104.77 0.21 Allowed 'Trans proline' 0 C--N 1.386 2.513 0 C-N-CA 122.547 2.165 . . . . 0.0 111.581 170.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 44.7 ttt180 -150.91 141.98 15.07 Favored Pre-proline 0 CA--C 1.562 1.404 0 C-N-CA 123.318 0.647 . . . . 0.0 110.293 -171.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -74.03 14.3 0.72 Allowed 'Trans proline' 0 C--N 1.386 2.518 0 C-N-CA 122.988 2.459 . . . . 0.0 115.219 -177.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -107.55 149.36 28.09 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.6 0.76 . . . . 0.0 111.957 -177.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -91.02 20.65 4.74 Favored 'General case' 0 CA--C 1.565 1.521 0 C-N-CA 124.502 1.121 . . . . 0.0 111.159 -178.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -64.98 -18.93 65.71 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.639 0.776 . . . . 0.0 112.874 -175.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -123.07 94.29 47.32 Favored Pre-proline 0 N--CA 1.488 1.439 0 C-N-CA 123.815 0.846 . . . . 0.0 111.119 -178.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -93.97 26.87 0.33 Allowed 'Trans proline' 0 CA--C 1.56 1.816 0 C-N-CA 123.19 2.593 . . . . 0.0 112.699 170.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -87.7 64.82 3.64 Favored Glycine 0 C--N 1.352 1.446 0 N-CA-C 114.121 0.409 . . . . 0.0 114.121 -174.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 58.93 99.94 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.734 1.214 . . . . 0.0 113.305 176.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.8 pttt -96.53 170.42 9.23 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.228 0.611 . . . . 0.0 109.857 174.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.61 113.53 3.04 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.004 0.522 . . . . 0.0 110.941 176.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 116.54 -11.17 16.27 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 116.193 -0.458 . . . . 0.0 113.668 -175.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -85.21 97.34 9.86 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 117.242 0.521 . . . . 0.0 110.59 175.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.534 ' HD2' HG21 ' A' ' 98' ' ' VAL . 44.8 ttp180 -96.66 84.12 3.58 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -174.95 120.7 0.21 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 125.873 1.669 . . . . 0.0 108.075 -174.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.485 ' SG ' ' NE2' ' A' ' 30' ' ' GLN . 36.2 m 59.47 27.99 17.26 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.511 0.724 . . . . 0.0 112.888 173.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.427 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.9 tm? -67.78 135.76 53.14 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 123.817 0.847 . . . . 0.0 110.559 -177.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.2 m -66.51 95.26 0.32 Allowed 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.845 0.858 . . . . 0.0 111.083 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.766 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -60.23 -29.42 68.74 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.847 0.859 . . . . 0.0 113.163 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.7 m -56.45 -35.21 67.62 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.553 0.741 . . . . 0.0 112.184 175.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -73.62 -41.56 62.64 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.136 0.974 . . . . 0.0 111.472 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 3.0 t-105 -66.54 -48.59 69.22 Favored 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 122.816 0.446 . . . . 0.0 110.366 176.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.56 ' HB2' HG12 ' A' ' 110' ' ' VAL . 11.0 tp60 -49.43 -43.28 44.61 Favored 'General case' 0 CA--C 1.564 1.481 0 C-N-CA 124.052 0.941 . . . . 0.0 111.885 169.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.11 -47.27 85.89 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.949 0.5 . . . . 0.0 111.765 175.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.05 -39.34 74.68 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -173.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.497 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 49.7 t80 -72.18 -45.06 61.92 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.354 0.261 . . . . 0.0 111.495 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -71.71 -21.59 61.75 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.253 0.621 . . . . 0.0 112.173 178.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.29 -24.59 29.81 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.036 0.934 . . . . 0.0 111.216 175.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.62 42.42 7.81 Favored Glycine 0 C--N 1.349 1.281 0 CA-C-N 116.418 -0.355 . . . . 0.0 113.474 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -142.05 12.54 2.02 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.032 0.933 . . . . 0.0 111.33 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.497 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -50.66 114.08 4.29 Favored Pre-proline 0 CA--C 1.566 1.586 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -176.028 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.534 ' HG2' ' HB2' ' A' ' 49' ' ' PHE . 12.0 Cg_exo -74.92 177.04 9.09 Favored 'Trans proline' 0 CA--C 1.57 2.296 0 C-N-CA 123.978 3.119 . . . . 0.0 112.651 170.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.479 ' HA ' ' HB3' ' A' ' 118' ' ' HIS . 65.5 Cg_endo -70.55 152.59 65.32 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.178 1.919 . . . . 0.0 113.715 174.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 14.9 p -138.1 167.68 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 124.294 1.038 . . . . 0.0 109.461 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.534 HG21 ' HD2' ' A' ' 77' ' ' ARG . 16.6 m -90.7 135.69 25.96 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 123.159 0.584 . . . . 0.0 111.231 169.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 12.5 mt -90.9 -36.9 13.89 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.598 0.713 . . . . 0.0 109.532 161.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -78.99 13.57 1.71 Allowed 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 125.093 1.357 . . . . 0.0 113.671 -171.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.477 ' HB3' HG21 ' A' ' 98' ' ' VAL . 46.3 t -147.01 -39.82 0.2 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.124 0.569 . . . . 0.0 111.279 179.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.7 m -61.78 130.14 44.32 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 122.697 0.399 . . . . 0.0 111.248 174.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -75.81 161.41 29.04 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.061 0.545 . . . . 0.0 111.957 -177.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.409 ' HA ' HD13 ' A' ' 107' ' ' LEU . 13.8 mptt -70.97 -17.5 62.65 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.532 0.733 . . . . 0.0 112.126 178.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' A' ' 40' ' ' THR . 49.6 m -60.82 -26.94 67.69 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.269 0.628 . . . . 0.0 111.938 174.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.431 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -61.72 -32.56 72.79 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.729 0.811 . . . . 0.0 112.587 176.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 104' ' ' LYS . 9.5 mp -62.75 1.86 0.35 Allowed 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 125.027 1.331 . . . . 0.0 114.534 -174.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -96.12 -28.81 14.42 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.397 0.679 . . . . 0.0 110.214 177.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -97.64 -43.8 7.05 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.139 1.375 . . . . 0.0 109.139 -177.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.78 HG21 HD21 ' A' ' 115' ' ' LEU . 35.5 m -93.39 -171.25 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 122.087 0.946 . . . . 0.0 110.646 163.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 44.7 t -115.39 154.29 29.48 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 114.549 -1.205 . . . . 0.0 108.566 155.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.0 tt -48.8 -36.02 15.73 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.762 0.825 . . . . 0.0 111.513 170.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.64 74.63 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 123.937 0.895 . . . . 0.0 113.388 -177.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.72 -42.38 91.17 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.373 0.606 . . . . 0.0 110.463 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.78 HD21 HG21 ' A' ' 110' ' ' VAL . 6.4 mt -66.36 -52.43 46.98 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.791 -178.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.38 -25.11 63.1 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.173 0.989 . . . . 0.0 112.505 -174.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -60.78 -26.26 67.13 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 170.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 96' ' ' PRO . 78.0 m80 -132.54 26.68 4.41 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.76 0.824 . . . . 0.0 112.16 -177.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -166.68 155.8 10.84 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.125 0.97 . . . . 0.0 110.387 176.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.507 HD11 HD11 ' A' ' 123' ' ' LEU . 2.4 pt? -140.58 161.57 53.88 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 122.875 0.47 . . . . 0.0 110.79 175.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -49.68 139.09 31.9 Favored 'Trans proline' 0 C--N 1.378 2.088 0 C-N-CA 123.317 2.678 . . . . 0.0 113.265 165.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 9.9 p -65.48 126.53 24.78 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.339 0 CA-C-O 121.252 0.548 . . . . 0.0 110.049 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.507 HD11 HD11 ' A' ' 120' ' ' LEU . 5.3 mp -72.93 100.74 3.01 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.733 0.813 . . . . 0.0 112.069 -163.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.03 -21.13 12.14 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.074 0.949 . . . . 0.0 111.544 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -128.21 178.98 5.86 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.619 0.767 . . . . 0.0 111.844 173.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 55.3 t60 -72.93 134.06 44.6 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.096 0.958 . . . . 0.0 112.746 -171.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -121.93 171.17 9.12 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.611 1.165 . . . . 0.0 108.665 166.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 66.97 98.99 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.305 1.042 . . . . 0.0 111.203 -174.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -160.69 167.06 27.71 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.051 0.94 . . . . 0.0 110.92 -176.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 . . . . . 0 CA--C 1.564 1.499 0 C-N-CA 123.24 0.616 . . . . 0.0 110.606 176.793 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -74.3 107.48 2.28 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 120.178 -0.235 . . . . 0.0 112.903 176.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -72.3 115.55 11.68 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.199 0.599 . . . . 0.0 110.394 176.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.57 108.87 3.09 Favored Glycine 0 C--N 1.347 1.191 0 O-C-N 123.187 0.304 . . . . 0.0 112.934 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -90.24 143.6 26.62 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -153.27 121.16 6.06 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.631 0.372 . . . . 0.0 111.767 -174.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.416 HG12 ' NE2' ' A' ' 34' ' ' GLN . 1.9 t 52.67 20.22 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.897 0 C-N-CA 126.176 1.79 . . . . 0.0 114.117 173.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -71.41 -18.86 62.32 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.154 0.981 . . . . 0.0 113.128 -178.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 161.29 89.71 0.07 OUTLIER Glycine 0 CA--C 1.53 0.987 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -156.61 -48.49 0.07 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.626 0.77 . . . . 0.0 111.765 -171.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -86.19 -171.27 3.48 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.579 0.751 . . . . 0.0 109.542 -176.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.3 mp -80.48 71.07 7.3 Favored 'General case' 0 CA--C 1.555 1.14 0 O-C-N 121.173 -0.954 . . . . 0.0 110.348 174.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -59.86 -47.36 86.06 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.321 0.648 . . . . 0.0 109.472 169.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.1 p -148.17 141.8 18.99 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.953 0.901 . . . . 0.0 109.317 169.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.647 ' HA ' ' HD2' ' A' ' 28' ' ' PHE . 42.0 t -147.32 122.46 10.17 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.236 0.614 . . . . 0.0 111.061 -177.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.476 ' HB2' ' HB3' ' A' ' 26' ' ' ASN . 29.9 p -84.76 144.95 28.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.424 0.69 . . . . 0.0 111.753 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 74.0 m -69.44 -15.59 63.31 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.073 0.549 . . . . 0.0 112.121 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.05 127.99 93.54 Favored Pre-proline 0 CA--C 1.558 1.274 0 C-N-CA 123.575 0.75 . . . . 0.0 111.768 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -53.19 155.16 12.49 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 123.675 2.917 . . . . 0.0 114.198 176.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 85.4 mtp 63.03 46.95 4.45 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.34 1.056 . . . . 0.0 111.846 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.0 p -51.9 96.51 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 123.738 0.815 . . . . 0.0 112.433 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.402 ' H ' ' HG3' ' A' ' 25' ' ' ARG . . . -158.87 -101.92 0.18 Allowed Glycine 0 C--N 1.347 1.148 0 CA-C-N 116.316 -0.402 . . . . 0.0 112.642 -176.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 48.9 t90 -70.56 93.24 0.89 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.71 0.804 . . . . 0.0 111.389 -176.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 61.66 -76.44 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.417 1.487 . . . . 0.0 112.742 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.402 ' HG3' ' H ' ' A' ' 22' ' ' GLY . 1.7 mmp_? 69.2 -76.13 0.06 Allowed 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 125.016 1.326 . . . . 0.0 112.896 175.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.476 ' HB3' ' HB2' ' A' ' 16' ' ' CYS . 5.0 t30 -155.16 10.48 0.32 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.658 0.783 . . . . 0.0 109.893 177.136 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 129.58 64.38 0.11 Allowed Glycine 0 C--N 1.351 1.386 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.774 -175.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.647 ' HD2' ' HA ' ' A' ' 15' ' ' CYS . 41.5 t80 -145.52 138.78 26.31 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.656 0.782 . . . . 0.0 109.048 174.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.0 t -154.11 -35.76 0.1 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.126 0.57 . . . . 0.0 110.8 171.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 60.53 29.46 19.03 Favored 'General case' 0 N--CA 1.501 2.115 0 CA-C-O 123.013 1.387 . . . . 0.0 112.412 172.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.9 t -135.88 16.67 3.29 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 122.392 1.091 . . . . 0.0 109.05 171.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -88.38 145.85 25.58 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 113.923 -1.49 . . . . 0.0 108.87 -177.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.411 HG21 ' SG ' ' A' ' 79' ' ' CYS . 48.5 t -86.43 74.4 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.171 0 CA-C-O 121.123 0.487 . . . . 0.0 111.127 -176.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.416 ' NE2' HG12 ' A' ' 7' ' ' VAL . 78.3 mm-40 64.03 -65.99 0.12 Allowed 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 126.113 1.765 . . . . 0.0 115.354 166.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -52.38 148.43 6.74 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 124.726 1.211 . . . . 0.0 114.084 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.757 ' HD3' ' H ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -86.74 118.37 26.1 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.905 0.882 . . . . 0.0 111.154 -177.174 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 129.13 -168.68 20.73 Favored Glycine 0 N--CA 1.477 1.411 0 CA-C-N 116.113 -0.494 . . . . 0.0 113.46 177.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.1 m 61.65 -172.39 0.15 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.477 1.111 . . . . 0.0 112.456 -179.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -126.3 174.62 8.43 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.939 0.896 . . . . 0.0 109.911 171.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.2 m -93.11 105.9 17.93 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.038 0.447 . . . . 0.0 110.742 -172.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.9 t -125.62 122.8 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.708 0.803 . . . . 0.0 110.448 176.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 79.4 m -121.08 107.29 12.44 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 168.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.5 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -136.18 142.89 44.17 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.147 0.979 . . . . 0.0 108.645 179.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.452 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 17.4 tt0 -122.02 110.02 15.3 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.808 0.337 . . . . 0.0 110.548 -171.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.617 ' HB2' HD11 ' A' ' 50' ' ' LEU . 42.7 mmm -89.56 136.02 33.27 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.803 0.841 . . . . 0.0 109.157 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 14.7 t -82.23 159.98 23.1 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 176.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.471 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 31.7 tt0 -54.57 -32.07 57.82 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.364 0.666 . . . . 0.0 112.601 -172.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -57.29 -37.55 72.6 Favored 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -175.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -76.01 -39.83 54.91 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.617 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.3 mp -68.41 -25.02 64.83 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 120.97 0.414 . . . . 0.0 110.765 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.471 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 94.1 mt -74.98 -44.75 46.48 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.483 1.113 . . . . 0.0 109.835 170.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -55.99 -39.53 71.98 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.915 0.486 . . . . 0.0 111.006 174.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.0 t -66.1 -42.21 89.56 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.741 0.816 . . . . 0.0 111.892 -176.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.522 ' HB2' ' HA ' ' A' ' 59' ' ' ASP . 7.8 ptm180 -77.68 -47.66 18.65 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 179.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -69.46 -19.09 63.77 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.169 0.988 . . . . 0.0 113.012 -176.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -69.97 -32.57 70.86 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 122.701 0.4 . . . . 0.0 111.499 176.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -119.34 -81.89 0.75 Allowed Glycine 0 C--N 1.352 1.453 0 CA-C-N 116.655 -0.248 . . . . 0.0 113.543 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -138.06 -79.9 0.35 Allowed 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 124.028 0.931 . . . . 0.0 110.528 -179.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.522 ' HA ' ' HB2' ' A' ' 54' ' ' ARG . 6.9 p-10 -167.91 121.34 0.92 Allowed 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 123.94 0.896 . . . . 0.0 110.593 175.118 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 94.2 mt -110.75 -65.6 1.15 Allowed 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.857 0.863 . . . . 0.0 110.337 174.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 44.3 ttp -80.5 91.02 5.7 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-O 121.049 0.452 . . . . 0.0 109.834 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.467 HG21 ' HB2' ' A' ' 59' ' ' ASP . 4.7 p -145.65 163.29 32.25 Favored Pre-proline 0 N--CA 1.49 1.533 0 C-N-CA 124.609 1.164 . . . . 0.0 110.409 -178.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -60.89 86.4 0.08 OUTLIER 'Trans proline' 0 C--N 1.39 2.734 0 C-N-CA 123.015 2.477 . . . . 0.0 112.434 173.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.645 ' HB3' ' HB2' ' A' ' 67' ' ' PHE . 27.0 mmt180 -122.08 74.47 38.69 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 124.425 1.09 . . . . 0.0 109.383 178.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.87 -33.87 9.44 Favored 'Trans proline' 0 C--N 1.371 1.746 0 C-N-CA 122.406 2.071 . . . . 0.0 113.358 -169.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -97.09 -5.44 37.4 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.089 0.955 . . . . 0.0 111.783 -178.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.645 ' HB2' ' HB3' ' A' ' 64' ' ' ARG . 59.6 m-85 -108.87 -30.79 7.95 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.753 0.821 . . . . 0.0 111.115 -176.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.481 HD21 ' HA3' ' A' ' 71' ' ' GLY . 7.7 t30 -154.27 96.53 1.94 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.86 0.864 . . . . 0.0 109.934 -175.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.403 ' HB3' ' HD3' ' A' ' 70' ' ' PRO . 85.7 t80 -74.56 -49.68 4.83 Favored Pre-proline 0 CA--C 1.573 1.856 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.644 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.403 ' HD3' ' HB3' ' A' ' 69' ' ' PHE . 33.6 Cg_endo -91.57 -93.95 0.0 OUTLIER 'Trans proline' 0 C--N 1.394 2.963 0 C-N-CA 122.219 1.946 . . . . 0.0 112.259 173.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.481 ' HA3' HD21 ' A' ' 68' ' ' ASN . . . 72.74 -9.35 6.36 Favored Glycine 0 C--N 1.358 1.788 0 N-CA-C 115.537 0.975 . . . . 0.0 115.537 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 72' ' ' LEU . 4.2 mm? 64.63 108.91 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 125.048 1.339 . . . . 0.0 112.609 -174.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.05 167.71 11.06 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 173.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.67 125.69 24.65 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.407 0.683 . . . . 0.0 112.344 -176.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 99.8 2.28 56.23 Favored Glycine 0 CA--C 1.537 1.465 0 N-CA-C 114.738 0.655 . . . . 0.0 114.738 -177.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -97.14 109.27 22.06 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 117.96 0.88 . . . . 0.0 111.834 173.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.452 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 27.6 ptt-85 -90.95 87.84 6.78 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-O 122.079 0.943 . . . . 0.0 109.482 168.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -166.75 118.67 0.97 Allowed 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.67 -167.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.411 ' SG ' HG21 ' A' ' 33' ' ' VAL . 73.5 m 50.03 22.47 0.91 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 178.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.5 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -59.08 -31.03 68.51 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.823 0.849 . . . . 0.0 112.103 -169.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 42.4 t 67.11 113.53 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.685 1.194 . . . . 0.0 110.613 -172.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.86 -29.42 66.95 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -172.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.7 t -63.69 -33.23 75.18 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.466 0.706 . . . . 0.0 112.417 177.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -66.09 -41.83 90.13 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.624 0.769 . . . . 0.0 111.406 177.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.511 ' NE1' HD23 ' A' ' 115' ' ' LEU . 1.5 t-105 -69.26 -49.34 56.99 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 123.107 0.563 . . . . 0.0 110.822 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -52.98 -41.79 64.92 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.783 0.833 . . . . 0.0 111.397 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -64.12 -24.57 67.74 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.596 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.43 82.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.086 0.555 . . . . 0.0 111.477 176.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -65.03 -43.59 91.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.197 0.599 . . . . 0.0 110.552 173.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -68.0 -22.64 64.99 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.95 0.9 . . . . 0.0 111.665 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.6 -3.68 56.49 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.916 0.886 . . . . 0.0 112.206 173.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.03 41.2 23.05 Favored Glycine 0 C--N 1.352 1.444 0 C-N-CA 122.937 0.303 . . . . 0.0 113.25 -178.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 1.8 mmt -130.19 -78.02 0.54 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.501 0.721 . . . . 0.0 110.879 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.74 94.39 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.262 0 C-N-CA 124.624 1.169 . . . . 0.0 112.69 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -74.27 158.02 45.3 Favored 'Trans proline' 0 CA--C 1.567 2.13 0 C-N-CA 122.533 2.155 . . . . 0.0 112.663 170.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -59.6 111.42 0.94 Allowed 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 122.295 1.997 . . . . 0.0 113.1 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 6.6 p -95.07 149.49 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.41 0 C-N-CA 123.914 0.886 . . . . 0.0 111.318 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.5 p -80.32 91.79 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.574 1.865 0 CA-C-O 122.259 1.028 . . . . 0.0 113.036 -173.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.455 HD21 ' HB3' ' A' ' 115' ' ' LEU . 3.4 mm? -70.48 -22.08 62.7 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -178.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -73.91 -17.61 61.01 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 71.6 m -124.92 -4.78 7.51 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 96.7 m -71.0 126.42 29.53 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.422 0.556 . . . . 0.0 111.388 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -85.38 157.74 20.43 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.549 0.74 . . . . 0.0 111.712 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -58.07 -31.83 67.45 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.804 1.242 . . . . 0.0 113.488 -176.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 73.4 m -60.87 -29.13 69.36 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.2 70.74 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.312 0.645 . . . . 0.0 112.611 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.18 -24.68 65.9 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.834 0.854 . . . . 0.0 111.995 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -68.42 -18.14 64.37 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.928 0.491 . . . . 0.0 111.678 178.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -102.81 -53.07 2.93 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.101 0.96 . . . . 0.0 110.803 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.723 HG23 ' HB3' ' A' ' 114' ' ' ASP . 0.9 OUTLIER -99.34 -37.22 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 C-N-CA 122.625 0.37 . . . . 0.0 111.901 -172.481 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.1 t 73.25 134.37 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 125.135 1.522 . . . . 0.0 110.817 -166.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' A' ' 115' ' ' LEU . 5.5 tt -45.88 -29.46 1.39 Allowed 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -175.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.62 -34.84 74.83 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.731 0.412 . . . . 0.0 112.07 -179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.723 ' HB3' HG23 ' A' ' 110' ' ' VAL . 27.7 t70 -73.74 -40.44 63.53 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.568 0.747 . . . . 0.0 111.073 177.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.593 HD12 ' HA ' ' A' ' 112' ' ' LEU . 82.1 mt -54.93 -51.84 64.84 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.205 1.002 . . . . 0.0 111.36 173.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -75.34 -22.79 57.34 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.29 -1.323 . . . . 0.0 112.492 -176.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -54.23 -19.4 5.17 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 172.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -138.76 21.01 2.68 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 174.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -142.55 -172.82 3.71 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.772 -0.58 . . . . 0.0 111.329 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.421 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 4.0 pp -63.47 149.84 91.15 Favored Pre-proline 0 CA--C 1.562 1.421 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -177.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 120' ' ' LEU . 4.6 Cg_exo -77.56 149.41 27.05 Favored 'Trans proline' 0 C--N 1.379 2.156 0 C-N-CA 122.586 2.191 . . . . 0.0 112.444 174.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 8.7 p -100.98 120.18 50.15 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 CA-C-O 121.504 0.669 . . . . 0.0 109.652 171.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 49.3 tp -108.05 125.66 51.82 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.472 0.709 . . . . 0.0 110.018 176.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -83.74 162.63 20.61 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-O 121.296 0.569 . . . . 0.0 111.24 174.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -88.1 -66.31 0.93 Allowed 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 167.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -144.41 152.17 40.29 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.412 1.085 . . . . 0.0 108.706 171.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -63.52 -73.85 0.11 Allowed 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 121.177 0.513 . . . . 0.0 110.177 174.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -170.11 60.88 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.174 1.39 . . . . 0.0 108.484 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 67.5 m80 58.63 -93.29 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.071 1.348 . . . . 0.0 111.903 -170.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 . . . . . 0 CA--C 1.572 1.827 0 C-N-CA 124.697 1.199 . . . . 0.0 112.261 -175.179 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 120.482 0.182 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.1 -140.08 3.87 Favored Glycine 0 C--N 1.344 0.981 0 N-CA-C 112.028 -0.429 . . . . 0.0 112.028 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -94.91 89.38 5.61 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 117.996 0.898 . . . . 0.0 111.453 179.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -98.88 -153.76 28.41 Favored Glycine 0 N--CA 1.473 1.13 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 167.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -95.37 117.58 30.59 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 117.826 0.813 . . . . 0.0 109.973 174.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.5 p-10 -135.69 98.69 3.98 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.588 -178.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.8 t 61.13 -0.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.584 2.278 0 C-N-CA 125.891 1.677 . . . . 0.0 114.062 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.408 ' H ' ' HG ' ' A' ' 8' ' ' LEU . 3.5 pp -89.1 5.06 46.26 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.928 0.891 . . . . 0.0 112.79 -174.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.79 -110.34 0.3 Allowed Glycine 0 CA--C 1.532 1.123 0 N-CA-C 111.773 -0.531 . . . . 0.0 111.773 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -142.41 123.39 14.45 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.751 0.821 . . . . 0.0 110.287 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -175.93 137.18 0.32 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.945 0.898 . . . . 0.0 110.248 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 63.91 -83.05 0.03 OUTLIER 'General case' 0 CA--C 1.568 1.652 0 C-N-CA 124.656 1.182 . . . . 0.0 110.484 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 52.2 94.78 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 125.22 1.408 . . . . 0.0 113.27 176.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 14.4 p -137.82 168.4 20.64 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.357 0 C-N-CA 123.54 0.736 . . . . 0.0 111.913 -164.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 45.9 t -69.34 -13.87 62.61 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.687 1.195 . . . . 0.0 112.424 172.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.9 t 82.96 131.26 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 126.409 1.884 . . . . 0.0 112.011 177.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.564 ' HB3' HG23 ' A' ' 21' ' ' THR . 39.8 t -171.6 -48.04 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.753 1.221 . . . . 0.0 109.344 -175.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -155.44 160.62 30.71 Favored Pre-proline 0 CA--C 1.557 1.228 0 C-N-CA 124.537 1.135 . . . . 0.0 109.42 176.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -44.32 -50.12 8.19 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 123.256 2.637 . . . . 0.0 114.947 172.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 23.7 ptp -88.05 -27.36 22.05 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.501 0.32 . . . . 0.0 111.023 173.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.564 HG23 ' HB3' ' A' ' 17' ' ' CYS . 90.1 m 65.22 -75.63 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 125.416 1.487 . . . . 0.0 112.179 -174.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -170.66 137.18 4.3 Favored Glycine 0 C--N 1.349 1.261 0 CA-C-O 119.597 -0.557 . . . . 0.0 112.474 -178.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -61.75 -25.8 67.68 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -76.26 81.14 3.03 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.259 0.623 . . . . 0.0 109.692 171.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? 62.52 85.93 0.12 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.763 1.225 . . . . 0.0 112.067 -171.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -59.27 -28.05 66.38 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.888 0.875 . . . . 0.0 111.204 176.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -96.3 63.38 1.18 Allowed Glycine 0 CA--C 1.538 1.494 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.645 170.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -52.5 107.67 0.23 Allowed 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.645 0.778 . . . . 0.0 111.755 168.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.6 t -89.01 58.46 4.57 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.315 0.579 . . . . 0.0 110.6 177.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 57.07 17.39 3.41 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 125.08 1.352 . . . . 0.0 113.189 -174.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 61.2 m -109.43 98.01 7.48 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.243 0.617 . . . . 0.0 111.154 -174.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -87.37 138.53 31.4 Favored 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 165.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.585 HG22 HH11 ' A' ' 108' ' ' ARG . 11.8 p -68.9 -31.09 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.429 0 C-N-CA 123.383 0.673 . . . . 0.0 112.708 -173.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -140.89 -43.4 0.39 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.066 0.546 . . . . 0.0 111.558 -175.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.4 t70 70.47 161.85 0.23 Allowed 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.277 1.431 . . . . 0.0 112.415 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -75.53 -51.83 12.04 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.981 0.512 . . . . 0.0 111.356 -179.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.97 -62.26 1.94 Allowed Glycine 0 C--N 1.35 1.332 0 CA-C-N 116.301 -0.408 . . . . 0.0 112.556 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.3 t -158.06 136.55 11.1 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.175 0.59 . . . . 0.0 110.864 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.5 p80 -56.8 149.9 17.31 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.854 0.862 . . . . 0.0 112.539 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.2 t -95.44 114.65 26.44 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 121.448 0.642 . . . . 0.0 111.54 -171.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.473 HG11 ' HB2' ' A' ' 82' ' ' ALA . 82.2 t -140.38 110.33 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.214 1.006 . . . . 0.0 108.747 174.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 71.9 m -95.99 105.53 17.57 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 175.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.543 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -143.38 151.25 40.2 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.084 1.354 . . . . 0.0 108.26 -178.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.532 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 24.2 tt0 -125.24 108.52 11.82 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.013 0.824 . . . . 0.0 112.245 -174.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 70.6 mtp -87.41 135.22 33.42 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.355 0.662 . . . . 0.0 109.522 169.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.564 HG23 ' HD1' ' A' ' 49' ' ' PHE . 0.9 OUTLIER -91.63 155.18 18.52 Favored 'General case' 0 N--CA 1.502 2.142 0 CA-C-N 118.154 0.433 . . . . 0.0 110.734 -179.952 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -56.11 -32.1 63.89 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.944 0.898 . . . . 0.0 113.024 -169.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -53.69 -45.04 70.24 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.584 0.707 . . . . 0.0 110.621 178.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.564 ' HD1' HG23 ' A' ' 46' ' ' THR . 86.7 m-85 -78.58 -35.16 46.23 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.958 1.303 . . . . 0.0 113.899 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.9 mp -68.08 -42.22 80.71 Favored 'General case' 0 N--CA 1.499 2.011 0 CA-C-N 119.365 0.984 . . . . 0.0 110.727 177.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 83.5 mt -67.93 -37.34 81.53 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.072 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.406 ' HD2' ' SD ' ' A' ' 93' ' ' MET . 68.9 t80 -65.9 -39.35 90.52 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.261 0.624 . . . . 0.0 111.425 176.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 43.8 t -61.77 -44.68 96.41 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.612 0.765 . . . . 0.0 110.694 177.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.415 ' HG3' ' HA ' ' A' ' 59' ' ' ASP . 63.0 ttt180 -61.26 -47.37 86.35 Favored 'General case' 0 CA--C 1.559 1.304 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.278 175.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -71.73 -27.87 63.29 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 124.11 0.964 . . . . 0.0 112.284 -175.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.6 ttt85 -68.06 -44.21 76.89 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.643 0.777 . . . . 0.0 111.121 -175.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -96.19 -92.69 1.8 Allowed Glycine 0 CA--C 1.532 1.117 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.204 175.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -145.61 -59.27 0.33 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.765 1.226 . . . . 0.0 108.512 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.415 ' HA ' ' HG3' ' A' ' 54' ' ' ARG . 7.2 t0 -156.53 115.45 3.41 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.172 173.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 82.5 mt -119.37 7.73 11.27 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.338 0.655 . . . . 0.0 111.367 175.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 13.3 tmm? 176.78 111.72 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.09 1.356 . . . . 0.0 108.885 -178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.5 m -93.38 105.95 18.19 Favored Pre-proline 0 N--CA 1.495 1.806 0 C-N-CA 122.783 0.433 . . . . 0.0 110.671 176.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -82.32 -49.77 0.05 OUTLIER 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.47 2.113 . . . . 0.0 113.504 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 75.8 mtt-85 66.31 136.02 0.04 OUTLIER Pre-proline 0 N--CA 1.493 1.702 0 C-N-CA 125.331 1.452 . . . . 0.0 113.041 -172.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.35 45.78 2.03 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 122.739 2.292 . . . . 0.0 112.753 172.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -136.54 163.71 29.89 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 125.713 1.605 . . . . 0.0 107.847 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -84.86 37.67 0.67 Allowed 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 123.355 0.662 . . . . 0.0 112.383 -175.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -66.75 -44.07 82.44 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 124.236 1.014 . . . . 0.0 112.436 -176.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.4 t80 63.84 100.0 0.04 OUTLIER Pre-proline 0 CA--C 1.564 1.494 0 C-N-CA 125.165 1.386 . . . . 0.0 112.705 -176.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -77.51 159.29 32.38 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 123.032 2.488 . . . . 0.0 112.846 169.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.49 112.3 4.7 Favored Glycine 0 C--N 1.352 1.458 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 171.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.5 mp 66.54 133.64 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.459 1.104 . . . . 0.0 111.175 -164.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.84 175.97 10.8 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.327 0.651 . . . . 0.0 111.623 -177.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.06 131.46 50.66 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -173.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 66.4 40.95 94.65 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.486 -0.779 . . . . 0.0 113.464 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -124.94 104.88 8.83 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 122.854 0.461 . . . . 0.0 110.247 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.532 ' HB2' ' HB2' ' A' ' 44' ' ' GLU . 0.1 OUTLIER -83.5 88.03 7.0 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 122.813 0.445 . . . . 0.0 110.024 174.934 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -168.61 120.79 0.81 Allowed 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 124.261 1.024 . . . . 0.0 110.115 177.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 39.3 t 53.36 26.4 5.32 Favored 'General case' 0 N--CA 1.5 2.066 0 C-N-CA 124.687 1.195 . . . . 0.0 112.937 174.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.543 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.1 tm? -62.77 131.39 48.73 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.451 1.1 . . . . 0.0 111.041 -176.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 42.6 t -63.06 101.4 0.28 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.644 0.778 . . . . 0.0 111.394 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.473 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -59.08 -25.95 64.23 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.722 0.809 . . . . 0.0 112.297 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.5 m -69.33 -39.88 77.92 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.718 0.807 . . . . 0.0 112.029 174.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -74.99 -32.76 61.74 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.172 0.589 . . . . 0.0 111.338 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.571 ' HE1' HD23 ' A' ' 115' ' ' LEU . 3.4 t-105 -65.1 -46.73 79.87 Favored 'General case' 0 CA--C 1.567 1.598 0 C-N-CA 123.456 0.702 . . . . 0.0 109.377 171.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -57.49 -44.45 84.96 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.12 0.968 . . . . 0.0 111.576 174.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -60.25 -34.82 74.24 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.056 0.942 . . . . 0.0 111.42 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.89 -39.12 87.38 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 122.927 0.491 . . . . 0.0 111.739 175.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -66.76 -39.78 88.0 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 121.074 0.464 . . . . 0.0 110.715 176.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -69.22 -28.44 66.35 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 123.728 0.811 . . . . 0.0 111.425 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.18 -5.68 57.99 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.852 0.861 . . . . 0.0 111.978 173.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 92.76 -20.94 41.91 Favored Glycine 0 C--N 1.353 1.497 0 N-CA-C 114.226 0.45 . . . . 0.0 114.226 177.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . 0.406 ' SD ' ' HD2' ' A' ' 52' ' ' PHE . 6.3 ptm -71.27 -87.92 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.773 0 C-N-CA 124.03 0.932 . . . . 0.0 112.59 -177.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 61.58 112.67 0.02 OUTLIER Pre-proline 0 N--CA 1.496 1.849 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -67.69 176.72 4.77 Favored 'Trans proline' 0 N--CA 1.507 2.304 0 C-N-CA 123.498 2.799 . . . . 0.0 113.661 170.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -82.01 134.47 8.23 Favored 'Trans proline' 0 C--N 1.381 2.267 0 C-N-CA 122.402 2.068 . . . . 0.0 111.897 166.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.9 p -122.79 143.74 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.912 0.885 . . . . 0.0 110.179 177.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.3 p -94.65 120.2 43.72 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.652 0 C-N-CA 123.216 0.606 . . . . 0.0 111.852 -178.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 95.4 mt -61.0 -45.82 93.28 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.161 0.985 . . . . 0.0 113.384 -176.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -75.14 14.75 0.5 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.988 0.915 . . . . 0.0 113.451 -172.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.2 t -137.39 -5.73 1.8 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 123.521 0.728 . . . . 0.0 112.07 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 53.5 m -91.24 124.2 35.26 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.029 0.532 . . . . 0.0 110.888 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.8 mp0 -66.39 154.6 39.71 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.001 0.52 . . . . 0.0 112.194 175.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 1.4 tmtp? -67.17 -19.32 65.56 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 123.633 0.773 . . . . 0.0 111.545 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 42.9 t -56.43 -26.68 54.35 Favored 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 123.715 0.806 . . . . 0.0 111.918 176.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.37 73.73 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.956 0.902 . . . . 0.0 112.692 174.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 10.6 mp -62.9 -6.82 4.16 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -173.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.585 HH11 HG22 ' A' ' 33' ' ' VAL . 59.6 mtp180 -83.67 -34.2 25.04 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 121.084 0.469 . . . . 0.0 111.526 172.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -102.21 -22.73 14.12 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.501 1.121 . . . . 0.0 111.524 -173.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.424 HG21 ' NE1' ' A' ' 85' ' ' TRP . 7.6 p -136.24 170.98 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 124.331 1.052 . . . . 0.0 108.756 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . 0.512 ' HB3' ' HB2' ' A' ' 114' ' ' ASP . 28.7 t -92.97 151.29 20.0 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 121.747 -0.596 . . . . 0.0 111.277 170.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.9 tt -59.9 -44.63 94.16 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.551 0.34 . . . . 0.0 110.196 167.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.07 -30.65 69.35 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.298 0.639 . . . . 0.0 111.356 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.512 ' HB2' ' HB3' ' A' ' 111' ' ' SER . 5.5 t70 -67.1 -41.01 86.98 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.588 1.155 . . . . 0.0 110.45 175.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.571 HD23 ' HE1' ' A' ' 85' ' ' TRP . 71.3 mt -66.33 -53.48 35.88 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.845 0.858 . . . . 0.0 110.509 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.46 ' HA ' ' HB3' ' A' ' 119' ' ' ALA . 11.3 mt-30 -69.47 -28.03 65.74 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.445 1.098 . . . . 0.0 111.947 -173.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -55.2 -37.03 66.56 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.283 0.633 . . . . 0.0 112.43 171.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -113.22 30.26 7.34 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.757 0.823 . . . . 0.0 111.455 178.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.46 ' HB3' ' HA ' ' A' ' 116' ' ' GLN . . . -139.14 177.99 7.5 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.423 HD23 ' H ' ' A' ' 120' ' ' LEU . 2.6 pt? -85.27 163.12 46.52 Favored Pre-proline 0 CA--C 1.562 1.418 0 C-N-CA 124.096 0.958 . . . . 0.0 111.962 177.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_exo -51.85 115.21 1.98 Allowed 'Trans proline' 0 C--N 1.375 1.956 0 C-N-CA 123.133 2.556 . . . . 0.0 113.748 162.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.3 p -86.26 129.48 38.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 122.618 0.367 . . . . 0.0 110.364 174.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.0 pp -151.6 143.34 23.69 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.342 0.657 . . . . 0.0 112.061 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -160.96 140.17 10.41 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.631 0.772 . . . . 0.0 110.981 174.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -157.71 131.35 7.89 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.931 0.492 . . . . 0.0 110.886 173.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -110.92 147.67 34.13 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.605 1.162 . . . . 0.0 108.798 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -144.28 -59.82 0.38 Allowed 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -173.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 56.7 m80 70.2 149.19 0.08 Allowed 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 124.863 1.265 . . . . 0.0 112.266 -168.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -99.03 125.82 44.6 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.505 0.722 . . . . 0.0 110.073 176.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 55.8 t60 . . . . . 0 CA--C 1.568 1.643 0 C-N-CA 123.404 0.682 . . . . 0.0 110.943 178.458 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.8 ttm . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 120.463 0.173 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.65 118.18 0.81 Allowed Glycine 0 CA--C 1.533 1.205 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 177.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -72.24 123.9 23.92 Favored 'General case' 0 CA--C 1.556 1.201 0 CA-C-N 117.326 0.563 . . . . 0.0 112.087 -177.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.66 141.82 32.65 Favored Glycine 0 CA--C 1.539 1.543 0 CA-C-N 115.918 -0.583 . . . . 0.0 113.521 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -147.53 155.6 42.02 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.345 0.658 . . . . 0.0 111.532 -176.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -117.35 177.3 4.79 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -170.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 m -89.65 -14.12 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 124.593 1.157 . . . . 0.0 111.325 -174.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.41 HD13 ' HB3' ' A' ' 11' ' ' ASP . 43.0 mt -62.73 -55.11 29.72 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.619 1.168 . . . . 0.0 112.914 -161.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 80.68 -51.48 4.27 Favored Glycine 0 N--CA 1.481 1.674 0 CA-C-O 121.589 0.549 . . . . 0.0 112.195 -174.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -151.66 119.67 6.24 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.153 1.381 . . . . 0.0 107.657 172.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.41 ' HB3' HD13 ' A' ' 8' ' ' LEU . 7.7 p-10 -104.71 -24.56 12.92 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.026 0.53 . . . . 0.0 111.437 -174.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -69.59 98.49 1.16 Allowed 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.387 0.675 . . . . 0.0 109.898 174.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -74.94 170.11 16.62 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.81 0.444 . . . . 0.0 110.876 172.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.631 HG22 ' H ' ' A' ' 16' ' ' CYS . 10.6 p -143.75 130.77 17.27 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 CA-C-O 120.887 0.375 . . . . 0.0 111.627 -173.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 90.3 m -69.9 -15.49 63.08 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.542 0.737 . . . . 0.0 112.351 176.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.631 ' H ' HG22 ' A' ' 14' ' ' VAL . 60.6 m -71.62 -38.6 70.79 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 122.862 0.465 . . . . 0.0 112.081 174.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 52.8 t 66.93 -71.02 0.1 Allowed 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 125.47 1.508 . . . . 0.0 112.268 -174.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.607 ' H ' ' HD2' ' A' ' 19' ' ' PRO . . . -143.32 -49.23 0.02 OUTLIER Pre-proline 0 CA--C 1.572 1.799 0 C-N-CA 123.86 0.864 . . . . 0.0 112.733 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.607 ' HD2' ' H ' ' A' ' 18' ' ' ALA . 60.2 Cg_endo -68.1 160.3 49.3 Favored 'Trans proline' 0 C--N 1.399 3.204 0 C-N-CA 121.794 1.663 . . . . 0.0 113.797 174.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.0 57.53 2.43 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.231 1.012 . . . . 0.0 112.485 -167.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.8 t -69.76 -21.88 63.4 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 123.514 0.726 . . . . 0.0 112.56 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 170.36 -179.17 42.67 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-O 120.89 0.161 . . . . 0.0 113.426 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -94.09 -53.98 3.76 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.458 0.703 . . . . 0.0 109.856 175.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 67.57 -1.87 1.49 Allowed 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 125.84 1.656 . . . . 0.0 113.634 179.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 60.2 -70.12 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 125.548 1.539 . . . . 0.0 112.249 -173.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -61.51 -28.29 69.2 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.554 1.142 . . . . 0.0 112.001 175.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.68 -40.99 2.25 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.259 -176.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -126.94 96.59 4.67 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-O 121.925 0.869 . . . . 0.0 111.35 -177.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.0 p -172.36 -179.96 2.39 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.69 1.196 . . . . 0.0 110.619 178.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 63.74 83.06 0.17 Allowed 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.331 1.052 . . . . 0.0 111.619 -178.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 13.4 t -77.65 -13.39 59.92 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 171.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 60.49 -85.98 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 125.15 1.38 . . . . 0.0 112.446 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.263 10.4 p 44.19 -68.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 C-N-CA 127.049 2.14 . . . . 0.0 115.348 -172.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -174.29 -31.97 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 125.695 1.598 . . . . 0.0 108.91 -176.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -83.16 136.69 34.34 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 124.232 1.013 . . . . 0.0 111.821 -174.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -69.99 -33.09 71.61 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.709 0.804 . . . . 0.0 110.711 172.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.64 98.11 1.65 Allowed Glycine 0 CA--C 1.537 1.421 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.844 176.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.7 t -83.93 58.39 4.67 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.571 0.7 . . . . 0.0 111.346 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -132.3 31.1 4.12 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 124.598 1.159 . . . . 0.0 109.704 171.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.8 t -97.22 132.73 42.69 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.393 1.077 . . . . 0.0 111.935 -178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.604 HG11 ' HB2' ' A' ' 82' ' ' ALA . 42.3 t -139.5 110.6 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 C-N-CA 123.591 0.756 . . . . 0.0 110.618 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.8 m -108.23 106.92 17.31 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.631 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -142.27 151.31 41.91 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.45 0.7 . . . . 0.0 109.321 -168.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.465 ' HB2' ' HB3' ' A' ' 77' ' ' ARG . 29.1 tt0 -112.25 115.81 29.4 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.837 0.351 . . . . 0.0 111.667 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.443 ' HB3' HD11 ' A' ' 50' ' ' LEU . 75.5 mmm -95.19 114.84 26.68 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 170.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.695 ' HB ' ' HB2' ' A' ' 95' ' ' PRO . 92.4 m -83.56 147.73 27.59 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.34 0.656 . . . . 0.0 110.294 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.48 ' HG2' ' HG ' ' A' ' 51' ' ' LEU . 35.6 tt0 -47.31 -32.52 4.8 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -164.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -53.1 -41.87 65.39 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -76.08 -32.5 59.27 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.383 0.273 . . . . 0.0 111.595 175.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.598 HD22 ' HA ' ' A' ' 74' ' ' ALA . 5.3 mp -77.39 -22.54 51.48 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.803 0.441 . . . . 0.0 110.813 -177.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.48 ' HG ' ' HG2' ' A' ' 47' ' ' GLU . 70.2 mt -68.79 -46.82 67.72 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.811 1.244 . . . . 0.0 109.626 168.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -55.08 -48.77 73.08 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.427 1.091 . . . . 0.0 110.98 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -68.22 -28.46 67.27 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.117 0.967 . . . . 0.0 111.949 177.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.566 ' HA ' ' O ' ' A' ' 58' ' ' ASN . 50.0 ttt180 -69.23 -58.3 4.22 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.205 0.602 . . . . 0.0 111.833 -178.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -68.53 -11.58 60.08 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -176.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 58.2 ttt-85 -151.93 88.02 1.38 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.034 0.534 . . . . 0.0 109.681 173.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 151.95 -90.75 0.13 Allowed Glycine 0 C--N 1.353 1.485 0 CA-C-N 116.229 -0.441 . . . . 0.0 112.697 -179.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 54' ' ' ARG . 0.2 OUTLIER -139.93 156.83 46.48 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.735 0.814 . . . . 0.0 111.599 -177.701 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -63.19 -50.84 68.73 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -177.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.7 tm? 69.82 -70.46 0.14 Allowed 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 125.75 1.62 . . . . 0.0 111.544 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 56.6 mtt -61.38 -52.87 62.83 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.66 1.184 . . . . 0.0 112.898 -171.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.6 m 68.45 122.33 0.03 OUTLIER Pre-proline 0 N--CA 1.49 1.568 0 C-N-CA 124.46 1.104 . . . . 0.0 111.431 -179.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -78.0 41.38 1.0 Allowed 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 123.166 2.577 . . . . 0.0 114.051 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 75.1 mtp180 -120.64 142.57 34.5 Favored Pre-proline 0 N--CA 1.483 1.179 0 C-N-CA 124.517 1.127 . . . . 0.0 109.596 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -81.35 30.51 0.52 Allowed 'Trans proline' 0 C--N 1.376 2.001 0 C-N-CA 122.984 2.456 . . . . 0.0 112.932 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -125.04 126.55 45.57 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.996 1.318 . . . . 0.0 109.715 -170.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -112.26 82.91 1.71 Allowed 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.437 0.695 . . . . 0.0 109.494 -176.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -137.87 84.29 2.03 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.022 175.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -136.88 153.38 75.46 Favored Pre-proline 0 N--CA 1.487 1.425 0 C-N-CA 124.495 1.118 . . . . 0.0 110.338 -174.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -77.69 40.41 0.85 Allowed 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.853 2.369 . . . . 0.0 113.485 173.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -169.26 -144.08 4.11 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-N 116.652 -0.249 . . . . 0.0 113.008 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.473 HD12 ' HB3' ' A' ' 76' ' ' ASP . 2.3 pt? -140.75 -177.47 5.08 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.746 0.818 . . . . 0.0 111.34 -176.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.749 ' HG2' ' HB2' ' A' ' 76' ' ' ASP . 11.2 ptpt -106.5 -176.24 3.02 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.834 0.854 . . . . 0.0 111.973 -172.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.598 ' HA ' HD22 ' A' ' 50' ' ' LEU . . . -73.87 120.24 19.19 Favored 'General case' 0 CA--C 1.55 0.942 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.543 171.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 75.65 44.88 19.32 Favored Glycine 0 C--N 1.346 1.12 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.811 -176.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.749 ' HB2' ' HG2' ' A' ' 73' ' ' LYS . 14.5 t70 -119.93 149.14 42.6 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.227 0.611 . . . . 0.0 109.96 173.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.465 ' HB3' ' HB2' ' A' ' 44' ' ' GLU . 0.0 OUTLIER -135.54 91.68 2.75 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.206 0.602 . . . . 0.0 110.787 -174.713 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -179.61 123.8 0.08 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.551 1.141 . . . . 0.0 109.454 173.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.2 t 54.57 30.86 13.89 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.392 1.077 . . . . 0.0 112.706 177.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.631 HD12 ' HB3' ' A' ' 43' ' ' ALA . 2.4 tm? -68.6 131.77 45.78 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.697 0.799 . . . . 0.0 110.538 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 60.8 m -60.26 106.93 0.58 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.133 0.973 . . . . 0.0 110.761 176.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.604 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -64.5 -24.8 67.73 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.6 t -64.0 -34.01 77.02 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 122.756 0.422 . . . . 0.0 111.741 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -63.07 -37.99 89.38 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.82 0.848 . . . . 0.0 110.978 176.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -75.14 -50.62 15.74 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 124.279 1.032 . . . . 0.0 111.155 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.47 ' HB2' HG12 ' A' ' 110' ' ' VAL . 19.6 tp60 -49.1 -44.29 42.01 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.952 0.901 . . . . 0.0 112.07 173.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -69.61 -30.01 67.65 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.48 -43.13 91.21 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 122.822 0.449 . . . . 0.0 111.911 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.524 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 80.0 t80 -64.68 -41.37 96.1 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.134 0.574 . . . . 0.0 111.127 176.489 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -67.07 -29.94 69.85 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.612 0.765 . . . . 0.0 112.647 175.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.48 -14.7 56.7 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.598 0.759 . . . . 0.0 111.914 175.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 78.58 7.51 88.04 Favored Glycine 0 C--N 1.352 1.448 0 CA-C-N 116.25 -0.432 . . . . 0.0 113.318 -174.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 94.6 mmm -104.2 17.82 23.33 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.227 1.011 . . . . 0.0 112.075 -177.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.524 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . -52.06 108.56 1.1 Allowed Pre-proline 0 CA--C 1.569 1.701 0 C-N-CA 125.39 1.476 . . . . 0.0 114.439 178.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.695 ' HB2' ' HB ' ' A' ' 46' ' ' THR . 32.3 Cg_endo -86.56 168.06 8.6 Favored 'Trans proline' 0 CA--C 1.571 2.327 0 C-N-CA 123.06 2.507 . . . . 0.0 113.172 175.205 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.79 126.58 21.6 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.853 2.369 . . . . 0.0 114.803 176.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.2 p -115.43 175.61 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 125.381 1.472 . . . . 0.0 109.363 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.414 HG21 ' HB3' ' A' ' 101' ' ' SER . 10.0 m -95.67 161.1 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.435 0 O-C-N 121.625 -0.672 . . . . 0.0 110.612 165.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.46 HD11 ' HG2' ' A' ' 116' ' ' GLN . 7.7 mt -113.44 -29.73 7.11 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.214 1.006 . . . . 0.0 108.889 161.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -59.43 -46.06 89.79 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.802 1.241 . . . . 0.0 112.082 -173.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.414 ' HB3' HG21 ' A' ' 98' ' ' VAL . 28.1 t -96.63 -23.83 16.3 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.008 178.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 82.7 m -63.49 110.1 1.85 Allowed 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 120.855 0.359 . . . . 0.0 111.482 175.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.0 mp0 -65.59 155.65 35.15 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.947 0.899 . . . . 0.0 112.11 178.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -66.86 -16.61 64.42 Favored 'General case' 0 N--CA 1.5 2.03 0 C-N-CA 123.45 0.7 . . . . 0.0 112.057 179.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.4 t -61.34 -26.34 67.74 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.095 0.958 . . . . 0.0 112.302 173.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.497 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -54.66 -37.64 65.96 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.117 0.567 . . . . 0.0 112.084 174.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 7.0 mp -65.85 4.04 0.69 Allowed 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 124.956 1.303 . . . . 0.0 113.261 -176.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 65.1 mtp85 -98.69 -10.19 23.56 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.485 1.114 . . . . 0.0 110.848 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -121.06 -49.28 2.2 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.997 1.319 . . . . 0.0 108.611 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.838 HG21 HD21 ' A' ' 115' ' ' LEU . 32.6 m -90.1 -174.32 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 CA-C-O 122.101 0.953 . . . . 0.0 111.09 167.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.9 t -110.02 160.68 16.22 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.219 155.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.9 tt -53.58 -36.91 62.42 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.252 0.621 . . . . 0.0 112.39 173.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.36 -30.74 71.4 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -177.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -61.47 -46.36 90.39 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.307 0.575 . . . . 0.0 110.12 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.838 HD21 HG21 ' A' ' 110' ' ' VAL . 5.9 mt -66.55 -56.58 10.17 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.431 -175.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.46 ' HG2' HD11 ' A' ' 99' ' ' LEU . 3.2 mt-30 -65.84 -24.65 66.94 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.479 -170.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -51.17 -40.32 58.37 Favored 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 172.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -140.7 21.52 2.33 Favored 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 123.258 0.623 . . . . 0.0 112.639 -176.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -73.26 -30.34 63.37 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.625 HD23 ' H ' ' A' ' 120' ' ' LEU . 2.3 pt? -110.91 165.67 12.25 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 123.707 0.803 . . . . 0.0 110.795 -175.262 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -49.19 91.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.378 2.082 0 C-N-CA 122.828 2.352 . . . . 0.0 113.135 161.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 4.9 p -115.52 131.07 68.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.986 0.915 . . . . 0.0 110.729 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.7 pp -141.63 157.56 44.93 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.796 0.838 . . . . 0.0 111.07 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -67.23 99.0 0.65 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 122.981 0.512 . . . . 0.0 110.754 176.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -115.17 3.8 14.43 Favored 'General case' 0 CA--C 1.562 1.414 0 C-N-CA 123.981 0.912 . . . . 0.0 111.045 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 68.18 133.83 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 125.06 1.344 . . . . 0.0 111.968 -173.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -85.36 123.37 30.75 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -174.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -153.28 106.6 2.99 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.562 1.145 . . . . 0.0 108.87 171.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 30.7 p80 -124.44 150.69 45.39 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 122.822 0.449 . . . . 0.0 111.672 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 19.6 p80 . . . . . 0 CA--C 1.57 1.727 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.872 174.326 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.8 mtt . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -78.57 69.39 2.83 Favored Glycine 0 CA--C 1.537 1.45 0 O-C-N 122.88 0.112 . . . . 0.0 113.087 177.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -155.57 151.66 27.85 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.998 0.919 . . . . 0.0 110.596 -177.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.97 108.92 0.36 Allowed Glycine 0 N--CA 1.476 1.348 0 C-N-CA 121.988 -0.148 . . . . 0.0 113.304 179.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -110.26 116.72 31.99 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.6 0.76 . . . . 0.0 109.226 176.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.57 ' H ' HD12 ' A' ' 8' ' ' LEU . 2.5 p-10 -158.78 98.99 1.53 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.225 0.61 . . . . 0.0 110.876 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.9 t 43.28 67.5 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.562 1.432 0 C-N-CA 125.639 1.576 . . . . 0.0 113.322 174.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.57 HD12 ' H ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -122.31 -14.06 7.96 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.592 0.757 . . . . 0.0 113.035 -173.974 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -53.0 -28.77 33.51 Favored Glycine 0 N--CA 1.479 1.516 0 N-CA-C 116.568 1.387 . . . . 0.0 116.568 -166.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -160.05 -175.16 4.93 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.935 0.894 . . . . 0.0 109.695 172.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 36.5 t70 63.29 92.35 0.06 Allowed 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 124.589 1.156 . . . . 0.0 112.48 174.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.9 166.74 21.99 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.02 0.928 . . . . 0.0 109.648 171.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -76.69 -171.37 1.86 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -171.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.592 ' HA ' ' HB2' ' A' ' 28' ' ' PHE . 3.8 p -52.43 107.69 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.563 1.451 0 C-N-CA 124.377 1.071 . . . . 0.0 113.049 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.454 ' SG ' ' HB3' ' A' ' 70' ' ' PRO . 81.6 m -85.65 -45.84 11.32 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.183 178.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -82.09 88.41 6.44 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.301 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 47.7 t -157.98 -56.63 0.07 Allowed 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.644 0.778 . . . . 0.0 110.936 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.501 ' HB3' ' HD3' ' A' ' 19' ' ' PRO . . . -109.01 -52.4 0.06 OUTLIER Pre-proline 0 CA--C 1.571 1.76 0 CA-C-O 118.65 -0.69 . . . . 0.0 111.329 174.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.501 ' HD3' ' HB3' ' A' ' 18' ' ' ALA . 20.0 Cg_exo -68.95 120.41 7.32 Favored 'Trans proline' 0 C--N 1.398 3.151 0 C-N-CA 121.981 1.787 . . . . 0.0 111.398 168.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.2 mmt -73.92 97.22 2.76 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.178 0.591 . . . . 0.0 111.136 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.5 p -78.3 -3.22 41.86 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.904 0.881 . . . . 0.0 112.035 175.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 168.4 -60.93 0.2 Allowed Glycine 0 C--N 1.342 0.894 0 N-CA-C 110.596 -1.002 . . . . 0.0 110.596 177.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 22.3 t90 -168.75 171.73 8.41 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 124.878 1.271 . . . . 0.0 108.65 176.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -67.29 86.22 0.16 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-O 121.511 0.672 . . . . 0.0 110.377 172.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -95.01 -55.61 3.03 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.535 0.734 . . . . 0.0 110.337 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -172.63 158.63 4.16 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.532 1.133 . . . . 0.0 108.02 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.17 110.42 2.68 Favored Glycine 0 CA--C 1.541 1.674 0 CA-C-O 119.611 -0.55 . . . . 0.0 112.773 173.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.592 ' HB2' ' HA ' ' A' ' 14' ' ' VAL . 56.7 t80 80.27 140.31 0.07 Allowed 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 125.267 1.427 . . . . 0.0 112.567 174.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 57.7 m -88.62 98.1 11.48 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.668 0.787 . . . . 0.0 110.564 178.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -86.48 142.32 28.46 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-O 121.302 0.572 . . . . 0.0 110.921 173.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.591 HG21 ' SG ' ' A' ' 42' ' ' CYS . 9.6 t -108.71 6.03 25.33 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.972 0.909 . . . . 0.0 110.193 175.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -90.2 173.2 8.29 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.571 1.149 . . . . 0.0 111.696 -168.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.2 m 51.87 15.07 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 C-N-CA 126.276 1.83 . . . . 0.0 115.193 177.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -115.34 -82.5 0.62 Allowed 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 175.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 54.98 51.29 13.79 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.495 1.118 . . . . 0.0 113.269 172.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -121.63 -6.99 9.15 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.578 0.751 . . . . 0.0 112.733 -174.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.4 80.83 0.82 Allowed Glycine 0 CA--C 1.537 1.459 0 N-CA-C 112.741 -0.144 . . . . 0.0 112.741 -172.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -130.0 -61.82 0.97 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.995 0.918 . . . . 0.0 111.162 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.9 p80 -161.11 18.08 0.12 Allowed 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 123.86 0.864 . . . . 0.0 111.028 -177.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 45.0 p -96.42 111.18 23.37 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.079 1.352 . . . . 0.0 111.639 -173.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.42 HG11 ' HB2' ' A' ' 82' ' ' ALA . 39.2 t -129.07 123.51 58.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.781 -0.574 . . . . 0.0 110.525 173.169 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.591 ' SG ' HG21 ' A' ' 31' ' ' THR . 71.9 m -119.95 108.91 14.9 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 167.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.684 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -138.96 147.93 42.87 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.851 0.86 . . . . 0.0 108.835 -174.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -112.17 118.76 36.22 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 117.796 0.271 . . . . 0.0 111.501 -172.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.508 ' SD ' ' HB2' ' A' ' 85' ' ' TRP . 75.7 mmm -101.88 129.86 48.22 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.501 0.72 . . . . 0.0 110.641 178.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.47 ' H ' ' HB3' ' A' ' 95' ' ' PRO . 57.0 m -85.73 150.96 24.22 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.222 1.009 . . . . 0.0 110.412 -178.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -47.92 -30.01 3.84 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.631 1.573 . . . . 0.0 114.432 -172.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -48.19 -55.15 11.13 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.164 0.986 . . . . 0.0 112.179 177.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -74.39 -33.74 63.12 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.277 -176.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 45' ' ' MET . 6.8 mp -73.19 -35.61 66.39 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 117.914 0.324 . . . . 0.0 111.293 -176.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 38.8 mt -74.16 -33.67 63.56 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.972 0.509 . . . . 0.0 110.995 173.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -58.28 -51.92 67.76 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.908 0.483 . . . . 0.0 110.664 171.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.429 ' HA ' ' HE ' ' A' ' 56' ' ' ARG . 68.4 m -63.12 -45.19 93.13 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.662 0.785 . . . . 0.0 111.745 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.607 ' HA ' ' H ' ' A' ' 59' ' ' ASP . 50.8 ttt85 -60.27 -52.36 65.6 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.318 0.647 . . . . 0.0 111.4 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.33 -32.25 73.78 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.212 1.005 . . . . 0.0 111.851 178.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.429 ' HE ' ' HA ' ' A' ' 53' ' ' SER . 16.4 ttp180 -66.7 -34.22 77.38 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.252 1.021 . . . . 0.0 112.037 178.352 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 130.16 21.62 1.18 Allowed Glycine 0 N--CA 1.479 1.539 0 N-CA-C 114.295 0.478 . . . . 0.0 114.295 177.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -88.48 -51.17 5.86 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.232 0.613 . . . . 0.0 109.919 172.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.607 ' H ' ' HA ' ' A' ' 54' ' ' ARG . 2.5 m-20 65.42 -11.12 0.18 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 115.836 1.791 . . . . 0.0 115.836 176.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.8 tp -72.49 92.99 1.52 Allowed 'General case' 0 CA--C 1.552 1.023 0 CA-C-O 122.014 0.912 . . . . 0.0 110.892 -175.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.1 ttm -157.43 136.25 11.55 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.49 1.516 . . . . 0.0 107.052 177.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.4 m -59.81 105.93 0.65 Allowed Pre-proline 0 CA--C 1.563 1.474 0 C-N-CA 123.34 0.656 . . . . 0.0 111.379 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -92.3 -0.71 4.08 Favored 'Trans proline' 0 C--N 1.383 2.373 0 C-N-CA 123.225 2.617 . . . . 0.0 112.782 -178.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -100.08 130.63 25.75 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 124.402 1.081 . . . . 0.0 108.541 179.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.13 -18.72 63.5 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.884 2.389 . . . . 0.0 113.929 -172.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -76.06 116.69 17.01 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-O 121.02 0.438 . . . . 0.0 110.477 175.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -88.83 14.14 11.0 Favored 'General case' 0 CA--C 1.563 1.458 0 C-N-CA 123.682 0.793 . . . . 0.0 111.187 178.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.84 -37.13 73.3 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 125.326 1.451 . . . . 0.0 110.558 170.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -77.7 126.85 83.73 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 124.08 0.952 . . . . 0.0 110.792 -178.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.454 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 40.2 Cg_endo -65.42 107.75 1.07 Allowed 'Trans proline' 0 C--N 1.378 2.112 0 C-N-CA 122.442 2.095 . . . . 0.0 111.946 176.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -164.04 133.19 2.94 Favored Glycine 0 C--N 1.34 0.8 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.582 178.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.8 127.09 31.68 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.149 0.58 . . . . 0.0 111.025 179.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.462 ' H ' ' HD3' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -126.93 172.94 10.01 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.074 0.95 . . . . 0.0 109.589 178.256 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.41 111.23 2.57 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.304 0.641 . . . . 0.0 112.674 -172.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.85 20.8 25.28 Favored Glycine 0 CA--C 1.537 1.452 0 CA-C-N 115.648 -0.705 . . . . 0.0 113.431 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -95.99 134.02 39.51 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.565 0.746 . . . . 0.0 110.772 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.67 90.56 3.13 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.934 0.873 . . . . 0.0 111.791 172.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -173.96 121.4 0.3 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.485 1.114 . . . . 0.0 108.765 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 36.6 t 58.75 21.51 9.01 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.945 0.898 . . . . 0.0 112.374 177.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.684 HD12 ' HB3' ' A' ' 43' ' ' ALA . 3.2 tm? -68.87 112.92 5.85 Favored 'General case' 0 C--N 1.355 0.82 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 63.0 m -59.46 115.34 3.21 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.997 0.519 . . . . 0.0 109.967 176.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.42 ' HB2' HG11 ' A' ' 41' ' ' VAL . . . -56.28 -25.12 47.04 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -176.15 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.5 t -61.45 -33.32 73.54 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.623 0.769 . . . . 0.0 112.52 174.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -71.01 -40.21 71.93 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 123.852 0.861 . . . . 0.0 112.016 177.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.744 ' HE1' HD23 ' A' ' 115' ' ' LEU . 10.7 t-105 -68.84 -51.67 38.04 Favored 'General case' 0 CA--C 1.561 1.385 0 O-C-N 122.249 -0.282 . . . . 0.0 111.009 173.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.494 ' HB2' HG12 ' A' ' 110' ' ' VAL . 6.8 tp60 -48.43 -37.32 16.83 Favored 'General case' 0 CA--C 1.567 1.603 0 C-N-CA 124.167 0.987 . . . . 0.0 111.62 173.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -59.43 -44.04 92.98 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.634 1.174 . . . . 0.0 112.425 174.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.5 -36.6 73.9 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.149 0.58 . . . . 0.0 111.97 -173.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.726 ' HA ' ' HB2' ' A' ' 94' ' ' ALA . 65.5 t80 -66.02 -52.23 51.09 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.057 177.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -67.78 -22.52 65.19 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.92 -22.14 60.78 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.301 0.641 . . . . 0.0 111.528 171.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 102.26 -4.89 51.98 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 114.136 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 61.5 mtp -81.11 -70.14 0.55 Allowed 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 117.356 0.578 . . . . 0.0 109.909 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.726 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . . . 57.21 92.05 0.07 OUTLIER Pre-proline 0 CA--C 1.557 1.224 0 C-N-CA 125.034 1.333 . . . . 0.0 113.54 178.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.47 ' HB3' ' H ' ' A' ' 46' ' ' THR . 93.5 Cg_exo -55.06 159.25 10.02 Favored 'Trans proline' 0 CA--C 1.564 2.004 0 C-N-CA 123.049 2.499 . . . . 0.0 114.496 163.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.65 110.98 2.0 Favored 'Trans proline' 0 CA--C 1.558 1.699 0 C-N-CA 121.776 1.651 . . . . 0.0 110.999 163.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -95.24 157.15 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 123.245 0.618 . . . . 0.0 110.224 178.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.52 HG21 ' HB3' ' A' ' 101' ' ' SER . 28.1 m -73.48 147.28 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.149 0 C-N-CA 123.097 0.559 . . . . 0.0 111.175 171.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.458 HD23 ' HG2' ' A' ' 116' ' ' GLN . 0.6 OUTLIER -105.17 -30.25 9.83 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 167.766 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -80.52 -14.42 58.26 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.629 1.171 . . . . 0.0 113.338 -172.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.52 ' HB3' HG21 ' A' ' 98' ' ' VAL . 33.0 t -119.6 -24.69 6.17 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 122.759 0.424 . . . . 0.0 111.783 -179.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 85.5 m -63.31 106.3 0.87 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.747 0.419 . . . . 0.0 111.113 172.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -76.57 160.31 29.55 Favored 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 124.167 0.987 . . . . 0.0 110.702 -176.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -57.98 -23.36 53.51 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -174.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.6 m -59.23 -32.23 69.78 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 120.765 0.317 . . . . 0.0 111.628 176.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.451 ' O ' HG22 ' A' ' 110' ' ' VAL . . . -59.8 -36.36 76.58 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.556 0.742 . . . . 0.0 112.801 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.7 mp -65.47 5.49 0.41 Allowed 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 124.615 1.166 . . . . 0.0 113.495 -178.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 49.4 mtp180 -98.72 -26.01 14.49 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.044 0.938 . . . . 0.0 110.525 175.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -95.79 -53.15 3.8 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.731 1.212 . . . . 0.0 108.065 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.626 HG21 HD21 ' A' ' 115' ' ' LEU . 33.1 m -91.02 -171.54 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 122.207 1.003 . . . . 0.0 111.569 170.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 47.1 t -114.52 161.1 18.46 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.304 -1.316 . . . . 0.0 108.216 156.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.2 tt -53.88 -40.24 66.42 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.479 0.311 . . . . 0.0 110.97 168.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.89 -30.31 67.68 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.524 0.73 . . . . 0.0 112.43 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -66.57 -39.09 88.3 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.613 0.765 . . . . 0.0 110.298 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.744 HD23 ' HE1' ' A' ' 85' ' ' TRP . 23.4 mt -71.61 -53.67 12.92 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.738 -177.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.458 ' HG2' HD23 ' A' ' 99' ' ' LEU . 28.6 mt-30 -69.51 -27.16 64.95 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.445 -173.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -50.53 -54.54 21.62 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.878 0.871 . . . . 0.0 113.331 177.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 23.1 t-80 -99.9 -14.36 18.77 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.4 ' HB1' HD11 ' A' ' 99' ' ' LEU . . . -89.08 -93.82 0.11 Allowed 'General case' 0 CA--C 1.557 1.232 0 O-C-N 122.195 -0.316 . . . . 0.0 111.051 179.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 17.4 mt -141.24 159.37 61.5 Favored Pre-proline 0 N--CA 1.486 1.348 0 C-N-CA 123.463 0.705 . . . . 0.0 112.345 177.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -58.02 144.62 94.3 Favored 'Trans proline' 0 C--N 1.376 2.003 0 C-N-CA 123.809 3.006 . . . . 0.0 113.261 163.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.6 p -78.3 129.29 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 169.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.7 tt -76.02 104.35 6.51 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 173.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -150.9 143.11 24.15 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.812 0.845 . . . . 0.0 110.92 -177.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -72.65 118.16 15.24 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.045 0.538 . . . . 0.0 109.78 172.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -69.04 -35.41 76.56 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -169.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -83.85 92.95 7.89 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-O 121.287 0.565 . . . . 0.0 111.525 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -89.69 126.55 35.69 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.714 0.806 . . . . 0.0 109.205 171.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 25.8 p80 -139.26 -177.56 4.97 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.644 0.778 . . . . 0.0 111.271 -177.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 85.4 t60 . . . . . 0 CA--C 1.564 1.51 0 C-N-CA 123.453 0.701 . . . . 0.0 111.364 175.375 . . . . . . . . 0 0 . 1 stop_ save_