data_2mxf_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 2mxf _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 120.414 0.15 . . . . 1.0 111.34 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 28.1 mmt-85 -68.57 57.19 0.08 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 126.458 1.903 . . . . 1.0 113.001 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.2 mttt -54.39 131.08 41.48 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 128.915 2.886 . . . . 1.0 111.041 177.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.3 t -73.58 134.17 30.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 113.607 -1.633 . . . . 1.0 111.59 172.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -107.97 121.91 45.75 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.703 -1.592 . . . . 1.0 106.703 167.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.09 143.98 29.35 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 104.055 -2.572 . . . . 1.0 104.055 167.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -127.06 141.71 51.71 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.925 -1.139 . . . . 1.0 107.925 173.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.84 141.59 49.47 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.794 1.238 . . . . 1.0 109.149 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -108.32 110.14 61.75 Favored Pre-proline 0 CA--C 1.548 0.899 0 N-CA-C 112.658 0.614 . . . . 1.0 112.658 -173.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -52.69 -27.52 33.96 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.417 3.411 . . . . 1.0 116.04 174.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -88.57 -19.86 25.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.85 1.26 . . . . 1.0 114.286 -174.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.8 p -127.57 -19.93 4.08 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.726 1.009 . . . . 1.0 113.726 -173.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.95 8.22 77.6 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.062 0.839 . . . . 1.0 114.151 -172.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -80.62 157.0 26.12 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 119.055 1.428 . . . . 1.0 110.892 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.49 155.11 33.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 C-N-CA 126.746 2.018 . . . . 1.0 109.332 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.26 168.83 10.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 127.463 2.305 . . . . 1.0 109.601 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -146.65 122.63 10.71 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 127.885 2.474 . . . . 1.0 109.407 171.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.01 155.27 42.69 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.949 0.9 . . . . 1.0 110.085 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -95.64 8.75 42.52 Favored 'General case' 0 N--CA 1.48 1.075 0 O-C-N 120.94 -1.1 . . . . 1.0 111.884 174.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.07 -164.76 20.52 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 127.15 2.31 . . . . 1.0 113.112 -171.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.59 168.87 21.32 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 117.018 1.567 . . . . 1.0 117.018 170.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -57.22 101.73 0.07 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.403 2.281 . . . . 1.0 108.763 169.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -130.25 128.48 41.71 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.13 1.372 . . . . 1.0 109.783 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 31.2 tttt -46.41 -65.92 0.48 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.958 1.836 . . . . 1.0 115.958 -168.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.0 m -59.49 -41.76 90.6 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 119.175 0.898 . . . . 1.0 112.204 -177.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.3 tp -59.92 -38.83 83.45 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.109 0.964 . . . . 1.0 111.574 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -68.86 -32.07 71.48 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.7 0.8 . . . . 1.0 112.973 174.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -68.46 -43.16 77.6 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.623 1.101 . . . . 1.0 110.907 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -62.78 -36.18 82.26 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.509 0.559 . . . . 1.0 112.509 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -65.09 -36.28 83.81 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.404 -0.81 . . . . 1.0 112.413 171.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.78 -48.62 68.47 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.597 0.713 . . . . 1.0 110.914 176.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -69.78 -37.43 76.35 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.561 1.544 . . . . 1.0 113.407 -171.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 11.7 m-90 -134.12 -55.82 0.86 Allowed 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.66 0.985 . . . . 1.0 113.66 -175.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 149.78 156.71 7.36 Favored Glycine 0 CA--C 1.537 1.43 0 CA-C-N 119.062 0.846 . . . . 1.0 114.932 172.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.57 -30.98 71.1 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.054 2.503 . . . . 1.0 114.158 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -62.54 -46.2 89.47 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.037 0.922 . . . . 1.0 111.181 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.38 -52.95 63.43 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 125.051 1.34 . . . . 1.0 109.972 176.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.7 t -58.01 -47.49 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 125.848 1.659 . . . . 1.0 111.669 -175.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.77 -37.64 88.3 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.675 0.79 . . . . 1.0 112.274 173.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.3 m -66.05 -29.72 70.12 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.009 0.523 . . . . 1.0 112.288 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 13.3 m0 -78.97 -6.19 55.67 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.085 1.143 . . . . 1.0 114.085 173.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.49 169.12 16.09 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 124.133 1.921 . . . . 1.0 114.624 -173.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 83.1 m -144.6 138.51 27.48 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 129.606 3.162 . . . . 1.0 108.156 -176.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -96.95 126.22 41.94 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.369 1.067 . . . . 1.0 109.81 -177.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.4 mt . . . . . 0 CA--C 1.533 0.297 0 C-N-CA 125.947 1.699 . . . . 1.0 110.926 -177.508 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 111.265 0.098 . . . . 1.0 111.265 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 47.0 mmt-85 -65.32 62.25 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 126.783 2.033 . . . . 1.0 112.942 173.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -54.95 133.75 48.39 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 128.636 2.775 . . . . 1.0 110.91 177.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 95.1 t -75.12 135.83 26.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 113.445 -1.707 . . . . 1.0 111.019 171.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.1 mttp -111.09 124.39 52.09 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.681 -1.6 . . . . 1.0 106.681 167.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.04 145.86 28.26 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 104.599 -2.371 . . . . 1.0 104.599 167.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -128.96 141.47 51.25 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.73 -1.211 . . . . 1.0 107.73 173.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -132.82 139.63 47.59 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.897 1.279 . . . . 1.0 109.157 178.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -106.7 109.7 63.27 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.002 0.521 . . . . 1.0 112.275 -174.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -52.5 -27.97 34.3 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.325 3.35 . . . . 1.0 115.808 175.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -86.29 -17.27 35.06 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.218 1.192 . . . . 1.0 114.218 -174.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.3 p -129.85 -22.45 2.92 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.046 1.128 . . . . 1.0 114.046 -174.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.4 7.73 82.97 Favored Glycine 0 CA--C 1.538 1.527 0 C-N-CA 124.308 0.956 . . . . 1.0 114.274 -172.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.08 156.82 29.8 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.071 1.436 . . . . 1.0 110.698 173.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.94 155.01 32.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 126.912 2.085 . . . . 1.0 109.55 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.38 168.38 10.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 C-N-CA 127.621 2.369 . . . . 1.0 109.299 177.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -147.51 121.46 9.38 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 127.715 2.406 . . . . 1.0 109.139 173.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.94 151.45 37.03 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.833 0.853 . . . . 1.0 109.977 -178.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -90.32 7.71 37.08 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 120.952 -1.093 . . . . 1.0 112.443 174.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.63 -165.34 21.53 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 126.66 2.076 . . . . 1.0 113.414 -172.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.39 170.29 27.48 Favored Glycine 0 CA--C 1.537 1.414 0 N-CA-C 117.071 1.588 . . . . 1.0 117.071 169.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -57.96 102.56 0.1 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.382 2.273 . . . . 1.0 108.667 169.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -130.3 132.99 46.14 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.121 1.368 . . . . 1.0 109.747 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.5 tttt -50.39 -66.34 0.41 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.677 1.732 . . . . 1.0 115.677 -168.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 40.8 m -60.46 -41.66 94.61 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 119.301 0.955 . . . . 1.0 112.032 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 46.0 tp -58.49 -38.26 77.27 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.154 0.981 . . . . 1.0 111.62 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -69.05 -36.06 77.26 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.971 0.908 . . . . 1.0 112.358 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -66.45 -42.03 88.24 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.463 1.029 . . . . 1.0 110.444 178.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -61.92 -37.95 86.58 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.454 0.539 . . . . 1.0 112.454 177.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -65.52 -34.8 79.1 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.489 -0.757 . . . . 1.0 112.175 172.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.63 -49.04 62.35 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.537 0.684 . . . . 1.0 111.317 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -74.79 -33.74 62.29 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.909 1.683 . . . . 1.0 114.58 -169.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.1 m-90 -133.41 -47.99 0.83 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.7 1.0 . . . . 1.0 113.7 -176.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.54 154.17 6.18 Favored Glycine 0 N--CA 1.478 1.436 0 N-CA-C 115.047 0.779 . . . . 1.0 115.047 169.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -61.17 -35.06 87.76 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.111 2.541 . . . . 1.0 114.051 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.4 -45.62 93.56 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.722 0.773 . . . . 1.0 111.449 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.81 -54.92 40.66 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.138 -1.392 . . . . 1.0 109.831 175.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 32.5 t -57.7 -48.34 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.62 1.568 . . . . 1.0 112.06 -174.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -66.42 -35.25 79.84 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.11 0.564 . . . . 1.0 111.906 175.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.9 m -67.81 -30.19 69.54 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.67 -0.644 . . . . 1.0 112.608 178.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.2 m0 -74.2 -10.16 59.33 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.776 1.028 . . . . 1.0 113.776 173.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.73 168.47 16.53 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 124.048 1.88 . . . . 1.0 114.707 -172.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 87.2 m -144.0 138.7 28.59 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 129.6 3.16 . . . . 1.0 107.895 -175.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -99.03 127.03 44.87 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.373 1.069 . . . . 1.0 109.657 -176.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.4 mt . . . . . 0 CA--C 1.538 0.515 0 C-N-CA 126.039 1.736 . . . . 1.0 111.34 -175.165 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 111.173 0.064 . . . . 1.0 111.173 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.0 mmt85 -66.47 61.36 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 126.448 1.899 . . . . 1.0 113.661 176.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -54.83 130.1 39.75 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 128.855 2.862 . . . . 1.0 110.549 177.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 83.1 t -71.69 133.2 32.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 113.683 -1.599 . . . . 1.0 111.01 173.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -106.56 120.94 43.26 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.442 -1.688 . . . . 1.0 106.442 167.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.16 144.06 29.24 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 103.899 -2.63 . . . . 1.0 103.899 167.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -127.24 139.4 52.95 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.791 -1.188 . . . . 1.0 107.791 175.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -131.78 139.49 48.94 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.678 1.191 . . . . 1.0 109.256 176.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -105.79 110.52 64.23 Favored Pre-proline 0 CA--C 1.545 0.761 0 N-CA-C 112.337 0.495 . . . . 1.0 112.337 -174.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -52.81 -27.79 35.94 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 124.441 3.427 . . . . 1.0 115.728 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -87.35 -17.22 32.89 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.777 1.231 . . . . 1.0 114.185 -174.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.1 p -130.2 -21.83 2.89 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.247 1.203 . . . . 1.0 114.247 -174.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.1 8.74 79.43 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.434 1.016 . . . . 1.0 114.295 -172.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -78.42 156.48 29.4 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.072 1.436 . . . . 1.0 110.727 172.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.5 t -136.41 154.99 33.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 126.907 2.083 . . . . 1.0 109.733 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.86 168.77 8.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 127.795 2.438 . . . . 1.0 109.558 177.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -147.26 121.49 9.55 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.762 2.425 . . . . 1.0 109.273 173.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.83 153.55 39.32 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.579 0.752 . . . . 1.0 109.913 -179.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -95.52 6.24 49.48 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.515 1.126 . . . . 1.0 111.927 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 131.38 -166.41 22.88 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 127.229 2.347 . . . . 1.0 113.515 -173.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.04 170.79 27.33 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-O 123.627 1.682 . . . . 1.0 117.301 169.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -57.58 100.45 0.05 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 127.938 2.495 . . . . 1.0 109.202 169.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -130.64 133.17 45.91 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.685 1.594 . . . . 1.0 110.139 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -50.55 -67.27 0.27 Allowed 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 115.875 1.805 . . . . 1.0 115.875 -168.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 37.4 m -59.7 -41.01 89.8 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 119.254 0.933 . . . . 1.0 112.056 -175.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 47.6 tp -58.57 -39.07 79.28 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.46 1.104 . . . . 1.0 111.694 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -68.09 -36.02 79.12 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.813 0.845 . . . . 1.0 112.292 175.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.94 -41.86 86.27 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.308 0.958 . . . . 1.0 110.752 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -63.02 -36.06 82.31 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.69 0.626 . . . . 1.0 112.69 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.2 -36.37 83.99 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.428 -0.795 . . . . 1.0 112.396 171.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.87 -48.08 67.08 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.303 0.573 . . . . 1.0 111.085 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -76.54 -33.61 58.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.633 1.573 . . . . 1.0 114.254 -169.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.0 m-90 -134.11 -46.92 0.78 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.108 1.151 . . . . 1.0 114.108 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.39 154.2 6.29 Favored Glycine 0 N--CA 1.479 1.561 0 CA-C-N 119.292 0.951 . . . . 1.0 115.318 169.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -62.88 -31.91 77.37 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.218 2.612 . . . . 1.0 113.93 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -63.1 -46.63 86.43 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.906 0.882 . . . . 1.0 111.016 176.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.99 -53.67 55.78 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 125.174 1.39 . . . . 1.0 109.89 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 24.9 t -56.85 -47.82 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 126.059 1.744 . . . . 1.0 111.771 -176.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -67.99 -34.57 76.78 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.419 0.526 . . . . 1.0 112.419 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.8 m -67.09 -31.76 72.46 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.829 0.677 . . . . 1.0 112.829 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -74.63 -11.38 60.18 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.21 1.189 . . . . 1.0 114.21 174.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.43 168.99 14.96 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 124.245 1.974 . . . . 1.0 115.131 -170.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.7 m -142.24 142.73 32.64 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 130.157 3.383 . . . . 1.0 107.636 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.2 tt -108.11 122.59 47.21 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.82 0.848 . . . . 1.0 109.409 -174.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 CA--C 1.538 0.499 0 C-N-CA 126.489 1.916 . . . . 1.0 110.814 -172.417 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 111.231 0.085 . . . . 1.0 111.231 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -67.41 58.81 0.05 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 126.654 1.982 . . . . 1.0 113.077 175.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.9 mttt -54.43 132.46 44.44 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 128.814 2.846 . . . . 1.0 111.48 177.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.0 t -75.14 134.77 28.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 113.403 -1.726 . . . . 1.0 111.574 173.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -109.61 123.13 48.92 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 106.96 -1.496 . . . . 1.0 106.96 167.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.13 143.9 29.38 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 104.287 -2.486 . . . . 1.0 104.287 168.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -123.55 136.01 54.31 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.257 -1.386 . . . . 1.0 107.257 173.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -135.3 97.4 3.7 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.246 1.018 . . . . 1.0 109.886 -169.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -72.09 119.52 75.02 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.465 1.106 . . . . 1.0 112.864 -169.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.1 -20.0 22.2 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 123.678 2.918 . . . . 1.0 114.239 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -83.91 -22.07 31.69 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.575 1.15 . . . . 1.0 113.793 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 62.6 p -127.42 -22.89 3.59 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.156 1.169 . . . . 1.0 114.156 -172.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.8 4.88 77.88 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-O 118.932 -0.927 . . . . 1.0 114.144 -171.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -74.13 155.45 38.41 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.46 1.63 . . . . 1.0 110.607 171.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 5.1 t -137.74 153.04 27.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 113.358 -1.746 . . . . 1.0 109.262 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.06 169.21 12.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 126.924 2.09 . . . . 1.0 109.122 177.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -147.44 121.52 9.46 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 127.537 2.335 . . . . 1.0 109.14 173.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.93 154.14 41.6 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.911 0.884 . . . . 1.0 109.756 -179.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -95.41 8.79 42.16 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.109 -0.995 . . . . 1.0 112.002 174.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.38 -165.42 21.3 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 127.126 2.298 . . . . 1.0 113.335 -172.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.78 169.6 23.82 Favored Glycine 0 CA--C 1.537 1.453 0 N-CA-C 117.445 1.738 . . . . 1.0 117.445 169.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -57.76 101.25 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.559 2.344 . . . . 1.0 109.056 169.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -130.37 131.03 45.12 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.634 1.573 . . . . 1.0 109.839 178.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -49.39 -66.85 0.33 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.577 1.695 . . . . 1.0 115.577 -168.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.0 m -60.36 -40.39 90.57 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 119.36 0.982 . . . . 1.0 112.207 -175.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.7 tp -58.86 -38.47 78.86 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.334 1.053 . . . . 1.0 111.801 176.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.01 -36.51 80.09 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.476 0.711 . . . . 1.0 112.528 174.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.82 -41.98 86.61 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.296 0.953 . . . . 1.0 110.786 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -61.94 -38.41 88.38 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.532 0.568 . . . . 1.0 112.532 177.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -64.84 -34.77 79.16 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.529 -0.732 . . . . 1.0 112.177 172.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.61 -49.07 62.11 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.623 0.725 . . . . 1.0 110.945 176.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -73.22 -35.68 66.34 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.082 1.753 . . . . 1.0 114.425 -169.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.1 m-90 -132.81 -47.5 0.87 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.695 0.998 . . . . 1.0 113.695 -175.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.3 155.21 6.57 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.995 0.816 . . . . 1.0 114.676 169.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -61.77 -34.25 83.38 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.073 2.515 . . . . 1.0 113.788 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -61.12 -45.5 94.44 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 122.07 0.938 . . . . 1.0 111.339 177.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.47 -54.92 41.03 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 114.125 -1.398 . . . . 1.0 109.975 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.3 t -58.08 -46.32 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 125.448 1.499 . . . . 1.0 112.246 -174.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.0 -34.81 78.55 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.876 -0.515 . . . . 1.0 112.295 175.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.5 t -66.03 -32.38 73.82 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.622 -0.674 . . . . 1.0 112.339 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 27.9 m0 -73.37 -5.52 40.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.904 1.282 . . . . 1.0 113.663 173.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -75.16 168.48 19.9 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 124.151 1.929 . . . . 1.0 114.706 -175.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 84.0 m -147.86 139.72 24.01 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 130.134 3.373 . . . . 1.0 107.674 -176.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 30.3 tp -99.24 127.07 45.18 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.315 1.046 . . . . 1.0 109.786 -177.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.5 mt . . . . . 0 CA--C 1.537 0.471 0 C-N-CA 126.175 1.79 . . . . 1.0 110.993 -176.487 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 120.807 0.337 . . . . 1.0 111.652 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.4 mmt-85 -60.0 63.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 127.936 2.494 . . . . 1.0 113.083 170.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.6 mtpt -51.48 135.86 26.96 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 128.956 2.903 . . . . 1.0 112.038 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.4 t -75.69 135.53 26.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 112.936 -1.938 . . . . 1.0 110.642 169.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -111.03 123.47 50.25 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.521 -1.659 . . . . 1.0 106.521 167.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -83.47 145.08 29.15 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 104.209 -2.515 . . . . 1.0 104.209 168.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -127.61 140.27 52.21 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 107.668 -1.234 . . . . 1.0 107.668 172.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -131.7 131.1 42.8 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.42 1.088 . . . . 1.0 109.736 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -96.81 110.1 51.83 Favored Pre-proline 0 CA--C 1.543 0.696 0 C-N-CA 123.043 0.537 . . . . 1.0 111.784 -173.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -65.48 -15.56 50.18 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.583 2.855 . . . . 1.0 114.312 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -88.88 -17.48 29.54 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 114.444 1.276 . . . . 1.0 114.444 178.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 38.5 p -129.72 -22.77 2.93 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 114.481 1.289 . . . . 1.0 114.481 -175.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.51 7.2 87.11 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 124.359 0.98 . . . . 1.0 114.36 -172.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.18 156.08 30.04 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.211 1.505 . . . . 1.0 110.785 173.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.12 153.66 32.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 C-N-CA 126.695 1.998 . . . . 1.0 109.635 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.68 167.74 12.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 127.626 2.371 . . . . 1.0 109.193 177.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -146.8 121.57 9.89 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.752 2.421 . . . . 1.0 109.279 173.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.84 152.01 38.02 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.683 0.793 . . . . 1.0 109.904 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -92.1 7.93 40.17 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 121.069 -1.019 . . . . 1.0 112.116 174.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 130.36 -166.01 22.43 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 126.702 2.096 . . . . 1.0 113.432 -173.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.99 170.34 26.27 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 117.196 1.638 . . . . 1.0 117.196 169.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -57.71 100.42 0.05 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.698 2.399 . . . . 1.0 109.015 169.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -130.52 128.04 40.35 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.559 1.544 . . . . 1.0 109.764 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -44.25 -68.29 0.21 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.386 1.624 . . . . 1.0 115.386 -168.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.8 m -59.83 -41.68 91.87 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 119.185 0.902 . . . . 1.0 112.17 -174.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.5 tp -59.27 -38.89 81.23 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.146 0.979 . . . . 1.0 111.545 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.0 mmmt -69.75 -32.46 71.0 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 118.527 -0.749 . . . . 1.0 112.965 175.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -69.12 -42.44 76.04 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.514 1.052 . . . . 1.0 110.922 176.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -61.49 -37.35 83.35 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.685 0.624 . . . . 1.0 112.685 178.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -66.09 -34.45 78.08 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.548 -0.72 . . . . 1.0 112.38 172.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.53 -48.73 63.56 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.824 0.821 . . . . 1.0 111.236 175.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -74.54 -34.15 62.9 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.941 1.697 . . . . 1.0 114.567 -169.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 17.1 m-90 -132.75 -48.06 0.88 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 113.78 1.03 . . . . 1.0 113.78 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.57 153.75 6.07 Favored Glycine 0 N--CA 1.476 1.333 0 CA-C-N 118.908 0.776 . . . . 1.0 114.648 169.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.61 -34.68 84.03 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.061 2.507 . . . . 1.0 113.806 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.24 -45.3 95.09 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.986 0.898 . . . . 1.0 111.124 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.18 -55.98 27.21 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.263 -1.335 . . . . 1.0 109.72 175.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 38.9 t -57.87 -46.55 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 125.466 1.506 . . . . 1.0 112.111 -174.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -67.27 -35.69 80.04 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.86 -0.525 . . . . 1.0 112.048 176.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.3 t -65.63 -34.04 77.3 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.72 -0.613 . . . . 1.0 112.217 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 25.6 m0 -70.72 -11.53 61.0 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.027 1.121 . . . . 1.0 114.027 174.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.95 168.32 17.22 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 124.141 1.924 . . . . 1.0 114.76 -171.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 88.5 m -143.58 136.55 27.62 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 129.314 3.045 . . . . 1.0 108.243 -176.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 38.6 tp -96.03 126.54 41.34 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.254 1.022 . . . . 1.0 110.115 -176.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.9 mt . . . . . 0 CA--C 1.537 0.479 0 C-N-CA 125.654 1.582 . . . . 1.0 110.812 -175.773 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 119.845 -0.121 . . . . 1.0 110.81 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.0 mmp_? -63.45 59.25 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 127.432 2.293 . . . . 1.0 114.465 175.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -55.02 131.04 43.98 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 128.8 2.84 . . . . 1.0 110.395 174.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 85.0 t -74.26 133.86 30.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 113.437 -1.71 . . . . 1.0 111.315 173.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.4 mttp -107.77 122.17 46.2 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 106.505 -1.665 . . . . 1.0 106.505 167.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.04 145.17 28.63 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 104.32 -2.474 . . . . 1.0 104.32 168.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -128.06 142.84 51.1 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.158 -1.052 . . . . 1.0 108.158 172.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -132.68 141.08 48.43 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.046 1.338 . . . . 1.0 109.576 177.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -108.13 109.12 61.82 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 123.119 0.567 . . . . 1.0 112.496 -173.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -53.28 -26.8 35.81 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.36 3.374 . . . . 1.0 115.603 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -87.91 -19.6 27.1 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.475 1.11 . . . . 1.0 113.731 -174.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 45.9 p -129.97 -19.45 3.24 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.563 1.319 . . . . 1.0 114.563 -171.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.12 11.69 75.17 Favored Glycine 0 CA--C 1.539 1.57 0 C-N-CA 124.002 0.81 . . . . 1.0 114.215 -173.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -75.89 150.74 37.51 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.429 1.492 . . . . 1.0 109.405 171.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -133.08 155.09 40.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 C-N-CA 126.506 1.923 . . . . 1.0 108.936 172.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.7 167.9 12.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 127.537 2.335 . . . . 1.0 109.267 177.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -146.96 121.14 9.5 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 127.653 2.381 . . . . 1.0 108.92 173.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.0 154.54 42.65 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.825 0.85 . . . . 1.0 109.937 -178.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -95.67 9.83 38.97 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 121.118 -0.989 . . . . 1.0 111.856 174.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 126.1 -166.38 18.89 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 127.086 2.279 . . . . 1.0 113.396 -172.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.05 170.12 29.35 Favored Glycine 0 CA--C 1.535 1.311 0 N-CA-C 117.481 1.752 . . . . 1.0 117.481 169.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -57.49 100.02 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 128.119 2.568 . . . . 1.0 109.147 169.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.3 t60 -130.4 136.9 49.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.344 1.458 . . . . 1.0 110.69 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -49.99 -70.92 0.07 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 125.525 1.53 . . . . 1.0 114.809 -169.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.0 m -60.5 -40.68 92.26 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 118.918 0.781 . . . . 1.0 111.87 -173.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.96 -39.34 77.88 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.282 1.033 . . . . 1.0 111.725 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.82 -36.05 77.73 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.493 0.717 . . . . 1.0 112.407 175.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -67.27 -42.37 83.97 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.248 0.931 . . . . 1.0 110.977 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -61.37 -38.6 87.59 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.821 0.675 . . . . 1.0 112.821 176.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -64.74 -34.9 79.42 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.694 -0.628 . . . . 1.0 112.148 173.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.27 -48.74 64.21 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.645 0.736 . . . . 1.0 110.978 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.58 -34.63 60.66 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.658 1.583 . . . . 1.0 114.79 -169.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.7 m-90 -132.01 -48.15 0.94 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.832 1.049 . . . . 1.0 113.832 -176.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.96 153.94 6.17 Favored Glycine 0 N--CA 1.479 1.557 0 CA-C-N 118.908 0.776 . . . . 1.0 114.856 169.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -61.51 -34.5 85.47 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.945 2.43 . . . . 1.0 113.959 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -60.96 -45.94 92.73 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 122.032 0.92 . . . . 1.0 111.248 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.91 -54.74 42.65 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.296 -1.32 . . . . 1.0 109.922 176.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.4 t -57.87 -47.34 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 125.594 1.557 . . . . 1.0 112.074 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -66.92 -35.59 80.33 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.273 0.629 . . . . 1.0 112.163 175.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.5 m -66.47 -30.07 70.33 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 118.537 0.608 . . . . 1.0 112.514 178.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 19.2 m0 -75.6 -8.89 57.92 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.057 1.132 . . . . 1.0 114.057 173.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.1 168.81 16.34 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 124.118 1.913 . . . . 1.0 114.939 -172.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 91.4 m -144.54 142.92 30.56 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 130.177 3.391 . . . . 1.0 108.161 -176.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.96 123.6 48.41 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.025 0.93 . . . . 1.0 109.703 -176.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 CA--C 1.539 0.545 0 C-N-CA 126.744 2.018 . . . . 1.0 110.77 -173.563 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 120.336 0.112 . . . . 1.0 111.03 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 44.8 mmt-85 -67.47 61.51 0.06 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 126.392 1.877 . . . . 1.0 112.806 174.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -55.21 132.72 48.33 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 128.739 2.816 . . . . 1.0 111.207 178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 84.3 t -74.02 134.12 30.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 113.411 -1.722 . . . . 1.0 111.78 173.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -108.0 123.13 48.19 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 106.379 -1.711 . . . . 1.0 106.379 167.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.4 145.24 28.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 104.38 -2.452 . . . . 1.0 104.38 168.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -127.5 141.83 51.55 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.027 -1.101 . . . . 1.0 108.027 172.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -133.04 139.1 47.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.629 1.172 . . . . 1.0 109.27 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.8 t-20 -106.08 110.51 64.07 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 112.372 0.508 . . . . 1.0 112.372 -173.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -52.96 -28.27 39.04 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 124.469 3.446 . . . . 1.0 115.793 175.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -86.34 -17.88 33.35 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.32 1.23 . . . . 1.0 114.32 -174.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.1 p -129.27 -22.8 3.06 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 114.0 1.111 . . . . 1.0 114.0 -173.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.37 8.31 83.56 Favored Glycine 0 CA--C 1.538 1.531 0 C-N-CA 124.265 0.936 . . . . 1.0 114.175 -172.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -79.18 157.12 27.93 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 123.137 1.446 . . . . 1.0 110.683 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.1 t -136.65 154.6 32.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 C-N-CA 127.149 2.18 . . . . 1.0 109.496 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.14 167.72 11.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 127.335 2.254 . . . . 1.0 109.301 177.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -146.99 120.58 9.12 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 127.674 2.389 . . . . 1.0 109.206 174.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.58 153.07 39.93 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.707 0.803 . . . . 1.0 109.93 -179.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -95.36 7.33 46.53 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.332 1.053 . . . . 1.0 111.609 176.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 130.82 -166.76 22.46 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 127.006 2.241 . . . . 1.0 113.444 -172.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.41 170.2 23.4 Favored Glycine 0 CA--C 1.536 1.398 0 N-CA-C 117.505 1.762 . . . . 1.0 117.505 170.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -57.6 100.91 0.06 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.728 2.411 . . . . 1.0 108.984 169.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -130.51 131.79 45.28 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.378 1.471 . . . . 1.0 109.875 177.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -48.72 -67.68 0.25 Allowed 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.767 1.766 . . . . 1.0 115.767 -168.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 36.9 m -59.72 -41.29 90.53 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-N 119.194 0.907 . . . . 1.0 112.084 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.9 tp -58.45 -39.12 79.0 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.939 0.896 . . . . 1.0 111.736 177.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -68.34 -35.81 78.32 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.35 0.66 . . . . 1.0 112.293 175.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -67.15 -42.02 85.05 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.366 0.984 . . . . 1.0 110.779 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -62.52 -37.82 87.53 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.606 0.595 . . . . 1.0 112.606 177.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -65.44 -34.3 77.96 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.701 -0.624 . . . . 1.0 112.528 172.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.14 -48.99 60.92 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.505 0.669 . . . . 1.0 111.17 176.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -74.53 -34.69 63.06 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.087 1.755 . . . . 1.0 114.587 -169.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.0 m-90 -132.89 -46.11 0.86 Allowed 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.847 1.054 . . . . 1.0 113.847 -176.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.46 153.9 6.33 Favored Glycine 0 N--CA 1.479 1.505 0 CA-C-N 118.94 0.791 . . . . 1.0 115.024 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -61.75 -33.35 85.71 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.947 2.431 . . . . 1.0 113.949 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -61.18 -45.98 92.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.836 0.826 . . . . 1.0 111.316 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.87 -54.94 40.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.107 1.363 . . . . 1.0 109.967 175.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.9 t -57.98 -47.91 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 125.577 1.551 . . . . 1.0 111.889 -174.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -67.09 -34.89 78.62 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.918 -0.489 . . . . 1.0 112.098 176.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.2 m -67.39 -30.3 70.04 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.667 -0.645 . . . . 1.0 112.572 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.3 m0 -74.41 -10.77 59.9 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.04 1.126 . . . . 1.0 114.04 173.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.65 168.39 17.79 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 124.213 1.959 . . . . 1.0 114.809 -171.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 93.4 m -144.21 142.44 30.51 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 130.083 3.353 . . . . 1.0 107.91 -175.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -107.24 124.13 49.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.925 0.89 . . . . 1.0 109.624 -176.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.6 mt . . . . . 0 CA--C 1.538 0.494 0 C-N-CA 126.524 1.93 . . . . 1.0 110.962 -173.218 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.386 0.136 . . . . 1.0 111.253 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.5 mmt-85 -69.03 56.25 0.09 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 126.667 1.987 . . . . 1.0 113.168 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -56.05 128.92 37.72 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 128.594 2.757 . . . . 1.0 110.715 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 91.2 t -71.98 135.21 28.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 113.618 -1.628 . . . . 1.0 110.801 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -109.31 121.72 45.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 106.691 -1.596 . . . . 1.0 106.691 167.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.01 144.11 29.33 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 103.887 -2.634 . . . . 1.0 103.887 167.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -127.38 140.03 52.45 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.87 -1.159 . . . . 1.0 107.87 174.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -131.75 134.78 46.23 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.738 1.215 . . . . 1.0 109.616 178.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -99.82 110.41 59.03 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 123.209 0.604 . . . . 1.0 111.651 -173.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -66.37 -14.83 45.85 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.181 2.588 . . . . 1.0 114.3 -179.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -89.17 -20.77 23.8 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.599 1.16 . . . . 1.0 114.084 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.6 p -129.99 -20.98 3.05 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.24 1.57 . . . . 1.0 115.24 -171.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.33 10.71 82.14 Favored Glycine 0 CA--C 1.541 1.696 0 C-N-CA 123.857 0.742 . . . . 1.0 114.302 -173.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -74.06 148.76 41.61 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.181 1.392 . . . . 1.0 109.273 170.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.8 t -132.19 154.74 40.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 C-N-CA 126.362 1.865 . . . . 1.0 108.974 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.43 168.08 10.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 127.53 2.332 . . . . 1.0 109.417 177.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -147.21 120.26 8.81 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.808 2.443 . . . . 1.0 109.174 173.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.98 157.79 43.87 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.16 0.984 . . . . 1.0 109.98 -178.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -99.07 11.59 38.57 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 120.792 -1.192 . . . . 1.0 111.855 176.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 123.71 -167.01 16.03 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 127.165 2.317 . . . . 1.0 112.971 -171.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.23 169.5 32.03 Favored Glycine 0 CA--C 1.536 1.393 0 N-CA-C 117.329 1.692 . . . . 1.0 117.329 169.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -57.7 99.3 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 128.057 2.543 . . . . 1.0 109.14 169.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -130.55 132.87 45.8 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.345 1.458 . . . . 1.0 110.583 178.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.7 tppt? -44.83 -71.24 0.08 Allowed 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 125.747 1.619 . . . . 1.0 114.995 -169.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.8 m -61.45 -40.06 93.11 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 118.532 0.605 . . . . 1.0 111.947 -173.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.7 tp -58.25 -40.4 81.68 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.259 1.024 . . . . 1.0 111.488 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -69.65 -32.2 70.72 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.681 0.792 . . . . 1.0 112.982 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.95 -42.59 76.45 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.619 1.1 . . . . 1.0 111.225 176.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.0 m0 -61.14 -36.69 80.44 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.627 0.603 . . . . 1.0 112.627 177.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -65.11 -36.47 84.39 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.424 -0.798 . . . . 1.0 112.611 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.24 -48.01 71.91 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.472 0.653 . . . . 1.0 110.989 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -76.27 -34.05 59.13 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.304 1.442 . . . . 1.0 114.64 -169.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.6 m-90 -134.02 -48.26 0.79 Allowed 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.942 1.089 . . . . 1.0 113.942 -176.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.7 153.73 6.06 Favored Glycine 0 N--CA 1.48 1.627 0 CA-C-N 119.34 0.973 . . . . 1.0 115.265 169.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.57 -33.34 78.42 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 123.212 2.608 . . . . 1.0 114.214 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -62.85 -46.79 86.25 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 122.168 0.985 . . . . 1.0 111.042 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.78 -53.66 55.91 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.313 1.445 . . . . 1.0 109.935 176.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 28.1 t -57.29 -47.79 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 125.774 1.629 . . . . 1.0 111.778 -175.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.89 -36.0 82.2 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.3 0.64 . . . . 1.0 112.562 174.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.2 m -66.84 -30.75 71.02 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.585 0.587 . . . . 1.0 112.585 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 16.2 m0 -75.83 -8.78 57.7 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.947 1.091 . . . . 1.0 113.947 173.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.7 168.9 16.78 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 124.032 1.872 . . . . 1.0 114.831 -172.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 94.9 m -142.53 141.74 32.12 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 130.521 3.529 . . . . 1.0 107.632 -176.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.08 123.32 47.83 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.779 0.832 . . . . 1.0 109.64 -175.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.4 mt . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 126.525 1.93 . . . . 1.0 110.927 -173.496 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.462 0 CA-C-O 120.491 0.186 . . . . 1.0 111.337 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 29.9 mmt-85 -69.46 58.27 0.12 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 126.483 1.913 . . . . 1.0 112.637 175.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -55.89 130.96 45.74 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 128.634 2.774 . . . . 1.0 110.995 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.5 t -73.62 134.1 30.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 113.584 -1.643 . . . . 1.0 110.95 172.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 40.2 mttt -108.45 122.32 46.78 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 106.777 -1.564 . . . . 1.0 106.777 167.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.53 144.1 28.9 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 103.932 -2.618 . . . . 1.0 103.932 167.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -127.46 138.58 52.99 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 107.84 -1.17 . . . . 1.0 107.84 173.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -131.73 125.97 33.33 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.61 1.164 . . . . 1.0 109.847 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -92.41 110.79 47.11 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 123.163 0.585 . . . . 1.0 111.767 -172.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -65.87 -14.56 45.16 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.371 2.714 . . . . 1.0 114.659 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -88.94 -18.08 28.21 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.169 1.174 . . . . 1.0 114.169 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.2 p -129.51 -22.9 2.97 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.382 1.252 . . . . 1.0 114.382 -174.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 76.86 7.55 86.32 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 124.361 0.982 . . . . 1.0 114.486 -172.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -78.05 156.33 30.12 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 119.243 1.521 . . . . 1.0 110.877 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 20.9 t -136.44 153.66 31.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 C-N-CA 126.691 1.997 . . . . 1.0 109.814 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.58 168.07 12.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 127.658 2.383 . . . . 1.0 109.405 177.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -146.74 120.89 9.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.736 2.414 . . . . 1.0 109.136 173.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.92 155.89 43.16 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.898 0.879 . . . . 1.0 109.897 -178.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -97.81 10.15 40.85 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.113 -0.992 . . . . 1.0 111.693 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 126.12 -165.31 19.36 Favored Glycine 0 CA--C 1.532 1.143 0 C-N-CA 127.227 2.346 . . . . 1.0 113.085 -171.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.07 168.44 26.14 Favored Glycine 0 CA--C 1.535 1.32 0 N-CA-C 117.157 1.623 . . . . 1.0 117.157 169.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -57.59 100.49 0.05 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 127.421 2.288 . . . . 1.0 109.035 169.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -130.38 126.34 36.83 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.692 1.597 . . . . 1.0 109.534 178.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -44.84 -66.6 0.37 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 115.774 1.768 . . . . 1.0 115.774 -168.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.8 m -60.46 -40.98 93.17 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.403 1.001 . . . . 1.0 112.132 -175.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.6 tp -59.5 -39.07 82.61 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.053 0.941 . . . . 1.0 111.545 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -68.56 -32.56 72.57 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.628 0.771 . . . . 1.0 113.036 175.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -68.87 -42.64 76.74 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.426 1.012 . . . . 1.0 110.909 176.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.8 m0 -62.06 -36.01 80.35 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.426 0.528 . . . . 1.0 112.426 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.9 -36.11 82.48 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.5 -0.75 . . . . 1.0 112.464 172.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.07 -48.89 66.87 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.859 0.837 . . . . 1.0 111.004 176.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.2 -33.02 61.37 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.706 1.602 . . . . 1.0 114.546 -169.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -134.5 -48.43 0.77 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.832 1.049 . . . . 1.0 113.832 -176.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.62 153.91 6.11 Favored Glycine 0 N--CA 1.479 1.529 0 CA-C-N 119.35 0.977 . . . . 1.0 115.148 169.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.49 -32.87 80.18 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 123.043 2.496 . . . . 1.0 114.187 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -62.64 -46.61 87.41 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.0 0.905 . . . . 1.0 111.027 176.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.85 -53.81 54.19 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.202 1.401 . . . . 1.0 109.648 176.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.8 t -57.53 -47.09 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 C-N-CA 125.872 1.669 . . . . 1.0 111.788 -175.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.81 -37.99 89.48 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.362 0.665 . . . . 1.0 112.373 173.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 56.7 m -66.51 -29.88 70.08 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.051 0.54 . . . . 1.0 112.435 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 26.8 m0 -74.83 -10.3 59.37 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.184 1.179 . . . . 1.0 114.184 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.83 168.73 17.26 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 124.09 1.9 . . . . 1.0 115.075 -171.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 63.7 m -144.18 139.59 28.84 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 129.857 3.263 . . . . 1.0 108.369 -176.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.6 tp -97.86 126.44 43.24 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.4 1.08 . . . . 1.0 109.763 -177.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.6 mt . . . . . 0 CA--C 1.537 0.446 0 C-N-CA 125.776 1.631 . . . . 1.0 111.12 -177.293 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.613 0.244 . . . . 1.0 111.631 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 50.8 mmt-85 -69.68 61.24 0.16 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 126.124 1.769 . . . . 1.0 112.915 175.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.8 mttt -58.12 131.67 51.21 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 128.413 2.685 . . . . 1.0 110.577 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.3 t -70.66 134.53 29.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 113.572 -1.649 . . . . 1.0 110.996 171.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.4 mttt -107.99 120.1 41.34 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 106.833 -1.543 . . . . 1.0 106.833 167.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.91 143.69 31.48 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 103.21 -2.885 . . . . 1.0 103.21 167.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -127.2 142.5 51.47 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.841 -1.17 . . . . 1.0 107.841 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.68 142.32 49.79 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.869 1.268 . . . . 1.0 109.546 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -109.26 109.6 60.45 Favored Pre-proline 0 CA--C 1.548 0.892 0 N-CA-C 112.846 0.684 . . . . 1.0 112.846 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_exo -53.13 -27.58 37.7 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 124.345 3.363 . . . . 1.0 115.743 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -89.35 -21.62 23.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.774 1.229 . . . . 1.0 114.087 -173.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.5 p -127.04 -17.97 4.72 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 114.286 1.217 . . . . 1.0 114.286 -171.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.71 11.16 72.89 Favored Glycine 0 CA--C 1.541 1.699 0 C-N-CA 123.843 0.735 . . . . 1.0 114.218 -174.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -78.18 150.92 33.45 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.716 1.606 . . . . 1.0 109.696 174.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 t -132.97 154.7 40.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 126.614 1.966 . . . . 1.0 108.913 172.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.28 168.35 10.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 127.372 2.269 . . . . 1.0 109.575 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -146.95 119.77 8.66 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 127.669 2.388 . . . . 1.0 109.605 172.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.97 149.87 34.03 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.894 0.878 . . . . 1.0 109.748 -178.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -92.41 9.9 32.26 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 120.851 -1.155 . . . . 1.0 111.907 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.89 -166.1 20.66 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 127.105 2.288 . . . . 1.0 113.363 -170.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.51 168.2 27.21 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 125.466 1.508 . . . . 1.0 116.818 170.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -56.95 102.57 0.09 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 127.234 2.214 . . . . 1.0 109.077 169.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -130.8 135.13 47.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.031 1.332 . . . . 1.0 111.061 177.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -49.46 -69.17 0.12 Allowed 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 126.2 1.8 . . . . 1.0 114.811 -169.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 38.2 m -62.09 -39.51 92.72 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.35 -0.844 . . . . 1.0 111.942 -175.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.4 tp -58.6 -39.42 80.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.464 1.106 . . . . 1.0 111.557 176.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -67.52 -36.23 80.62 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.656 0.783 . . . . 1.0 112.273 175.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -67.32 -42.03 84.31 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.106 0.866 . . . . 1.0 111.313 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 34.9 m0 -61.78 -37.23 83.56 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.69 0.626 . . . . 1.0 112.69 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -64.85 -36.0 82.95 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 121.343 -0.848 . . . . 1.0 112.139 172.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.07 -49.01 66.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.667 0.746 . . . . 1.0 110.816 176.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -69.82 -37.37 76.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.531 1.533 . . . . 1.0 113.726 -170.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 11.6 m-90 -133.84 -54.55 0.87 Allowed 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.62 0.97 . . . . 1.0 113.62 -175.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 147.75 157.24 7.37 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-N 118.974 0.806 . . . . 1.0 114.934 172.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.78 -30.29 68.69 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.954 2.436 . . . . 1.0 113.842 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -62.43 -46.86 86.63 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.083 0.953 . . . . 1.0 111.086 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.84 -52.68 64.68 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.048 1.339 . . . . 1.0 109.979 176.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 38.0 t -57.42 -47.88 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 C-N-CA 125.843 1.657 . . . . 1.0 111.842 -176.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.63 -37.84 88.95 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.838 0.855 . . . . 1.0 112.587 173.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.5 m -65.31 -29.06 69.78 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.771 -0.581 . . . . 1.0 112.535 -178.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -80.74 -5.71 57.47 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.374 1.249 . . . . 1.0 114.374 174.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.27 168.65 16.86 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 124.026 1.87 . . . . 1.0 115.1 -172.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 67.7 m -142.12 135.64 29.27 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 130.083 3.353 . . . . 1.0 108.696 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 26.6 tp -87.86 126.87 35.27 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.641 1.176 . . . . 1.0 110.163 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 CA--C 1.543 0.688 0 C-N-CA 126.936 2.095 . . . . 1.0 110.361 176.905 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.282 0.087 . . . . 1.0 111.15 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.9 mmt-85 -67.56 59.16 0.06 Allowed 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 126.611 1.964 . . . . 1.0 112.996 175.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.4 mttt -54.91 132.75 47.32 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 128.869 2.867 . . . . 1.0 111.074 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.1 t -74.77 134.73 28.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 113.464 -1.698 . . . . 1.0 111.692 174.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.5 mttp -108.68 122.51 47.27 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 106.598 -1.63 . . . . 1.0 106.598 167.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.19 145.68 28.23 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 104.607 -2.368 . . . . 1.0 104.607 168.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -128.03 142.12 51.32 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.907 -1.146 . . . . 1.0 107.907 172.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -133.83 138.03 45.41 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.989 1.316 . . . . 1.0 109.137 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -105.51 110.31 64.14 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 112.348 0.499 . . . . 1.0 112.348 -173.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -53.29 -27.76 39.99 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 124.405 3.404 . . . . 1.0 115.694 176.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -86.58 -17.47 33.89 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.771 1.228 . . . . 1.0 114.216 -174.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.5 p -129.45 -22.32 3.06 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.267 1.21 . . . . 1.0 114.267 -174.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.95 8.13 82.32 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.369 0.985 . . . . 1.0 114.169 -172.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.15 156.67 29.76 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 119.141 1.47 . . . . 1.0 110.745 173.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -136.62 154.97 33.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 126.799 2.04 . . . . 1.0 109.194 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.71 168.02 10.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 127.513 2.325 . . . . 1.0 109.28 178.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -147.49 121.83 9.64 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 127.735 2.414 . . . . 1.0 109.148 174.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.31 153.6 41.44 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.731 0.812 . . . . 1.0 109.663 -179.081 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -94.51 8.13 43.22 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.964 -1.085 . . . . 1.0 111.807 174.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.51 -166.66 20.97 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 126.919 2.2 . . . . 1.0 113.4 -172.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.47 169.82 26.83 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-O 123.603 1.668 . . . . 1.0 116.886 169.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -57.69 102.97 0.11 Allowed 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 127.644 2.378 . . . . 1.0 108.818 169.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.4 t60 -130.51 131.87 45.32 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 1.0 109.767 178.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.4 tttt -49.75 -66.02 0.46 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 115.903 1.816 . . . . 1.0 115.903 -168.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 41.2 m -60.49 -41.23 93.84 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 119.488 1.04 . . . . 1.0 111.891 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.1 tp -59.05 -38.52 79.57 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.103 0.961 . . . . 1.0 111.482 177.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.31 -36.11 78.83 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.681 0.792 . . . . 1.0 112.399 175.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -66.8 -42.14 86.43 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.331 0.969 . . . . 1.0 110.75 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -61.71 -38.45 87.9 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.695 0.628 . . . . 1.0 112.695 177.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -65.34 -34.28 77.95 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.53 -0.732 . . . . 1.0 112.38 172.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.02 58.87 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.567 0.699 . . . . 1.0 111.24 176.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -74.58 -34.09 62.81 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.906 1.682 . . . . 1.0 114.669 -169.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -132.89 -47.16 0.86 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.588 0.958 . . . . 1.0 113.588 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.34 154.21 6.3 Favored Glycine 0 N--CA 1.477 1.368 0 CA-C-N 118.952 0.796 . . . . 1.0 115.084 169.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.65 -33.89 85.38 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.088 2.526 . . . . 1.0 113.864 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -61.23 -45.98 92.32 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 122.038 0.923 . . . . 1.0 111.286 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.66 -54.84 41.75 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 114.211 -1.358 . . . . 1.0 109.827 175.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 36.4 t -58.07 -47.37 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 125.462 1.505 . . . . 1.0 112.043 -174.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.32 -35.76 80.08 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.778 -0.576 . . . . 1.0 111.979 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.2 t -65.4 -33.62 76.38 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.476 0.58 . . . . 1.0 112.195 178.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 28.1 m0 -71.55 -11.84 61.06 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.093 1.146 . . . . 1.0 114.093 174.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.15 168.52 17.02 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 124.041 1.877 . . . . 1.0 114.98 -171.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 91.2 m -144.29 143.45 31.01 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 130.213 3.405 . . . . 1.0 107.958 -175.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -108.41 124.25 50.1 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.899 0.88 . . . . 1.0 109.587 -176.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.6 mt . . . . . 0 CA--C 1.538 0.49 0 C-N-CA 126.817 2.047 . . . . 1.0 110.819 -172.671 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.425 0.155 . . . . 1.0 111.349 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.2 mmt-85 -69.65 56.22 0.12 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 126.602 1.961 . . . . 1.0 113.049 176.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -55.07 130.87 43.5 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 129.056 2.943 . . . . 1.0 111.123 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 74.2 t -73.39 132.84 32.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 113.729 -1.578 . . . . 1.0 111.973 173.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.9 mttt -106.43 121.92 45.24 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.753 -1.573 . . . . 1.0 106.753 167.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -83.83 144.66 29.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 103.714 -2.698 . . . . 1.0 103.714 167.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -126.78 142.84 51.43 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.918 -1.141 . . . . 1.0 107.918 172.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -132.72 138.51 47.26 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.934 1.294 . . . . 1.0 109.088 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -105.02 110.66 64.8 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 112.317 0.488 . . . . 1.0 112.317 -174.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -53.05 -27.53 36.74 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.33 3.353 . . . . 1.0 115.998 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -87.41 -17.16 32.91 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.83 1.252 . . . . 1.0 114.086 -174.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 42.6 p -129.78 -22.46 2.94 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.362 1.245 . . . . 1.0 114.362 -174.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.76 7.24 83.36 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 124.369 0.985 . . . . 1.0 114.251 -172.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -77.79 156.79 30.29 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 123.14 1.448 . . . . 1.0 110.738 173.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -137.37 155.12 31.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 126.795 2.038 . . . . 1.0 109.461 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.25 169.64 9.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 127.266 2.226 . . . . 1.0 109.79 177.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -146.15 123.17 11.4 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 128.017 2.527 . . . . 1.0 109.641 170.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.06 155.42 43.34 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.897 0.879 . . . . 1.0 109.735 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.4 mttp -95.2 8.67 42.34 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.121 0.968 . . . . 1.0 111.872 173.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 125.94 -165.82 18.96 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 126.907 2.194 . . . . 1.0 113.232 -170.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.6 168.75 25.14 Favored Glycine 0 CA--C 1.535 1.3 0 N-CA-C 117.021 1.568 . . . . 1.0 117.021 170.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -57.68 102.05 0.09 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.322 2.249 . . . . 1.0 108.796 169.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -130.42 127.78 39.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.349 1.46 . . . . 1.0 109.6 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.1 tttt -45.39 -66.69 0.36 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 116.036 1.865 . . . . 1.0 116.036 -168.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.8 m -60.12 -41.25 92.24 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.23 0.923 . . . . 1.0 112.28 -177.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.5 tp -59.95 -38.7 83.19 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.897 0.879 . . . . 1.0 111.576 178.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -68.74 -32.78 72.79 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.679 0.792 . . . . 1.0 112.707 174.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -68.33 -42.9 78.66 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.563 1.074 . . . . 1.0 110.947 176.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.0 m0 -61.61 -36.37 80.52 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.555 0.576 . . . . 1.0 112.555 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.82 -36.05 82.39 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.45 -0.781 . . . . 1.0 112.432 172.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.2 -48.68 67.17 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.701 0.763 . . . . 1.0 111.024 176.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -75.38 -33.56 61.03 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.782 1.633 . . . . 1.0 114.336 -169.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.3 m-90 -134.46 -48.16 0.77 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.987 1.106 . . . . 1.0 113.987 -175.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.82 153.22 5.93 Favored Glycine 0 N--CA 1.479 1.518 0 CA-C-N 119.142 0.883 . . . . 1.0 115.225 169.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.3 -32.51 81.8 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.093 2.529 . . . . 1.0 114.356 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -62.43 -46.63 87.66 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 122.136 0.97 . . . . 1.0 111.03 176.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.39 -53.22 60.63 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 114.15 -1.386 . . . . 1.0 110.179 176.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 34.4 t -57.71 -47.49 85.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 C-N-CA 125.644 1.578 . . . . 1.0 111.88 -175.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.6 -38.08 89.77 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.451 0.7 . . . . 1.0 112.322 173.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.4 m -66.35 -29.66 69.89 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.414 0.524 . . . . 1.0 112.414 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -76.52 -8.85 58.03 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.953 1.094 . . . . 1.0 113.953 173.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -72.42 168.8 17.71 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 124.032 1.872 . . . . 1.0 114.866 -171.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 95.8 m -144.21 136.29 26.35 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 129.63 3.172 . . . . 1.0 108.444 -175.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 27.6 tp -92.76 128.16 38.53 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 124.663 1.185 . . . . 1.0 109.657 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.6 mt . . . . . 0 CA--C 1.535 0.4 0 C-N-CA 125.866 1.666 . . . . 1.0 111.246 -179.058 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 120.348 0.118 . . . . 1.0 111.202 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.2 mmt-85 -68.84 56.51 0.09 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.741 2.016 . . . . 1.0 113.048 175.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 66.3 mttt -56.66 129.12 39.71 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 128.404 2.682 . . . . 1.0 110.538 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.6 t -72.57 132.36 33.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 113.488 -1.687 . . . . 1.0 110.763 173.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -106.39 122.22 45.83 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 106.649 -1.612 . . . . 1.0 106.649 167.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.08 144.9 28.75 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 103.706 -2.702 . . . . 1.0 103.706 167.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -128.28 141.03 51.56 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.745 -1.205 . . . . 1.0 107.745 174.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -131.77 140.57 49.25 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.688 1.195 . . . . 1.0 109.318 177.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -106.35 109.64 63.29 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 123.266 0.627 . . . . 1.0 112.283 -174.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -52.79 -27.33 33.91 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 124.129 3.22 . . . . 1.0 115.847 175.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -88.72 -19.12 26.51 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.558 1.143 . . . . 1.0 113.926 -173.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.0 p -129.84 -20.32 3.18 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 114.561 1.319 . . . . 1.0 114.561 -172.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.79 10.68 77.19 Favored Glycine 0 CA--C 1.537 1.456 0 CA-C-N 118.73 0.696 . . . . 1.0 114.145 -173.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -74.14 149.12 41.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.194 1.397 . . . . 1.0 109.426 170.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -133.13 154.23 39.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 C-N-CA 126.776 2.03 . . . . 1.0 109.0 173.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.15 168.65 10.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 127.456 2.303 . . . . 1.0 109.331 178.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -147.62 120.87 8.94 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 127.843 2.457 . . . . 1.0 109.27 173.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.27 155.21 42.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.086 0.954 . . . . 1.0 109.968 -178.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -96.04 10.57 37.06 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 120.88 -1.137 . . . . 1.0 112.023 176.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 124.77 -167.68 17.06 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 127.106 2.288 . . . . 1.0 112.969 -171.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.67 170.14 31.43 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 116.999 1.559 . . . . 1.0 116.999 170.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -57.03 103.15 0.1 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.452 2.301 . . . . 1.0 109.218 169.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -130.47 134.89 47.44 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.344 1.458 . . . . 1.0 110.243 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -52.44 -66.77 0.33 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 115.918 1.822 . . . . 1.0 115.918 -168.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 34.4 m -60.1 -40.93 91.36 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 119.41 1.004 . . . . 1.0 111.963 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.5 tp -57.55 -39.12 75.96 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.269 1.027 . . . . 1.0 111.765 176.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -68.6 -35.78 77.8 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.829 0.851 . . . . 1.0 112.502 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -67.0 -41.31 86.93 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.278 0.945 . . . . 1.0 110.838 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 34.6 m0 -61.71 -37.31 83.69 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.67 0.618 . . . . 1.0 112.67 175.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -65.16 -36.23 83.59 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.444 -0.785 . . . . 1.0 112.107 172.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.92 -48.27 69.17 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.724 0.774 . . . . 1.0 110.971 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -76.43 -34.12 58.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.384 1.474 . . . . 1.0 114.538 -169.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 13.4 m-90 -133.5 -47.84 0.82 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.053 1.131 . . . . 1.0 114.053 -175.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.08 153.47 6.05 Favored Glycine 0 N--CA 1.479 1.543 0 CA-C-N 119.226 0.921 . . . . 1.0 115.354 169.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.15 -33.08 82.88 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.281 2.654 . . . . 1.0 114.359 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -63.35 -46.54 86.11 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.716 0.807 . . . . 1.0 110.875 177.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.9 -53.31 59.87 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.331 1.452 . . . . 1.0 109.812 176.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 29.3 t -57.52 -47.7 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 C-N-CA 125.904 1.682 . . . . 1.0 111.981 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -66.15 -36.17 82.42 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.29 0.636 . . . . 1.0 112.563 173.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 64.4 m -66.63 -30.66 70.99 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.544 0.572 . . . . 1.0 112.544 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -75.89 -8.84 57.86 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.057 1.132 . . . . 1.0 114.057 173.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.52 168.98 16.41 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 124.218 1.961 . . . . 1.0 114.613 -173.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 89.8 m -142.98 139.63 30.71 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 129.851 3.26 . . . . 1.0 108.215 -176.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -97.43 126.75 42.87 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.376 1.071 . . . . 1.0 109.972 -177.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 85.9 mt . . . . . 0 CA--C 1.538 0.508 0 C-N-CA 125.92 1.688 . . . . 1.0 110.944 -177.109 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.121 0.01 . . . . 1.0 111.024 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -66.28 60.77 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.458 1.903 . . . . 1.0 113.737 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.0 mttt -55.32 137.2 48.22 Favored 'General case' 0 CA--C 1.523 -0.091 0 C-N-CA 128.854 2.862 . . . . 1.0 110.464 175.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 97.1 t -77.06 135.82 25.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 113.56 -1.654 . . . . 1.0 110.843 171.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -116.32 121.8 43.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.627 -1.249 . . . . 1.0 107.627 167.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.01 147.07 35.0 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 105.239 -2.134 . . . . 1.0 105.239 168.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -129.06 140.03 51.77 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.795 -1.187 . . . . 1.0 107.795 172.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -132.81 129.52 38.63 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.711 1.205 . . . . 1.0 109.659 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -95.03 110.91 52.62 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 123.074 0.55 . . . . 1.0 111.597 -172.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.97 -15.25 48.06 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.324 2.682 . . . . 1.0 114.36 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -89.24 -20.52 24.05 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.281 1.215 . . . . 1.0 114.281 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.1 p -130.03 -21.24 3.01 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 114.894 1.442 . . . . 1.0 114.894 -172.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.19 9.42 84.13 Favored Glycine 0 CA--C 1.54 1.596 0 CA-C-N 118.808 0.731 . . . . 1.0 114.373 -173.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -72.95 148.82 43.92 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.684 1.242 . . . . 1.0 109.524 170.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 t -133.03 153.4 37.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 C-N-CA 126.605 1.962 . . . . 1.0 109.501 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.08 168.7 10.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 127.458 2.303 . . . . 1.0 109.198 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -147.78 121.42 9.2 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 128.205 2.602 . . . . 1.0 108.996 173.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.32 155.66 42.79 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.773 0.829 . . . . 1.0 109.653 -178.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -96.79 6.13 49.27 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.225 1.01 . . . . 1.0 111.789 173.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 132.11 -165.05 23.66 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.855 2.169 . . . . 1.0 113.609 -175.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.84 170.74 26.43 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 123.461 1.589 . . . . 1.0 117.042 169.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -57.82 101.36 0.07 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.466 2.306 . . . . 1.0 109.014 169.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -130.4 126.36 36.86 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.719 1.608 . . . . 1.0 109.592 178.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -44.84 -67.17 0.31 Allowed 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 116.07 1.878 . . . . 1.0 116.07 -169.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.2 m -60.11 -40.98 91.56 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 119.212 0.914 . . . . 1.0 112.214 -175.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 41.1 tp -59.44 -39.04 82.29 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.23 1.012 . . . . 1.0 111.611 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -68.58 -32.62 72.66 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.753 0.821 . . . . 1.0 113.151 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -69.12 -42.68 75.74 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 119.593 1.088 . . . . 1.0 110.777 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -60.57 -36.91 79.64 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.668 0.618 . . . . 1.0 112.668 177.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.28 -36.53 84.39 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 121.475 -0.765 . . . . 1.0 112.526 172.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.35 -48.37 70.44 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.854 0.835 . . . . 1.0 111.087 176.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -76.31 -33.57 59.05 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.342 1.457 . . . . 1.0 114.58 -169.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.3 m-90 -133.47 -48.83 0.83 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.923 1.083 . . . . 1.0 113.923 -176.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 141.19 153.44 5.96 Favored Glycine 0 N--CA 1.477 1.421 0 CA-C-N 119.046 0.839 . . . . 1.0 115.041 169.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -62.6 -32.94 79.23 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.075 2.517 . . . . 1.0 114.378 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -61.94 -46.64 88.42 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.89 0.852 . . . . 1.0 111.15 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.61 -53.96 51.97 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.996 1.318 . . . . 1.0 109.836 176.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 34.4 t -57.74 -46.69 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 125.425 1.49 . . . . 1.0 112.077 -175.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -64.98 -37.66 88.39 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.354 0.662 . . . . 1.0 112.388 173.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 55.6 m -66.46 -30.14 70.42 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.163 0.585 . . . . 1.0 112.365 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -74.95 -10.02 59.08 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.979 1.103 . . . . 1.0 113.979 173.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.14 167.23 19.77 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 124.032 1.872 . . . . 1.0 114.501 -173.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 95.8 m -146.37 133.11 19.98 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 129.305 3.042 . . . . 1.0 108.466 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.8 tt -100.37 124.83 46.35 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.685 0.794 . . . . 1.0 110.016 -171.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 CA--C 1.533 0.31 0 C-N-CA 126.657 1.983 . . . . 1.0 111.056 -170.868 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 111.137 0.051 . . . . 1.0 111.137 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 61.2 mmt-85 -65.41 61.58 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 126.658 1.983 . . . . 1.0 113.482 176.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -54.51 132.8 45.53 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 128.45 2.7 . . . . 1.0 111.04 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 74.5 t -70.88 135.22 28.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 113.088 -1.869 . . . . 1.0 111.264 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.3 mttp -107.44 120.62 42.67 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.304 -1.739 . . . . 1.0 106.304 167.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.85 144.66 29.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 104.108 -2.553 . . . . 1.0 104.108 168.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -127.24 140.17 52.41 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.994 -1.113 . . . . 1.0 107.994 173.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -132.08 130.95 41.91 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.7 1.2 . . . . 1.0 109.704 178.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -97.63 110.95 57.31 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 122.777 0.431 . . . . 1.0 111.31 -173.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -66.32 -14.63 45.05 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.45 2.767 . . . . 1.0 114.666 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -88.63 -17.63 29.67 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.726 1.21 . . . . 1.0 114.219 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 40.0 p -129.75 -23.56 2.82 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 114.534 1.309 . . . . 1.0 114.534 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.87 7.48 87.43 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.294 0.949 . . . . 1.0 114.234 -172.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.44 156.44 29.39 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.098 1.449 . . . . 1.0 110.976 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -136.37 154.11 32.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 126.681 1.992 . . . . 1.0 109.632 179.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.88 168.01 11.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 127.672 2.389 . . . . 1.0 109.525 177.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -147.03 120.76 9.21 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.585 2.354 . . . . 1.0 109.481 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.32 151.33 37.33 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.753 0.821 . . . . 1.0 109.685 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -95.17 10.13 37.07 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.1 -1.0 . . . . 1.0 111.826 176.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 129.33 -166.09 21.77 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 126.982 2.229 . . . . 1.0 113.093 -172.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.68 169.16 22.39 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 117.195 1.638 . . . . 1.0 117.195 170.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -57.66 100.99 0.06 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.717 2.407 . . . . 1.0 109.2 169.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.8 t60 -130.5 130.74 44.56 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.623 1.569 . . . . 1.0 109.939 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -49.52 -66.96 0.31 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.647 1.721 . . . . 1.0 115.647 -168.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.5 m -60.01 -40.94 90.96 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 119.323 0.965 . . . . 1.0 111.911 -175.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.9 tp -58.89 -38.39 78.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.014 0.926 . . . . 1.0 111.756 177.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.05 -36.33 79.7 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.574 0.75 . . . . 1.0 112.281 175.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.92 -42.14 85.87 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.102 0.865 . . . . 1.0 110.839 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.3 m0 -62.17 -38.03 87.52 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.587 0.588 . . . . 1.0 112.587 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.7 -33.87 76.87 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.535 -0.728 . . . . 1.0 112.181 172.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.48 -49.27 56.36 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.435 0.636 . . . . 1.0 111.451 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -74.24 -34.13 63.56 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.204 1.802 . . . . 1.0 114.67 -169.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.7 m-90 -133.05 -46.5 0.85 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.574 0.953 . . . . 1.0 113.574 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.42 153.84 6.32 Favored Glycine 0 N--CA 1.48 1.613 0 C-N-CA 123.849 0.738 . . . . 1.0 114.871 170.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.32 -33.59 89.02 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 122.98 2.453 . . . . 1.0 113.67 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -61.26 -45.88 92.65 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.987 0.899 . . . . 1.0 111.387 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.86 -55.16 37.58 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.218 -1.355 . . . . 1.0 109.923 175.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.6 t -57.3 -47.78 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 C-N-CA 125.59 1.556 . . . . 1.0 111.997 -175.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -67.28 -34.61 77.77 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.936 -0.477 . . . . 1.0 112.263 176.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.2 t -65.96 -33.99 77.09 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.73 -0.606 . . . . 1.0 112.234 177.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -71.5 -11.93 61.12 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.031 1.123 . . . . 1.0 114.031 174.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.82 168.71 16.18 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 124.117 1.913 . . . . 1.0 115.116 -170.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 79.5 m -142.26 141.83 32.51 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 130.107 3.363 . . . . 1.0 108.323 -177.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.3 tt -104.44 120.54 41.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.374 1.07 . . . . 1.0 110.206 -176.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 74.9 mt . . . . . 0 CA--C 1.54 0.579 0 C-N-CA 127.3 2.24 . . . . 1.0 110.92 -175.752 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.386 0.136 . . . . 1.0 111.264 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 31.4 mmt-85 -67.81 58.73 0.07 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 126.813 2.045 . . . . 1.0 113.077 175.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.8 mttt -55.54 131.26 45.73 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 128.769 2.828 . . . . 1.0 111.08 178.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 85.7 t -73.77 134.48 29.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 113.629 -1.623 . . . . 1.0 111.433 173.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.8 mttp -108.54 122.92 48.07 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 106.577 -1.638 . . . . 1.0 106.577 167.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.27 145.59 28.22 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 104.442 -2.429 . . . . 1.0 104.442 168.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -128.39 142.29 51.15 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.199 -1.037 . . . . 1.0 108.199 173.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -132.74 139.74 47.75 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.938 1.295 . . . . 1.0 109.485 177.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -106.82 109.75 63.28 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 123.234 0.614 . . . . 1.0 112.483 -173.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -53.36 -26.67 36.07 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.269 3.312 . . . . 1.0 115.957 176.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -88.99 -18.79 26.68 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.52 1.128 . . . . 1.0 113.996 -174.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.9 p -129.54 -19.76 3.36 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.49 1.292 . . . . 1.0 114.49 -172.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.61 11.44 72.74 Favored Glycine 0 CA--C 1.54 1.647 0 CA-C-N 118.741 0.7 . . . . 1.0 114.159 -173.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -75.32 149.61 38.69 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.39 1.476 . . . . 1.0 109.4 171.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.5 t -132.47 154.75 40.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 126.754 2.022 . . . . 1.0 109.035 172.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.89 167.69 12.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 127.318 2.247 . . . . 1.0 109.384 177.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -146.84 120.31 9.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 127.483 2.313 . . . . 1.0 108.888 173.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.22 153.58 41.49 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.75 0.82 . . . . 1.0 109.588 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.4 mttp -95.72 9.05 41.71 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.1 -1.0 . . . . 1.0 111.573 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.84 -166.68 20.4 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 127.238 2.352 . . . . 1.0 113.202 -171.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.92 169.16 27.1 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 117.272 1.669 . . . . 1.0 117.272 169.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -57.64 101.42 0.07 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 127.708 2.403 . . . . 1.0 108.944 169.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -130.66 130.2 43.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.478 1.511 . . . . 1.0 109.625 178.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -48.68 -65.52 0.55 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 115.971 1.841 . . . . 1.0 115.971 -169.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 44.3 m -62.22 -39.22 92.08 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 119.266 0.939 . . . . 1.0 111.925 -175.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.5 tp -59.67 -39.44 84.51 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.773 0.829 . . . . 1.0 111.72 176.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -67.41 -35.83 80.06 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.664 0.786 . . . . 1.0 112.485 175.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -67.2 -43.87 81.05 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.06 0.846 . . . . 1.0 110.271 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.8 m0 -60.22 -38.54 83.7 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.73 -0.668 . . . . 1.0 112.487 176.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -65.18 -34.54 78.62 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.512 -0.742 . . . . 1.0 112.53 172.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.86 -49.85 59.81 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.804 0.812 . . . . 1.0 111.191 176.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -75.58 -34.13 60.64 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.859 1.664 . . . . 1.0 114.822 -169.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.6 m-90 -132.75 -47.01 0.87 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 113.651 0.982 . . . . 1.0 113.651 -176.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.01 154.01 6.28 Favored Glycine 0 N--CA 1.479 1.507 0 CA-C-N 118.944 0.793 . . . . 1.0 114.967 169.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -61.76 -33.83 84.46 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.075 2.517 . . . . 1.0 113.928 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -60.9 -45.96 92.55 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 122.07 0.938 . . . . 1.0 111.376 177.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.69 -54.97 40.23 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.182 -1.372 . . . . 1.0 109.916 175.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.2 t -58.11 -47.82 86.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 125.694 1.598 . . . . 1.0 111.786 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.14 -35.29 79.41 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.127 0.571 . . . . 1.0 112.157 176.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.3 t -65.43 -34.01 77.29 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.079 0.552 . . . . 1.0 112.189 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 24.3 m0 -72.28 -10.06 59.29 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.963 1.097 . . . . 1.0 113.963 174.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.45 168.46 17.45 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 124.172 1.939 . . . . 1.0 115.045 -172.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 92.8 m -144.14 142.81 30.79 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 130.133 3.373 . . . . 1.0 107.812 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -107.92 123.55 48.78 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.893 0.877 . . . . 1.0 109.767 -176.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.7 mt . . . . . 0 CA--C 1.54 0.572 0 C-N-CA 126.758 2.023 . . . . 1.0 110.69 -172.869 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 111.13 0.048 . . . . 1.0 111.13 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.6 mmp_? -65.59 57.37 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 127.268 2.227 . . . . 1.0 114.191 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -56.59 127.97 33.94 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 128.795 2.838 . . . . 1.0 110.221 175.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.6 t -70.65 133.86 31.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 113.62 -1.627 . . . . 1.0 110.646 174.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -108.09 121.87 45.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.529 -1.656 . . . . 1.0 106.529 168.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.63 144.46 28.58 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 103.694 -2.706 . . . . 1.0 103.694 167.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -127.66 140.36 52.13 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 107.691 -1.226 . . . . 1.0 107.691 174.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -131.83 139.25 48.79 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.848 1.259 . . . . 1.0 109.462 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -105.63 110.38 64.17 Favored Pre-proline 0 CA--C 1.544 0.713 0 N-CA-C 112.413 0.523 . . . . 1.0 112.413 -173.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo -52.73 -27.5 34.14 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 124.338 3.359 . . . . 1.0 115.87 176.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -87.97 -17.24 31.71 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.833 1.253 . . . . 1.0 114.273 -174.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.4 p -129.9 -22.1 2.95 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.114 1.153 . . . . 1.0 114.114 -174.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.01 7.52 81.75 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 124.09 0.852 . . . . 1.0 114.443 -172.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -77.45 156.49 31.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.011 1.406 . . . . 1.0 110.681 173.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.0 t -136.11 155.29 34.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 C-N-CA 126.986 2.115 . . . . 1.0 109.536 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.47 168.42 10.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 127.85 2.46 . . . . 1.0 109.404 177.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -147.48 121.84 9.65 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.757 2.423 . . . . 1.0 109.023 173.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.64 156.68 43.38 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.931 0.892 . . . . 1.0 109.972 -178.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -96.37 9.51 41.01 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.893 -1.129 . . . . 1.0 112.101 175.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 125.24 -167.56 17.57 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 127.186 2.327 . . . . 1.0 112.969 -171.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.1 170.07 32.68 Favored Glycine 0 CA--C 1.537 1.467 0 N-CA-C 117.082 1.593 . . . . 1.0 117.082 169.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -57.33 101.38 0.07 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.703 2.401 . . . . 1.0 108.945 169.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -130.68 133.95 46.52 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.121 1.369 . . . . 1.0 110.638 178.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -45.33 -70.55 0.1 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 125.895 1.678 . . . . 1.0 115.408 -169.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.4 m -61.04 -41.21 96.15 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.571 0.748 . . . . 1.0 111.949 -175.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 40.0 tp -58.44 -39.54 80.12 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.099 0.96 . . . . 1.0 111.69 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -69.72 -32.52 71.13 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.778 0.831 . . . . 1.0 112.965 175.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -68.44 -43.17 77.68 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.798 1.181 . . . . 1.0 111.221 175.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -61.56 -35.43 77.75 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.678 0.622 . . . . 1.0 112.678 178.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.76 -36.53 83.83 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 121.515 -0.741 . . . . 1.0 112.514 171.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.7 -48.45 69.24 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.826 0.822 . . . . 1.0 110.818 176.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.94 -32.84 59.74 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.657 1.583 . . . . 1.0 114.448 -169.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -134.87 -50.17 0.76 Allowed 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.008 1.114 . . . . 1.0 114.008 -176.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.2 153.87 6.02 Favored Glycine 0 N--CA 1.477 1.385 0 CA-C-N 119.315 0.962 . . . . 1.0 115.458 169.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.47 -33.24 79.65 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.264 2.643 . . . . 1.0 114.262 -178.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -63.76 -46.71 84.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.927 0.87 . . . . 1.0 110.887 177.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.08 -53.45 58.06 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.223 1.409 . . . . 1.0 110.197 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 25.7 t -57.43 -48.07 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 125.769 1.628 . . . . 1.0 111.804 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.7 -35.79 80.97 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.574 0.583 . . . . 1.0 112.574 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 21.9 t -65.73 -33.44 75.88 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.228 0.611 . . . . 1.0 112.067 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -72.75 -10.97 60.41 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.012 1.116 . . . . 1.0 114.012 174.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.88 169.25 15.12 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 124.321 2.01 . . . . 1.0 114.86 -172.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.0 m -143.67 142.26 30.92 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 130.148 3.379 . . . . 1.0 107.711 -176.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.1 tt -106.98 123.04 47.61 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.067 0.947 . . . . 1.0 109.586 -175.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.4 mt . . . . . 0 CA--C 1.537 0.479 0 C-N-CA 126.424 1.89 . . . . 1.0 110.888 -172.981 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 111.326 0.121 . . . . 1.0 111.326 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 51.9 mmt-85 -65.41 66.77 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 126.277 1.831 . . . . 1.0 112.637 175.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 44.8 mttt -62.94 137.33 58.24 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 128.934 2.894 . . . . 1.0 110.575 178.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 87.8 t -76.37 136.14 25.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 C-N-CA 125.723 1.609 . . . . 1.0 111.309 172.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -109.63 122.56 47.74 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 106.179 -1.786 . . . . 1.0 106.179 167.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.21 145.27 28.43 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 104.269 -2.493 . . . . 1.0 104.269 168.265 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -127.36 141.76 51.61 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.028 -1.101 . . . . 1.0 108.028 172.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -133.28 137.43 46.02 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.884 1.274 . . . . 1.0 109.041 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -107.45 110.89 63.13 Favored Pre-proline 0 CA--C 1.548 0.888 0 N-CA-C 112.417 0.525 . . . . 1.0 112.417 -172.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -53.19 -27.22 36.74 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 124.636 3.557 . . . . 1.0 115.593 175.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -89.05 -15.08 34.9 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.119 1.368 . . . . 1.0 114.575 -174.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.6 p -128.93 -21.83 3.28 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.351 1.061 . . . . 1.0 113.831 -176.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.77 9.75 79.39 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.577 1.084 . . . . 1.0 114.023 -172.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -83.47 158.89 21.87 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.03 1.415 . . . . 1.0 110.853 175.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -136.74 155.51 33.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 C-N-CA 126.96 2.104 . . . . 1.0 109.577 178.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.99 168.53 9.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 127.468 2.307 . . . . 1.0 109.29 178.206 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -147.22 121.66 9.69 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.685 2.394 . . . . 1.0 109.287 173.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.25 153.61 40.78 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.851 0.861 . . . . 1.0 109.727 -179.392 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 33.7 mttp -97.06 10.75 38.44 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.875 -1.141 . . . . 1.0 111.5 174.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.98 -165.53 21.73 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 127.253 2.358 . . . . 1.0 113.133 -173.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.12 168.9 23.81 Favored Glycine 0 CA--C 1.537 1.433 0 CA-C-O 123.5 1.611 . . . . 1.0 117.054 170.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -57.72 101.9 0.08 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 127.498 2.319 . . . . 1.0 109.093 169.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -130.51 123.7 30.24 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.497 1.519 . . . . 1.0 109.711 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -43.94 -65.37 0.51 Allowed 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 115.486 1.662 . . . . 1.0 115.486 -169.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.7 m -58.69 -41.59 86.59 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 119.379 0.99 . . . . 1.0 112.454 -176.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.2 tp -60.97 -37.9 84.06 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.058 0.943 . . . . 1.0 111.457 177.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -69.5 -32.79 71.87 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.533 0.733 . . . . 1.0 112.773 174.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.03 -42.1 76.82 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.823 1.192 . . . . 1.0 110.973 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -62.39 -37.65 86.57 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.554 0.576 . . . . 1.0 112.554 177.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -65.67 -32.06 73.42 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.668 -0.645 . . . . 1.0 112.332 172.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.36 -51.4 24.35 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.434 0.635 . . . . 1.0 110.968 176.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.437 ' HE3' ' CH2' ' A' ' 111' ' ' TRP . 47.1 mtmt -74.68 -29.06 61.09 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 115.309 1.596 . . . . 1.0 115.309 -169.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.437 ' CH2' ' HE3' ' A' ' 110' ' ' LYS . 16.5 m-90 -134.76 -47.51 0.74 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.176 1.176 . . . . 1.0 114.176 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.1 154.18 6.31 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 119.09 0.859 . . . . 1.0 114.942 170.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -61.03 -33.95 91.18 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.268 2.645 . . . . 1.0 113.759 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -61.41 -45.82 92.73 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.877 0.846 . . . . 1.0 111.238 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.74 -55.11 38.36 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 114.326 -1.306 . . . . 1.0 110.073 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 32.9 t -57.42 -48.24 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 125.819 1.648 . . . . 1.0 111.923 -174.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -66.94 -34.7 78.35 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.085 0.554 . . . . 1.0 112.147 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.6 m -67.58 -30.45 70.06 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 112.641 0.608 . . . . 1.0 112.641 178.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 17.9 m0 -74.55 -10.97 60.07 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.212 1.19 . . . . 1.0 114.212 173.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.7 168.46 16.51 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 124.091 1.901 . . . . 1.0 114.823 -170.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 99.6 m -142.95 143.19 31.87 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 130.133 3.373 . . . . 1.0 107.909 -176.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.69 122.91 47.31 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.082 0.953 . . . . 1.0 109.818 -176.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 CA--C 1.539 0.542 0 C-N-CA 126.651 1.98 . . . . 1.0 110.52 -174.413 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 111.275 0.102 . . . . 1.0 111.275 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 36.7 mmt-85 -66.74 59.57 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 126.627 1.971 . . . . 1.0 113.053 174.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.7 mttt -54.05 133.01 43.67 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 128.744 2.817 . . . . 1.0 111.152 178.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.1 t -75.6 135.05 27.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 113.45 -1.704 . . . . 1.0 111.607 172.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.0 mttp -110.18 123.55 49.97 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 106.928 -1.508 . . . . 1.0 106.928 167.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -83.94 145.4 28.58 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 104.414 -2.439 . . . . 1.0 104.414 168.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -128.48 142.65 51.02 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.04 -1.096 . . . . 1.0 108.04 173.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -132.71 140.85 48.29 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.711 1.204 . . . . 1.0 109.467 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -107.81 109.57 62.26 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 123.077 0.551 . . . . 1.0 112.271 -173.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -53.28 -26.89 36.2 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 124.57 3.513 . . . . 1.0 115.785 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -88.68 -18.82 27.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.506 1.122 . . . . 1.0 113.928 -174.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 47.0 p -129.64 -19.85 3.31 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 114.543 1.312 . . . . 1.0 114.543 -172.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.88 11.53 73.99 Favored Glycine 0 CA--C 1.538 1.473 0 C-N-CA 123.879 0.752 . . . . 1.0 114.276 -173.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -75.72 149.82 37.98 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.176 1.39 . . . . 1.0 109.454 171.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -132.94 154.73 40.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 126.802 2.041 . . . . 1.0 108.962 172.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.84 168.15 11.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 127.45 2.3 . . . . 1.0 109.448 178.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -147.0 121.1 9.44 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 127.844 2.458 . . . . 1.0 109.097 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.71 152.58 39.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.73 0.812 . . . . 1.0 109.826 -178.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -93.06 7.57 43.61 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 120.921 -1.112 . . . . 1.0 111.988 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.77 -166.44 21.26 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 126.989 2.233 . . . . 1.0 113.133 -171.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.66 169.66 27.16 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-O 123.366 1.537 . . . . 1.0 116.807 169.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -57.26 103.0 0.1 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.533 2.333 . . . . 1.0 108.92 169.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -130.64 131.87 45.14 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.275 1.43 . . . . 1.0 110.161 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -48.96 -67.46 0.26 Allowed 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 115.909 1.818 . . . . 1.0 115.909 -168.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 34.1 m -59.95 -41.02 90.97 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 119.008 0.822 . . . . 1.0 111.893 -176.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.1 tp -58.53 -38.94 78.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.085 0.954 . . . . 1.0 111.571 177.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -68.54 -35.81 77.95 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.686 0.794 . . . . 1.0 112.352 175.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -66.79 -42.11 86.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.368 0.986 . . . . 1.0 110.744 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -61.47 -38.79 88.53 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.5 0.555 . . . . 1.0 112.5 176.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -65.06 -34.48 78.52 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.424 -0.797 . . . . 1.0 112.081 173.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.65 -48.74 63.25 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.737 0.779 . . . . 1.0 111.388 176.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.62 -33.89 60.53 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.773 1.629 . . . . 1.0 114.822 -169.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.4 m-90 -133.23 -45.89 0.84 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.814 1.042 . . . . 1.0 113.814 -176.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.64 154.23 6.39 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-N 119.073 0.851 . . . . 1.0 115.223 169.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.62 -34.47 84.41 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.063 2.509 . . . . 1.0 113.795 178.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -60.57 -45.87 92.34 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 122.072 0.939 . . . . 1.0 111.357 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.85 -54.84 41.52 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.017 -1.447 . . . . 1.0 110.067 175.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.9 t -57.91 -47.67 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 125.528 1.531 . . . . 1.0 112.201 -175.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -67.04 -35.21 79.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.95 0.5 . . . . 1.0 112.232 175.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.6 t -65.38 -33.99 77.26 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.688 -0.633 . . . . 1.0 112.331 177.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.6 m0 -72.63 -9.6 58.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.994 1.109 . . . . 1.0 113.994 174.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.51 168.29 16.56 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 124.041 1.877 . . . . 1.0 114.893 -173.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 89.7 m -143.89 138.92 28.91 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 129.79 3.236 . . . . 1.0 108.157 -176.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 30.8 tp -98.63 127.64 44.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.335 1.054 . . . . 1.0 109.718 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.5 mt . . . . . 0 CA--C 1.533 0.317 0 C-N-CA 125.999 1.72 . . . . 1.0 110.878 -176.376 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 111.689 0.255 . . . . 1.0 111.689 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.1 mmp_? -69.31 58.32 0.11 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.731 2.013 . . . . 1.0 113.518 174.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -53.42 128.19 27.74 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 128.22 2.608 . . . . 1.0 110.179 174.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.8 t -72.3 134.39 29.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 113.633 -1.621 . . . . 1.0 110.521 171.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -108.33 121.57 45.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.516 -1.661 . . . . 1.0 106.516 167.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.81 143.82 28.85 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 103.896 -2.631 . . . . 1.0 103.896 167.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -127.66 139.96 52.39 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.761 -1.199 . . . . 1.0 107.761 175.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.48 140.0 49.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.546 1.139 . . . . 1.0 108.986 177.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -105.57 109.89 63.68 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 112.542 0.571 . . . . 1.0 112.542 -174.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -52.96 -26.77 32.9 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.18 3.253 . . . . 1.0 115.878 176.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -87.65 -17.44 31.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.883 1.273 . . . . 1.0 114.232 -174.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.3 p -129.79 -22.59 2.92 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 114.028 1.122 . . . . 1.0 114.028 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.42 8.78 80.94 Favored Glycine 0 CA--C 1.539 1.554 0 C-N-CA 124.048 0.832 . . . . 1.0 114.352 -172.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.32 156.0 29.83 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 119.061 1.43 . . . . 1.0 110.506 172.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -135.83 155.52 36.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 C-N-CA 126.917 2.087 . . . . 1.0 109.563 178.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.69 168.1 10.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 127.689 2.396 . . . . 1.0 109.261 177.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -146.92 122.01 10.11 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 127.772 2.429 . . . . 1.0 109.288 172.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.08 156.4 42.98 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.919 0.888 . . . . 1.0 109.861 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.0 mttp -97.13 10.34 39.64 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.038 -1.039 . . . . 1.0 111.986 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 124.98 -166.65 17.6 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 127.253 2.359 . . . . 1.0 112.858 -171.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.5 169.52 29.72 Favored Glycine 0 CA--C 1.537 1.408 0 N-CA-C 117.405 1.722 . . . . 1.0 117.405 169.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -57.74 100.37 0.05 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.607 2.363 . . . . 1.0 109.265 169.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -130.43 130.96 44.96 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.446 1.498 . . . . 1.0 109.75 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -47.17 -67.09 0.31 Allowed 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 115.501 1.667 . . . . 1.0 115.501 -168.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.7 m -60.15 -41.02 91.87 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 119.29 0.95 . . . . 1.0 112.083 -174.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 46.4 tp -59.28 -39.52 83.19 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.243 1.017 . . . . 1.0 111.522 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -68.84 -32.44 72.12 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 113.193 0.812 . . . . 1.0 113.193 175.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.33 -42.99 74.6 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 119.422 1.01 . . . . 1.0 110.858 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -61.53 -35.66 78.36 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.761 0.652 . . . . 1.0 112.761 177.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -65.13 -36.91 85.76 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 121.39 -0.819 . . . . 1.0 112.696 171.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.92 -48.26 69.18 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.703 0.763 . . . . 1.0 110.863 176.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -76.07 -32.89 59.48 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.568 1.547 . . . . 1.0 114.415 -169.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -135.0 -49.76 0.75 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.019 1.118 . . . . 1.0 114.019 -176.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.44 153.62 5.95 Favored Glycine 0 N--CA 1.48 1.577 0 CA-C-N 119.416 1.007 . . . . 1.0 115.353 169.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.1 -33.24 82.91 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.26 2.64 . . . . 1.0 114.328 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -63.11 -46.76 85.82 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 122.009 0.909 . . . . 1.0 110.966 177.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.64 -53.56 57.02 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.065 1.346 . . . . 1.0 110.032 176.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 27.7 t -57.15 -48.24 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.991 1.717 . . . . 1.0 111.81 -176.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -66.24 -36.01 81.9 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.076 0.551 . . . . 1.0 112.442 174.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.7 m -67.12 -30.58 70.62 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.644 0.609 . . . . 1.0 112.644 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 23.0 m0 -75.05 -10.04 59.1 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.805 1.039 . . . . 1.0 113.805 173.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.98 168.77 16.29 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 124.375 2.036 . . . . 1.0 114.689 -172.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.5 m -141.99 141.07 32.86 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 130.156 3.382 . . . . 1.0 107.736 -177.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.3 tt -104.98 121.72 44.33 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.928 0.891 . . . . 1.0 109.787 -175.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 CA--C 1.537 0.468 0 C-N-CA 126.395 1.878 . . . . 1.0 110.917 -174.431 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 120.414 0.15 . . . . 1.0 111.34 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 28.1 mmt-85 -68.57 57.19 0.08 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 126.458 1.903 . . . . 1.0 113.001 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.2 mttt -54.39 131.08 41.48 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 128.915 2.886 . . . . 1.0 111.041 177.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.3 t -73.58 134.17 30.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 113.607 -1.633 . . . . 1.0 111.59 172.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -107.97 121.91 45.75 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.703 -1.592 . . . . 1.0 106.703 167.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.09 143.98 29.35 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 104.055 -2.572 . . . . 1.0 104.055 167.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -127.06 141.71 51.71 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.925 -1.139 . . . . 1.0 107.925 173.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.84 141.59 49.47 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.794 1.238 . . . . 1.0 109.149 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -108.32 110.14 61.75 Favored Pre-proline 0 CA--C 1.548 0.899 0 N-CA-C 112.658 0.614 . . . . 1.0 112.658 -173.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -52.69 -27.52 33.96 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.417 3.411 . . . . 1.0 116.04 174.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -88.57 -19.86 25.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.85 1.26 . . . . 1.0 114.286 -174.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.8 p -127.57 -19.93 4.08 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.726 1.009 . . . . 1.0 113.726 -173.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.95 8.22 77.6 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.062 0.839 . . . . 1.0 114.151 -172.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -80.62 157.0 26.12 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 119.055 1.428 . . . . 1.0 110.892 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.49 155.11 33.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 C-N-CA 126.746 2.018 . . . . 1.0 109.332 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.26 168.83 10.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 127.463 2.305 . . . . 1.0 109.601 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -146.65 122.63 10.71 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 127.885 2.474 . . . . 1.0 109.407 171.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.01 155.27 42.69 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.949 0.9 . . . . 1.0 110.085 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -95.64 8.75 42.52 Favored 'General case' 0 N--CA 1.48 1.075 0 O-C-N 120.94 -1.1 . . . . 1.0 111.884 174.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.07 -164.76 20.52 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 127.15 2.31 . . . . 1.0 113.112 -171.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.59 168.87 21.32 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 117.018 1.567 . . . . 1.0 117.018 170.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -57.22 101.73 0.07 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.403 2.281 . . . . 1.0 108.763 169.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -130.25 128.48 41.71 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.13 1.372 . . . . 1.0 109.783 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 31.2 tttt -46.41 -65.92 0.48 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.958 1.836 . . . . 1.0 115.958 -168.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.0 m -59.49 -41.76 90.6 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 119.175 0.898 . . . . 1.0 112.204 -177.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.3 tp -59.92 -38.83 83.45 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.109 0.964 . . . . 1.0 111.574 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -68.86 -32.07 71.48 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.7 0.8 . . . . 1.0 112.973 174.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -68.46 -43.16 77.6 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.623 1.101 . . . . 1.0 110.907 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -62.78 -36.18 82.26 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.509 0.559 . . . . 1.0 112.509 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -65.09 -36.28 83.81 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.404 -0.81 . . . . 1.0 112.413 171.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.78 -48.62 68.47 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.597 0.713 . . . . 1.0 110.914 176.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -69.78 -37.43 76.35 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.561 1.544 . . . . 1.0 113.407 -171.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 11.7 m-90 -134.12 -55.82 0.86 Allowed 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.66 0.985 . . . . 1.0 113.66 -175.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 149.78 156.71 7.36 Favored Glycine 0 CA--C 1.537 1.43 0 CA-C-N 119.062 0.846 . . . . 1.0 114.932 172.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.57 -30.98 71.1 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.054 2.503 . . . . 1.0 114.158 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -62.54 -46.2 89.47 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.037 0.922 . . . . 1.0 111.181 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.38 -52.95 63.43 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 125.051 1.34 . . . . 1.0 109.972 176.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.7 t -58.01 -47.49 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 125.848 1.659 . . . . 1.0 111.669 -175.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.77 -37.64 88.3 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.675 0.79 . . . . 1.0 112.274 173.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.3 m -66.05 -29.72 70.12 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.009 0.523 . . . . 1.0 112.288 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 13.3 m0 -78.97 -6.19 55.67 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.085 1.143 . . . . 1.0 114.085 173.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.49 169.12 16.09 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 124.133 1.921 . . . . 1.0 114.624 -173.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 83.1 m -144.6 138.51 27.48 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 129.606 3.162 . . . . 1.0 108.156 -176.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -96.95 126.22 41.94 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.369 1.067 . . . . 1.0 109.81 -177.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.4 mt -125.21 122.28 36.57 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.947 1.699 . . . . 1.0 110.926 -177.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -64.99 -30.32 77.7 Favored Glycine 0 CA--C 1.537 1.456 0 CA-C-N 115.114 -0.948 . . . . 1.0 114.283 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 . . . . . 0 C--O 1.256 1.434 0 C-N-CA 127.616 2.367 . . . . 1.0 113.735 -179.878 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.898 0 O4'-C4'-C3' 109.328 3.728 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.153 0 O4'-C4'-C3' 108.669 3.069 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.267 0 O4'-C4'-C3' 109.475 3.875 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.602 0 O5'-C5'-C4' 114.137 2.812 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.314 0 O4'-C4'-C3' 108.755 3.155 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.971 0 O4'-C4'-C3' 109.143 3.543 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.629 0 O4'-C1'-N19 110.822 3.778 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 0 O5'-C5'-C4' 114.465 3.047 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.972 1 O4'-C4'-C3' 109.735 4.135 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.734 0 P-O3'-C3' 123.444 3.12 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.811 0 O4'-C4'-C3' 109.183 3.583 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.347 0 O4'-C1'-N19 110.145 2.931 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.956 0 O4'-C4'-C3' 108.654 3.054 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.209 0 O5'-C5'-C4' 114.793 3.281 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.402 1 O4'-C1'-N19 111.157 4.197 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.789 0 P-O3'-C3' 123.416 3.096 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.298 0 O4'-C1'-N19 110.155 2.944 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.887 0 O5'-C5'-C4' 113.932 2.666 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.698 0 P-O3'-C3' 123.649 3.291 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.716 1 C5'-C4'-C3' 106.554 -5.43 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.483 0 O4'-C4'-C3' 108.035 2.435 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.416 1 O4'-C1'-N19 111.445 4.556 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.815 0 O4'-C4'-C3' 109.011 3.411 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.371 1 O4'-C1'-N19 111.246 4.308 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 111.265 0.098 . . . . 1.0 111.265 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 47.0 mmt-85 -65.32 62.25 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 126.783 2.033 . . . . 1.0 112.942 173.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -54.95 133.75 48.39 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 128.636 2.775 . . . . 1.0 110.91 177.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 95.1 t -75.12 135.83 26.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 113.445 -1.707 . . . . 1.0 111.019 171.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.1 mttp -111.09 124.39 52.09 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.681 -1.6 . . . . 1.0 106.681 167.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.04 145.86 28.26 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 104.599 -2.371 . . . . 1.0 104.599 167.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -128.96 141.47 51.25 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.73 -1.211 . . . . 1.0 107.73 173.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -132.82 139.63 47.59 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.897 1.279 . . . . 1.0 109.157 178.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -106.7 109.7 63.27 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.002 0.521 . . . . 1.0 112.275 -174.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -52.5 -27.97 34.3 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.325 3.35 . . . . 1.0 115.808 175.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -86.29 -17.27 35.06 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.218 1.192 . . . . 1.0 114.218 -174.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.3 p -129.85 -22.45 2.92 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.046 1.128 . . . . 1.0 114.046 -174.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.4 7.73 82.97 Favored Glycine 0 CA--C 1.538 1.527 0 C-N-CA 124.308 0.956 . . . . 1.0 114.274 -172.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.08 156.82 29.8 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.071 1.436 . . . . 1.0 110.698 173.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.94 155.01 32.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 126.912 2.085 . . . . 1.0 109.55 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.38 168.38 10.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 C-N-CA 127.621 2.369 . . . . 1.0 109.299 177.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -147.51 121.46 9.38 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 127.715 2.406 . . . . 1.0 109.139 173.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.94 151.45 37.03 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.833 0.853 . . . . 1.0 109.977 -178.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -90.32 7.71 37.08 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 120.952 -1.093 . . . . 1.0 112.443 174.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.63 -165.34 21.53 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 126.66 2.076 . . . . 1.0 113.414 -172.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.39 170.29 27.48 Favored Glycine 0 CA--C 1.537 1.414 0 N-CA-C 117.071 1.588 . . . . 1.0 117.071 169.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -57.96 102.56 0.1 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.382 2.273 . . . . 1.0 108.667 169.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -130.3 132.99 46.14 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.121 1.368 . . . . 1.0 109.747 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.5 tttt -50.39 -66.34 0.41 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.677 1.732 . . . . 1.0 115.677 -168.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 40.8 m -60.46 -41.66 94.61 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 119.301 0.955 . . . . 1.0 112.032 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 46.0 tp -58.49 -38.26 77.27 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.154 0.981 . . . . 1.0 111.62 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -69.05 -36.06 77.26 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.971 0.908 . . . . 1.0 112.358 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -66.45 -42.03 88.24 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.463 1.029 . . . . 1.0 110.444 178.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -61.92 -37.95 86.58 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.454 0.539 . . . . 1.0 112.454 177.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -65.52 -34.8 79.1 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.489 -0.757 . . . . 1.0 112.175 172.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.63 -49.04 62.35 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.537 0.684 . . . . 1.0 111.317 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -74.79 -33.74 62.29 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.909 1.683 . . . . 1.0 114.58 -169.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.1 m-90 -133.41 -47.99 0.83 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.7 1.0 . . . . 1.0 113.7 -176.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.54 154.17 6.18 Favored Glycine 0 N--CA 1.478 1.436 0 N-CA-C 115.047 0.779 . . . . 1.0 115.047 169.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -61.17 -35.06 87.76 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.111 2.541 . . . . 1.0 114.051 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.4 -45.62 93.56 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.722 0.773 . . . . 1.0 111.449 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.81 -54.92 40.66 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.138 -1.392 . . . . 1.0 109.831 175.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 32.5 t -57.7 -48.34 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.62 1.568 . . . . 1.0 112.06 -174.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -66.42 -35.25 79.84 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.11 0.564 . . . . 1.0 111.906 175.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.9 m -67.81 -30.19 69.54 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.67 -0.644 . . . . 1.0 112.608 178.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.2 m0 -74.2 -10.16 59.33 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.776 1.028 . . . . 1.0 113.776 173.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.73 168.47 16.53 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 124.048 1.88 . . . . 1.0 114.707 -172.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 87.2 m -144.0 138.7 28.59 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 129.6 3.16 . . . . 1.0 107.895 -175.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -99.03 127.03 44.87 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.373 1.069 . . . . 1.0 109.657 -176.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.4 mt -125.18 117.53 24.07 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.039 1.736 . . . . 1.0 111.34 -175.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -83.63 -12.67 77.4 Favored Glycine 0 CA--C 1.537 1.459 0 CA-C-N 114.918 -1.037 . . . . 1.0 115.257 -176.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 77.7 t60 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 126.152 1.781 . . . . 1.0 111.082 179.154 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.852 0 O4'-C4'-C3' 109.105 3.505 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.741 0 O5'-C5'-C4' 114.436 3.026 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.377 0 O4'-C4'-C3' 109.304 3.704 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.336 0 O4'-C4'-C3' 108.493 2.893 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.068 0 O4'-C4'-C3' 108.655 3.055 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.888 0 O4'-C4'-C3' 108.973 3.373 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.476 1 O4'-C1'-N19 111.121 4.151 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.115 0 O5'-C5'-C4' 114.494 3.067 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.936 1 O4'-C4'-C3' 109.817 4.217 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.372 0 O4'-C4'-C3' 108.658 3.058 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.576 0 O4'-C4'-C3' 109.064 3.464 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.576 0 O4'-C1'-N19 110.501 3.376 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.751 0 O4'-C4'-C3' 108.497 2.897 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.172 0 O5'-C5'-C4' 114.858 3.327 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.188 0 O4'-C1'-N19 110.925 3.906 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.825 0 P-O3'-C3' 123.293 2.994 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.143 0 O4'-C4'-C3' 108.56 2.96 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.913 0 O5'-C5'-C4' 113.977 2.698 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.568 -2.544 0 P-O3'-C3' 123.836 3.447 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.356 1 C5'-C4'-C3' 107.981 -4.479 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.463 0 O5'-C5'-C4' 113.101 2.072 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.205 1 O4'-C1'-N19 111.542 4.677 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.694 0 O4'-C4'-C3' 109.166 3.566 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.292 1 O4'-C1'-N19 111.491 4.614 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 111.173 0.064 . . . . 1.0 111.173 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.0 mmt85 -66.47 61.36 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 126.448 1.899 . . . . 1.0 113.661 176.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -54.83 130.1 39.75 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 128.855 2.862 . . . . 1.0 110.549 177.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 83.1 t -71.69 133.2 32.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 113.683 -1.599 . . . . 1.0 111.01 173.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -106.56 120.94 43.26 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.442 -1.688 . . . . 1.0 106.442 167.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.16 144.06 29.24 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 103.899 -2.63 . . . . 1.0 103.899 167.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -127.24 139.4 52.95 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.791 -1.188 . . . . 1.0 107.791 175.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -131.78 139.49 48.94 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.678 1.191 . . . . 1.0 109.256 176.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -105.79 110.52 64.23 Favored Pre-proline 0 CA--C 1.545 0.761 0 N-CA-C 112.337 0.495 . . . . 1.0 112.337 -174.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -52.81 -27.79 35.94 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 124.441 3.427 . . . . 1.0 115.728 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -87.35 -17.22 32.89 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.777 1.231 . . . . 1.0 114.185 -174.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.1 p -130.2 -21.83 2.89 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.247 1.203 . . . . 1.0 114.247 -174.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.1 8.74 79.43 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.434 1.016 . . . . 1.0 114.295 -172.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -78.42 156.48 29.4 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.072 1.436 . . . . 1.0 110.727 172.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.5 t -136.41 154.99 33.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 126.907 2.083 . . . . 1.0 109.733 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.86 168.77 8.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 127.795 2.438 . . . . 1.0 109.558 177.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -147.26 121.49 9.55 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.762 2.425 . . . . 1.0 109.273 173.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.83 153.55 39.32 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.579 0.752 . . . . 1.0 109.913 -179.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -95.52 6.24 49.48 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.515 1.126 . . . . 1.0 111.927 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 131.38 -166.41 22.88 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 127.229 2.347 . . . . 1.0 113.515 -173.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.04 170.79 27.33 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-O 123.627 1.682 . . . . 1.0 117.301 169.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -57.58 100.45 0.05 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 127.938 2.495 . . . . 1.0 109.202 169.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -130.64 133.17 45.91 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.685 1.594 . . . . 1.0 110.139 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -50.55 -67.27 0.27 Allowed 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 115.875 1.805 . . . . 1.0 115.875 -168.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 37.4 m -59.7 -41.01 89.8 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 119.254 0.933 . . . . 1.0 112.056 -175.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 47.6 tp -58.57 -39.07 79.28 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.46 1.104 . . . . 1.0 111.694 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -68.09 -36.02 79.12 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.813 0.845 . . . . 1.0 112.292 175.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.94 -41.86 86.27 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.308 0.958 . . . . 1.0 110.752 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -63.02 -36.06 82.31 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.69 0.626 . . . . 1.0 112.69 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.2 -36.37 83.99 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.428 -0.795 . . . . 1.0 112.396 171.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.87 -48.08 67.08 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.303 0.573 . . . . 1.0 111.085 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -76.54 -33.61 58.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.633 1.573 . . . . 1.0 114.254 -169.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.0 m-90 -134.11 -46.92 0.78 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.108 1.151 . . . . 1.0 114.108 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.39 154.2 6.29 Favored Glycine 0 N--CA 1.479 1.561 0 CA-C-N 119.292 0.951 . . . . 1.0 115.318 169.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -62.88 -31.91 77.37 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.218 2.612 . . . . 1.0 113.93 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -63.1 -46.63 86.43 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.906 0.882 . . . . 1.0 111.016 176.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.99 -53.67 55.78 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 125.174 1.39 . . . . 1.0 109.89 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 24.9 t -56.85 -47.82 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 126.059 1.744 . . . . 1.0 111.771 -176.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -67.99 -34.57 76.78 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.419 0.526 . . . . 1.0 112.419 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.8 m -67.09 -31.76 72.46 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.829 0.677 . . . . 1.0 112.829 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -74.63 -11.38 60.18 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.21 1.189 . . . . 1.0 114.21 174.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.43 168.99 14.96 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 124.245 1.974 . . . . 1.0 115.131 -170.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.7 m -142.24 142.73 32.64 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 130.157 3.383 . . . . 1.0 107.636 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.2 tt -108.11 122.59 47.21 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.82 0.848 . . . . 1.0 109.409 -174.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt -120.47 125.96 49.19 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.489 1.916 . . . . 1.0 110.814 -172.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -91.37 -9.26 63.45 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 124.393 0.997 . . . . 1.0 115.2 -173.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.186 0 C-N-CA 125.728 1.611 . . . . 1.0 112.025 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.912 0 O4'-C4'-C3' 109.079 3.479 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.085 0 O5'-C5'-C4' 114.437 3.026 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.238 0 O4'-C4'-C3' 109.17 3.57 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.297 0 O4'-C4'-C3' 108.639 3.039 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.355 0 O4'-C4'-C3' 108.447 2.847 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.421 0 O5'-C5'-C4' 114.651 3.179 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.622 2.922 0 P-O3'-C3' 124.056 3.63 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.055 0 O5'-C5'-C4' 114.858 3.327 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.022 1 O4'-C4'-C3' 109.804 4.204 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.661 0 O4'-C1'-N19 110.248 3.06 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.766 0 O4'-C4'-C3' 108.818 3.218 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.145 0 O4'-C1'-N19 110.166 2.957 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.791 0 O4'-C4'-C3' 108.541 2.941 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.822 0 O5'-C5'-C4' 115.142 3.53 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.145 1 O4'-C1'-N19 111.105 4.131 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.711 0 P-O3'-C3' 123.519 3.182 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.303 0 O4'-C1'-N19 110.239 3.049 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.926 0 O5'-C5'-C4' 114.035 2.739 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.617 0 P-O3'-C3' 123.865 3.471 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.333 1 C5'-C4'-C3' 106.882 -5.212 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.043 0 O4'-C4'-C3' 108.29 2.69 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.437 1 O4'-C1'-N19 111.188 4.235 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.542 0 O4'-C4'-C3' 109.319 3.719 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.058 1 O4'-C1'-N19 111.226 4.282 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 111.231 0.085 . . . . 1.0 111.231 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -67.41 58.81 0.05 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 126.654 1.982 . . . . 1.0 113.077 175.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.9 mttt -54.43 132.46 44.44 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 128.814 2.846 . . . . 1.0 111.48 177.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.0 t -75.14 134.77 28.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 113.403 -1.726 . . . . 1.0 111.574 173.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -109.61 123.13 48.92 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 106.96 -1.496 . . . . 1.0 106.96 167.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.13 143.9 29.38 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 104.287 -2.486 . . . . 1.0 104.287 168.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -123.55 136.01 54.31 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.257 -1.386 . . . . 1.0 107.257 173.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -135.3 97.4 3.7 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.246 1.018 . . . . 1.0 109.886 -169.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -72.09 119.52 75.02 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.465 1.106 . . . . 1.0 112.864 -169.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.1 -20.0 22.2 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 123.678 2.918 . . . . 1.0 114.239 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -83.91 -22.07 31.69 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.575 1.15 . . . . 1.0 113.793 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 62.6 p -127.42 -22.89 3.59 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.156 1.169 . . . . 1.0 114.156 -172.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.8 4.88 77.88 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-O 118.932 -0.927 . . . . 1.0 114.144 -171.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -74.13 155.45 38.41 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.46 1.63 . . . . 1.0 110.607 171.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 5.1 t -137.74 153.04 27.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 113.358 -1.746 . . . . 1.0 109.262 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.06 169.21 12.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 126.924 2.09 . . . . 1.0 109.122 177.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -147.44 121.52 9.46 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 127.537 2.335 . . . . 1.0 109.14 173.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.93 154.14 41.6 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.911 0.884 . . . . 1.0 109.756 -179.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -95.41 8.79 42.16 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.109 -0.995 . . . . 1.0 112.002 174.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.38 -165.42 21.3 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 127.126 2.298 . . . . 1.0 113.335 -172.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.78 169.6 23.82 Favored Glycine 0 CA--C 1.537 1.453 0 N-CA-C 117.445 1.738 . . . . 1.0 117.445 169.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -57.76 101.25 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.559 2.344 . . . . 1.0 109.056 169.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -130.37 131.03 45.12 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.634 1.573 . . . . 1.0 109.839 178.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -49.39 -66.85 0.33 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.577 1.695 . . . . 1.0 115.577 -168.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.0 m -60.36 -40.39 90.57 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 119.36 0.982 . . . . 1.0 112.207 -175.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.7 tp -58.86 -38.47 78.86 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.334 1.053 . . . . 1.0 111.801 176.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.01 -36.51 80.09 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.476 0.711 . . . . 1.0 112.528 174.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.82 -41.98 86.61 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.296 0.953 . . . . 1.0 110.786 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -61.94 -38.41 88.38 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.532 0.568 . . . . 1.0 112.532 177.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -64.84 -34.77 79.16 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.529 -0.732 . . . . 1.0 112.177 172.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.61 -49.07 62.11 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.623 0.725 . . . . 1.0 110.945 176.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -73.22 -35.68 66.34 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.082 1.753 . . . . 1.0 114.425 -169.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.1 m-90 -132.81 -47.5 0.87 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.695 0.998 . . . . 1.0 113.695 -175.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.3 155.21 6.57 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.995 0.816 . . . . 1.0 114.676 169.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -61.77 -34.25 83.38 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.073 2.515 . . . . 1.0 113.788 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -61.12 -45.5 94.44 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 122.07 0.938 . . . . 1.0 111.339 177.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.47 -54.92 41.03 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 114.125 -1.398 . . . . 1.0 109.975 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.3 t -58.08 -46.32 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 125.448 1.499 . . . . 1.0 112.246 -174.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.0 -34.81 78.55 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.876 -0.515 . . . . 1.0 112.295 175.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.5 t -66.03 -32.38 73.82 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.622 -0.674 . . . . 1.0 112.339 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 27.9 m0 -73.37 -5.52 40.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.904 1.282 . . . . 1.0 113.663 173.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -75.16 168.48 19.9 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 124.151 1.929 . . . . 1.0 114.706 -175.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 84.0 m -147.86 139.72 24.01 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 130.134 3.373 . . . . 1.0 107.674 -176.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 30.3 tp -99.24 127.07 45.18 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.315 1.046 . . . . 1.0 109.786 -177.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.5 mt -124.37 122.01 36.51 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.175 1.79 . . . . 1.0 110.993 -176.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -77.54 -15.83 80.95 Favored Glycine 0 CA--C 1.539 1.551 0 CA-C-N 115.019 -0.991 . . . . 1.0 115.391 -174.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 41.5 m80 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 126.222 1.809 . . . . 1.0 111.318 -179.851 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.795 0 O4'-C4'-C3' 109.134 3.534 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.069 0 O5'-C5'-C4' 114.61 3.15 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.562 0 O4'-C4'-C3' 109.216 3.616 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.519 0 O4'-C4'-C3' 108.542 2.942 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.131 0 O4'-C4'-C3' 108.622 3.022 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.128 0 O4'-C4'-C3' 108.958 3.358 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.789 0 O4'-C1'-N19 110.99 3.988 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.185 0 O5'-C5'-C4' 114.471 3.051 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.233 1 O4'-C4'-C3' 109.846 4.246 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.592 0 O4'-C1'-N19 110.327 3.159 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.73 0 O4'-C4'-C3' 109.062 3.462 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.282 0 O4'-C1'-N19 110.025 2.781 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.927 0 O4'-C1'-N19 110.3 3.125 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.237 0 O5'-C5'-C4' 114.98 3.415 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.314 0 O4'-C1'-N19 110.837 3.796 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.858 0 P-O3'-C3' 123.393 3.077 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.25 0 O4'-C1'-N19 110.323 3.154 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.065 0 O5'-C5'-C4' 113.774 2.553 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.713 0 P-O3'-C3' 124.042 3.618 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.15 1 C5'-C4'-C3' 107.138 -5.041 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.584 0 O4'-C4'-C3' 107.721 2.121 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.462 1 O4'-C1'-N19 111.395 4.494 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.796 0 O4'-C4'-C3' 109.283 3.683 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.049 1 O4'-C1'-N19 111.215 4.269 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 120.807 0.337 . . . . 1.0 111.652 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.4 mmt-85 -60.0 63.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 127.936 2.494 . . . . 1.0 113.083 170.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.6 mtpt -51.48 135.86 26.96 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 128.956 2.903 . . . . 1.0 112.038 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.4 t -75.69 135.53 26.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 112.936 -1.938 . . . . 1.0 110.642 169.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -111.03 123.47 50.25 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.521 -1.659 . . . . 1.0 106.521 167.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -83.47 145.08 29.15 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 104.209 -2.515 . . . . 1.0 104.209 168.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -127.61 140.27 52.21 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 107.668 -1.234 . . . . 1.0 107.668 172.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -131.7 131.1 42.8 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.42 1.088 . . . . 1.0 109.736 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -96.81 110.1 51.83 Favored Pre-proline 0 CA--C 1.543 0.696 0 C-N-CA 123.043 0.537 . . . . 1.0 111.784 -173.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -65.48 -15.56 50.18 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.583 2.855 . . . . 1.0 114.312 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -88.88 -17.48 29.54 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 114.444 1.276 . . . . 1.0 114.444 178.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 38.5 p -129.72 -22.77 2.93 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 114.481 1.289 . . . . 1.0 114.481 -175.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.51 7.2 87.11 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 124.359 0.98 . . . . 1.0 114.36 -172.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.18 156.08 30.04 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.211 1.505 . . . . 1.0 110.785 173.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.12 153.66 32.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 C-N-CA 126.695 1.998 . . . . 1.0 109.635 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.68 167.74 12.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 127.626 2.371 . . . . 1.0 109.193 177.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -146.8 121.57 9.89 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.752 2.421 . . . . 1.0 109.279 173.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.84 152.01 38.02 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.683 0.793 . . . . 1.0 109.904 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -92.1 7.93 40.17 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 121.069 -1.019 . . . . 1.0 112.116 174.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 130.36 -166.01 22.43 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 126.702 2.096 . . . . 1.0 113.432 -173.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.99 170.34 26.27 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 117.196 1.638 . . . . 1.0 117.196 169.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -57.71 100.42 0.05 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.698 2.399 . . . . 1.0 109.015 169.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -130.52 128.04 40.35 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.559 1.544 . . . . 1.0 109.764 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -44.25 -68.29 0.21 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.386 1.624 . . . . 1.0 115.386 -168.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.8 m -59.83 -41.68 91.87 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 119.185 0.902 . . . . 1.0 112.17 -174.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.5 tp -59.27 -38.89 81.23 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.146 0.979 . . . . 1.0 111.545 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.0 mmmt -69.75 -32.46 71.0 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 118.527 -0.749 . . . . 1.0 112.965 175.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -69.12 -42.44 76.04 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.514 1.052 . . . . 1.0 110.922 176.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -61.49 -37.35 83.35 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.685 0.624 . . . . 1.0 112.685 178.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -66.09 -34.45 78.08 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.548 -0.72 . . . . 1.0 112.38 172.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.53 -48.73 63.56 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.824 0.821 . . . . 1.0 111.236 175.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -74.54 -34.15 62.9 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.941 1.697 . . . . 1.0 114.567 -169.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 17.1 m-90 -132.75 -48.06 0.88 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 113.78 1.03 . . . . 1.0 113.78 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.57 153.75 6.07 Favored Glycine 0 N--CA 1.476 1.333 0 CA-C-N 118.908 0.776 . . . . 1.0 114.648 169.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.61 -34.68 84.03 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.061 2.507 . . . . 1.0 113.806 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.24 -45.3 95.09 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.986 0.898 . . . . 1.0 111.124 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.18 -55.98 27.21 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.263 -1.335 . . . . 1.0 109.72 175.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 38.9 t -57.87 -46.55 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 125.466 1.506 . . . . 1.0 112.111 -174.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -67.27 -35.69 80.04 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.86 -0.525 . . . . 1.0 112.048 176.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.3 t -65.63 -34.04 77.3 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.72 -0.613 . . . . 1.0 112.217 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 25.6 m0 -70.72 -11.53 61.0 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.027 1.121 . . . . 1.0 114.027 174.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.95 168.32 17.22 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 124.141 1.924 . . . . 1.0 114.76 -171.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 88.5 m -143.58 136.55 27.62 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 129.314 3.045 . . . . 1.0 108.243 -176.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 38.6 tp -96.03 126.54 41.34 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.254 1.022 . . . . 1.0 110.115 -176.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.9 mt -126.07 117.28 22.86 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.654 1.582 . . . . 1.0 110.812 -175.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -82.76 -11.76 81.09 Favored Glycine 0 CA--C 1.539 1.556 0 CA-C-N 115.074 -0.966 . . . . 1.0 115.084 -175.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 11.7 p-80 . . . . . 0 C--O 1.253 1.269 0 C-N-CA 126.347 1.859 . . . . 1.0 112.093 176.81 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.686 0 O4'-C4'-C3' 109.135 3.535 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.965 0 O5'-C5'-C4' 114.353 2.966 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.194 0 O4'-C4'-C3' 109.257 3.657 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.703 0 O4'-C4'-C3' 108.486 2.886 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.144 0 O4'-C4'-C3' 108.738 3.138 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.215 0 O4'-C4'-C3' 109.026 3.426 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.509 1 O4'-C1'-N19 111.802 5.002 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.17 0 O5'-C5'-C4' 114.705 3.218 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.935 1 O4'-C4'-C3' 109.632 4.032 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.364 0 O4'-C1'-N19 110.448 3.311 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.568 0 O4'-C4'-C3' 108.897 3.297 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.25 0 O4'-C1'-N19 110.202 3.002 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 0 O4'-C1'-N19 110.523 3.404 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.963 0 O5'-C5'-C4' 114.946 3.39 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.341 0 O4'-C1'-N19 110.833 3.791 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.97 0 P-O3'-C3' 123.366 3.055 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.623 2.984 0 O4'-C4'-C3' 108.628 3.028 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.999 0 O5'-C5'-C4' 113.926 2.661 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.564 -2.926 0 P-O3'-C3' 124.185 3.737 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.345 2 O4'-C1'-N19 111.449 4.561 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.502 0 O4'-C4'-C3' 107.807 2.207 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.395 1 O4'-C1'-N19 111.769 4.961 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.761 0 O4'-C4'-C3' 109.282 3.682 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.142 1 O4'-C1'-N19 111.46 4.575 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 119.845 -0.121 . . . . 1.0 110.81 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.0 mmp_? -63.45 59.25 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 127.432 2.293 . . . . 1.0 114.465 175.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -55.02 131.04 43.98 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 128.8 2.84 . . . . 1.0 110.395 174.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 85.0 t -74.26 133.86 30.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 113.437 -1.71 . . . . 1.0 111.315 173.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.4 mttp -107.77 122.17 46.2 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 106.505 -1.665 . . . . 1.0 106.505 167.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.04 145.17 28.63 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 104.32 -2.474 . . . . 1.0 104.32 168.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -128.06 142.84 51.1 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.158 -1.052 . . . . 1.0 108.158 172.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -132.68 141.08 48.43 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.046 1.338 . . . . 1.0 109.576 177.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -108.13 109.12 61.82 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 123.119 0.567 . . . . 1.0 112.496 -173.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -53.28 -26.8 35.81 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.36 3.374 . . . . 1.0 115.603 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -87.91 -19.6 27.1 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.475 1.11 . . . . 1.0 113.731 -174.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 45.9 p -129.97 -19.45 3.24 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.563 1.319 . . . . 1.0 114.563 -171.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.12 11.69 75.17 Favored Glycine 0 CA--C 1.539 1.57 0 C-N-CA 124.002 0.81 . . . . 1.0 114.215 -173.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -75.89 150.74 37.51 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.429 1.492 . . . . 1.0 109.405 171.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -133.08 155.09 40.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 C-N-CA 126.506 1.923 . . . . 1.0 108.936 172.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.7 167.9 12.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 127.537 2.335 . . . . 1.0 109.267 177.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -146.96 121.14 9.5 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 127.653 2.381 . . . . 1.0 108.92 173.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.0 154.54 42.65 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.825 0.85 . . . . 1.0 109.937 -178.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -95.67 9.83 38.97 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 121.118 -0.989 . . . . 1.0 111.856 174.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 126.1 -166.38 18.89 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 127.086 2.279 . . . . 1.0 113.396 -172.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.05 170.12 29.35 Favored Glycine 0 CA--C 1.535 1.311 0 N-CA-C 117.481 1.752 . . . . 1.0 117.481 169.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -57.49 100.02 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 128.119 2.568 . . . . 1.0 109.147 169.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.3 t60 -130.4 136.9 49.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.344 1.458 . . . . 1.0 110.69 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -49.99 -70.92 0.07 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 125.525 1.53 . . . . 1.0 114.809 -169.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.0 m -60.5 -40.68 92.26 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 118.918 0.781 . . . . 1.0 111.87 -173.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.96 -39.34 77.88 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.282 1.033 . . . . 1.0 111.725 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.82 -36.05 77.73 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.493 0.717 . . . . 1.0 112.407 175.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -67.27 -42.37 83.97 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.248 0.931 . . . . 1.0 110.977 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -61.37 -38.6 87.59 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.821 0.675 . . . . 1.0 112.821 176.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -64.74 -34.9 79.42 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.694 -0.628 . . . . 1.0 112.148 173.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.27 -48.74 64.21 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.645 0.736 . . . . 1.0 110.978 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.58 -34.63 60.66 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.658 1.583 . . . . 1.0 114.79 -169.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.7 m-90 -132.01 -48.15 0.94 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.832 1.049 . . . . 1.0 113.832 -176.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.96 153.94 6.17 Favored Glycine 0 N--CA 1.479 1.557 0 CA-C-N 118.908 0.776 . . . . 1.0 114.856 169.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -61.51 -34.5 85.47 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.945 2.43 . . . . 1.0 113.959 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -60.96 -45.94 92.73 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 122.032 0.92 . . . . 1.0 111.248 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.91 -54.74 42.65 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.296 -1.32 . . . . 1.0 109.922 176.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.4 t -57.87 -47.34 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 125.594 1.557 . . . . 1.0 112.074 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -66.92 -35.59 80.33 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.273 0.629 . . . . 1.0 112.163 175.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.5 m -66.47 -30.07 70.33 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 118.537 0.608 . . . . 1.0 112.514 178.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 19.2 m0 -75.6 -8.89 57.92 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.057 1.132 . . . . 1.0 114.057 173.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.1 168.81 16.34 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 124.118 1.913 . . . . 1.0 114.939 -172.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 91.4 m -144.54 142.92 30.56 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 130.177 3.391 . . . . 1.0 108.161 -176.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.96 123.6 48.41 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.025 0.93 . . . . 1.0 109.703 -176.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.8 mt -121.66 129.02 52.5 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.744 2.018 . . . . 1.0 110.77 -173.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -75.71 -18.92 79.48 Favored Glycine 0 CA--C 1.538 1.527 0 CA-C-N 115.222 -0.899 . . . . 1.0 115.283 -173.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.103 0 C-N-CA 125.904 1.682 . . . . 1.0 112.291 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.746 0 O4'-C4'-C3' 109.009 3.409 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.197 0 O5'-C5'-C4' 114.643 3.174 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.561 0 O4'-C4'-C3' 109.44 3.84 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.543 0 O4'-C4'-C3' 108.811 3.211 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.361 0 O4'-C4'-C3' 108.796 3.196 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.236 0 O5'-C5'-C4' 114.838 3.313 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.658 0 P-O3'-C3' 124.095 3.662 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.196 0 O5'-C5'-C4' 114.815 3.296 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.116 0 O4'-C4'-C3' 109.425 3.825 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.407 0 O4'-C4'-C3' 108.786 3.186 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.541 0 O4'-C4'-C3' 109.086 3.486 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.216 0 O4'-C1'-N19 110.468 3.335 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.823 0 O4'-C4'-C3' 108.656 3.056 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.191 0 O5'-C5'-C4' 115.138 3.527 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.094 0 O4'-C1'-N19 110.918 3.898 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.836 0 P-O3'-C3' 123.251 2.959 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.22 0 O4'-C4'-C3' 108.51 2.91 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.035 0 O5'-C5'-C4' 114.144 2.817 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.669 0 P-O3'-C3' 123.991 3.576 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.277 2 C5'-C4'-C3' 107.819 -4.587 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.311 0 O4'-C4'-C3' 107.904 2.304 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.749 1 O4'-C1'-N19 111.435 4.543 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.663 0 O4'-C4'-C3' 109.271 3.671 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.225 1 O4'-C1'-N19 111.24 4.299 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 120.336 0.112 . . . . 1.0 111.03 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 44.8 mmt-85 -67.47 61.51 0.06 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 126.392 1.877 . . . . 1.0 112.806 174.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -55.21 132.72 48.33 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 128.739 2.816 . . . . 1.0 111.207 178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 84.3 t -74.02 134.12 30.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 113.411 -1.722 . . . . 1.0 111.78 173.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -108.0 123.13 48.19 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 106.379 -1.711 . . . . 1.0 106.379 167.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.4 145.24 28.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 104.38 -2.452 . . . . 1.0 104.38 168.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -127.5 141.83 51.55 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.027 -1.101 . . . . 1.0 108.027 172.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -133.04 139.1 47.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.629 1.172 . . . . 1.0 109.27 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.8 t-20 -106.08 110.51 64.07 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 112.372 0.508 . . . . 1.0 112.372 -173.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -52.96 -28.27 39.04 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 124.469 3.446 . . . . 1.0 115.793 175.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -86.34 -17.88 33.35 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.32 1.23 . . . . 1.0 114.32 -174.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.1 p -129.27 -22.8 3.06 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 114.0 1.111 . . . . 1.0 114.0 -173.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.37 8.31 83.56 Favored Glycine 0 CA--C 1.538 1.531 0 C-N-CA 124.265 0.936 . . . . 1.0 114.175 -172.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -79.18 157.12 27.93 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 123.137 1.446 . . . . 1.0 110.683 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.1 t -136.65 154.6 32.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 C-N-CA 127.149 2.18 . . . . 1.0 109.496 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.14 167.72 11.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 127.335 2.254 . . . . 1.0 109.301 177.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -146.99 120.58 9.12 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 127.674 2.389 . . . . 1.0 109.206 174.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.58 153.07 39.93 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.707 0.803 . . . . 1.0 109.93 -179.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -95.36 7.33 46.53 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.332 1.053 . . . . 1.0 111.609 176.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 130.82 -166.76 22.46 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 127.006 2.241 . . . . 1.0 113.444 -172.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.41 170.2 23.4 Favored Glycine 0 CA--C 1.536 1.398 0 N-CA-C 117.505 1.762 . . . . 1.0 117.505 170.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -57.6 100.91 0.06 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.728 2.411 . . . . 1.0 108.984 169.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -130.51 131.79 45.28 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.378 1.471 . . . . 1.0 109.875 177.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -48.72 -67.68 0.25 Allowed 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.767 1.766 . . . . 1.0 115.767 -168.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 36.9 m -59.72 -41.29 90.53 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-N 119.194 0.907 . . . . 1.0 112.084 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.9 tp -58.45 -39.12 79.0 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.939 0.896 . . . . 1.0 111.736 177.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -68.34 -35.81 78.32 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.35 0.66 . . . . 1.0 112.293 175.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -67.15 -42.02 85.05 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.366 0.984 . . . . 1.0 110.779 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -62.52 -37.82 87.53 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.606 0.595 . . . . 1.0 112.606 177.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -65.44 -34.3 77.96 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.701 -0.624 . . . . 1.0 112.528 172.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.14 -48.99 60.92 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.505 0.669 . . . . 1.0 111.17 176.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -74.53 -34.69 63.06 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.087 1.755 . . . . 1.0 114.587 -169.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.0 m-90 -132.89 -46.11 0.86 Allowed 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.847 1.054 . . . . 1.0 113.847 -176.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.46 153.9 6.33 Favored Glycine 0 N--CA 1.479 1.505 0 CA-C-N 118.94 0.791 . . . . 1.0 115.024 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -61.75 -33.35 85.71 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.947 2.431 . . . . 1.0 113.949 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -61.18 -45.98 92.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.836 0.826 . . . . 1.0 111.316 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.87 -54.94 40.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.107 1.363 . . . . 1.0 109.967 175.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.9 t -57.98 -47.91 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 125.577 1.551 . . . . 1.0 111.889 -174.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -67.09 -34.89 78.62 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.918 -0.489 . . . . 1.0 112.098 176.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.2 m -67.39 -30.3 70.04 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.667 -0.645 . . . . 1.0 112.572 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.3 m0 -74.41 -10.77 59.9 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.04 1.126 . . . . 1.0 114.04 173.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.65 168.39 17.79 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 124.213 1.959 . . . . 1.0 114.809 -171.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 93.4 m -144.21 142.44 30.51 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 130.083 3.353 . . . . 1.0 107.91 -175.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -107.24 124.13 49.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.925 0.89 . . . . 1.0 109.624 -176.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.6 mt -120.97 127.98 52.3 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.524 1.93 . . . . 1.0 110.962 -173.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -81.73 -14.88 76.91 Favored Glycine 0 CA--C 1.536 1.358 0 N-CA-C 115.377 0.911 . . . . 1.0 115.377 -174.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.217 0 C-N-CA 125.979 1.711 . . . . 1.0 112.075 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.027 0 O4'-C4'-C3' 109.119 3.519 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.015 0 O5'-C5'-C4' 114.308 2.934 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.338 0 O4'-C4'-C3' 109.322 3.722 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.486 0 O4'-C4'-C3' 108.447 2.847 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.261 0 O4'-C4'-C3' 108.928 3.328 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.947 0 O5'-C5'-C4' 114.838 3.313 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.676 0 O4'-C1'-N19 110.615 3.519 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.942 0 O5'-C5'-C4' 115.192 3.565 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.993 1 O4'-C4'-C3' 109.822 4.222 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.708 0 O4'-C1'-N19 110.308 3.135 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.312 0 O4'-C4'-C3' 109.026 3.426 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.019 0 O4'-C1'-N19 109.897 2.621 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.866 0 O4'-C4'-C3' 108.518 2.918 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.997 0 O5'-C5'-C4' 114.917 3.369 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.06 0 O4'-C1'-N19 110.932 3.914 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.921 0 P-O3'-C3' 123.4 3.083 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.179 0 O4'-C1'-N19 110.248 3.061 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.737 0 O5'-C5'-C4' 114.136 2.812 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.753 0 P-O3'-C3' 123.891 3.493 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.226 1 C5'-C4'-C3' 107.417 -4.855 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.664 0 O4'-C4'-C3' 107.665 2.065 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.373 1 O4'-C1'-N19 111.543 4.679 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.452 0 O4'-C4'-C3' 109.192 3.592 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.222 1 O4'-C1'-N19 111.176 4.22 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.386 0.136 . . . . 1.0 111.253 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.5 mmt-85 -69.03 56.25 0.09 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 126.667 1.987 . . . . 1.0 113.168 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -56.05 128.92 37.72 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 128.594 2.757 . . . . 1.0 110.715 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 91.2 t -71.98 135.21 28.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 113.618 -1.628 . . . . 1.0 110.801 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -109.31 121.72 45.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 106.691 -1.596 . . . . 1.0 106.691 167.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.01 144.11 29.33 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 103.887 -2.634 . . . . 1.0 103.887 167.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -127.38 140.03 52.45 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.87 -1.159 . . . . 1.0 107.87 174.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -131.75 134.78 46.23 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.738 1.215 . . . . 1.0 109.616 178.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -99.82 110.41 59.03 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 123.209 0.604 . . . . 1.0 111.651 -173.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -66.37 -14.83 45.85 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.181 2.588 . . . . 1.0 114.3 -179.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -89.17 -20.77 23.8 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.599 1.16 . . . . 1.0 114.084 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.6 p -129.99 -20.98 3.05 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.24 1.57 . . . . 1.0 115.24 -171.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.33 10.71 82.14 Favored Glycine 0 CA--C 1.541 1.696 0 C-N-CA 123.857 0.742 . . . . 1.0 114.302 -173.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -74.06 148.76 41.61 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.181 1.392 . . . . 1.0 109.273 170.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.8 t -132.19 154.74 40.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 C-N-CA 126.362 1.865 . . . . 1.0 108.974 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.43 168.08 10.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 127.53 2.332 . . . . 1.0 109.417 177.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -147.21 120.26 8.81 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.808 2.443 . . . . 1.0 109.174 173.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.98 157.79 43.87 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.16 0.984 . . . . 1.0 109.98 -178.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -99.07 11.59 38.57 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 120.792 -1.192 . . . . 1.0 111.855 176.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 123.71 -167.01 16.03 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 127.165 2.317 . . . . 1.0 112.971 -171.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.23 169.5 32.03 Favored Glycine 0 CA--C 1.536 1.393 0 N-CA-C 117.329 1.692 . . . . 1.0 117.329 169.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -57.7 99.3 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 128.057 2.543 . . . . 1.0 109.14 169.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -130.55 132.87 45.8 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.345 1.458 . . . . 1.0 110.583 178.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.7 tppt? -44.83 -71.24 0.08 Allowed 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 125.747 1.619 . . . . 1.0 114.995 -169.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.8 m -61.45 -40.06 93.11 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 118.532 0.605 . . . . 1.0 111.947 -173.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.7 tp -58.25 -40.4 81.68 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.259 1.024 . . . . 1.0 111.488 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -69.65 -32.2 70.72 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.681 0.792 . . . . 1.0 112.982 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.95 -42.59 76.45 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.619 1.1 . . . . 1.0 111.225 176.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.0 m0 -61.14 -36.69 80.44 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.627 0.603 . . . . 1.0 112.627 177.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -65.11 -36.47 84.39 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.424 -0.798 . . . . 1.0 112.611 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.24 -48.01 71.91 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.472 0.653 . . . . 1.0 110.989 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -76.27 -34.05 59.13 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.304 1.442 . . . . 1.0 114.64 -169.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.6 m-90 -134.02 -48.26 0.79 Allowed 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.942 1.089 . . . . 1.0 113.942 -176.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.7 153.73 6.06 Favored Glycine 0 N--CA 1.48 1.627 0 CA-C-N 119.34 0.973 . . . . 1.0 115.265 169.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.57 -33.34 78.42 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 123.212 2.608 . . . . 1.0 114.214 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -62.85 -46.79 86.25 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 122.168 0.985 . . . . 1.0 111.042 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.78 -53.66 55.91 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.313 1.445 . . . . 1.0 109.935 176.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 28.1 t -57.29 -47.79 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 125.774 1.629 . . . . 1.0 111.778 -175.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.89 -36.0 82.2 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.3 0.64 . . . . 1.0 112.562 174.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.2 m -66.84 -30.75 71.02 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.585 0.587 . . . . 1.0 112.585 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 16.2 m0 -75.83 -8.78 57.7 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.947 1.091 . . . . 1.0 113.947 173.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.7 168.9 16.78 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 124.032 1.872 . . . . 1.0 114.831 -172.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 94.9 m -142.53 141.74 32.12 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 130.521 3.529 . . . . 1.0 107.632 -176.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.08 123.32 47.83 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.779 0.832 . . . . 1.0 109.64 -175.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.4 mt -121.44 129.13 52.8 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.525 1.93 . . . . 1.0 110.927 -173.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -76.88 -17.45 79.82 Favored Glycine 0 CA--C 1.538 1.508 0 CA-C-N 115.219 -0.901 . . . . 1.0 115.277 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.251 1.142 0 C-N-CA 126.306 1.842 . . . . 1.0 111.004 179.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.006 0 O4'-C4'-C3' 109.239 3.639 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.205 0 O5'-C5'-C4' 114.478 3.055 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.366 0 O4'-C4'-C3' 109.217 3.617 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.737 0 O5'-C5'-C4' 114.072 2.766 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.243 0 O4'-C4'-C3' 108.777 3.177 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.005 0 O4'-C4'-C3' 109.158 3.558 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.619 2.601 0 O4'-C1'-N19 110.524 3.404 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.204 0 O5'-C5'-C4' 114.596 3.14 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.049 0 O4'-C4'-C3' 109.467 3.867 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.337 0 O4'-C4'-C3' 108.914 3.314 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.821 0 O4'-C4'-C3' 109.179 3.579 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.371 0 O4'-C1'-N19 110.192 2.99 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.793 0 O5'-C5'-C4' 114.125 2.804 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.013 0 O5'-C5'-C4' 114.957 3.398 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.435 0 O4'-C1'-N19 110.784 3.731 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.726 0 P-O3'-C3' 123.291 2.992 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.2 0 O4'-C1'-N19 110.072 2.84 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.986 0 O5'-C5'-C4' 113.71 2.507 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.565 -2.826 0 P-O3'-C3' 123.872 3.476 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.183 2 C5'-C4'-C3' 106.68 -5.346 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.494 0 O4'-C4'-C3' 107.87 2.27 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.513 1 O4'-C1'-N19 111.292 4.365 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.62 0 O4'-C4'-C3' 109.347 3.747 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.24 1 O4'-C1'-N19 111.172 4.215 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.462 0 CA-C-O 120.491 0.186 . . . . 1.0 111.337 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 29.9 mmt-85 -69.46 58.27 0.12 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 126.483 1.913 . . . . 1.0 112.637 175.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -55.89 130.96 45.74 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 128.634 2.774 . . . . 1.0 110.995 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.5 t -73.62 134.1 30.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 113.584 -1.643 . . . . 1.0 110.95 172.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 40.2 mttt -108.45 122.32 46.78 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 106.777 -1.564 . . . . 1.0 106.777 167.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.53 144.1 28.9 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 103.932 -2.618 . . . . 1.0 103.932 167.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -127.46 138.58 52.99 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 107.84 -1.17 . . . . 1.0 107.84 173.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -131.73 125.97 33.33 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.61 1.164 . . . . 1.0 109.847 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -92.41 110.79 47.11 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 123.163 0.585 . . . . 1.0 111.767 -172.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -65.87 -14.56 45.16 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.371 2.714 . . . . 1.0 114.659 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -88.94 -18.08 28.21 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.169 1.174 . . . . 1.0 114.169 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.2 p -129.51 -22.9 2.97 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.382 1.252 . . . . 1.0 114.382 -174.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 76.86 7.55 86.32 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 124.361 0.982 . . . . 1.0 114.486 -172.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -78.05 156.33 30.12 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 119.243 1.521 . . . . 1.0 110.877 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 20.9 t -136.44 153.66 31.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 C-N-CA 126.691 1.997 . . . . 1.0 109.814 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.58 168.07 12.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 127.658 2.383 . . . . 1.0 109.405 177.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -146.74 120.89 9.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.736 2.414 . . . . 1.0 109.136 173.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.92 155.89 43.16 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.898 0.879 . . . . 1.0 109.897 -178.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -97.81 10.15 40.85 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.113 -0.992 . . . . 1.0 111.693 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 126.12 -165.31 19.36 Favored Glycine 0 CA--C 1.532 1.143 0 C-N-CA 127.227 2.346 . . . . 1.0 113.085 -171.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.07 168.44 26.14 Favored Glycine 0 CA--C 1.535 1.32 0 N-CA-C 117.157 1.623 . . . . 1.0 117.157 169.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -57.59 100.49 0.05 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 127.421 2.288 . . . . 1.0 109.035 169.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -130.38 126.34 36.83 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.692 1.597 . . . . 1.0 109.534 178.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -44.84 -66.6 0.37 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 115.774 1.768 . . . . 1.0 115.774 -168.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.8 m -60.46 -40.98 93.17 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.403 1.001 . . . . 1.0 112.132 -175.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.6 tp -59.5 -39.07 82.61 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.053 0.941 . . . . 1.0 111.545 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -68.56 -32.56 72.57 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.628 0.771 . . . . 1.0 113.036 175.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -68.87 -42.64 76.74 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.426 1.012 . . . . 1.0 110.909 176.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.8 m0 -62.06 -36.01 80.35 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.426 0.528 . . . . 1.0 112.426 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.9 -36.11 82.48 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.5 -0.75 . . . . 1.0 112.464 172.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.07 -48.89 66.87 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.859 0.837 . . . . 1.0 111.004 176.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.2 -33.02 61.37 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.706 1.602 . . . . 1.0 114.546 -169.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -134.5 -48.43 0.77 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.832 1.049 . . . . 1.0 113.832 -176.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.62 153.91 6.11 Favored Glycine 0 N--CA 1.479 1.529 0 CA-C-N 119.35 0.977 . . . . 1.0 115.148 169.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.49 -32.87 80.18 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 123.043 2.496 . . . . 1.0 114.187 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -62.64 -46.61 87.41 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.0 0.905 . . . . 1.0 111.027 176.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.85 -53.81 54.19 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.202 1.401 . . . . 1.0 109.648 176.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.8 t -57.53 -47.09 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 C-N-CA 125.872 1.669 . . . . 1.0 111.788 -175.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.81 -37.99 89.48 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.362 0.665 . . . . 1.0 112.373 173.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 56.7 m -66.51 -29.88 70.08 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.051 0.54 . . . . 1.0 112.435 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 26.8 m0 -74.83 -10.3 59.37 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.184 1.179 . . . . 1.0 114.184 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.83 168.73 17.26 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 124.09 1.9 . . . . 1.0 115.075 -171.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 63.7 m -144.18 139.59 28.84 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 129.857 3.263 . . . . 1.0 108.369 -176.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.6 tp -97.86 126.44 43.24 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.4 1.08 . . . . 1.0 109.763 -177.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.6 mt -124.49 120.25 31.46 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.776 1.631 . . . . 1.0 111.12 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -88.4 -8.57 70.88 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.426 1.012 . . . . 1.0 115.457 -175.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.255 1.375 0 C-N-CA 126.038 1.735 . . . . 1.0 112.204 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.925 0 O4'-C4'-C3' 109.115 3.515 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.866 0 O4'-C1'-N19 110.307 3.134 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C4'-C3' 109.16 3.56 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.598 0 O4'-C4'-C3' 108.396 2.796 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.044 0 O4'-C4'-C3' 108.562 2.962 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.916 0 O4'-C4'-C3' 108.905 3.305 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.772 0 O4'-C1'-N19 110.747 3.683 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.397 0 O5'-C5'-C4' 114.401 3.001 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.978 1 O4'-C4'-C3' 109.721 4.121 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.617 0 O4'-C1'-N19 110.399 3.248 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.663 0 O4'-C4'-C3' 109.027 3.427 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C1'-N19 110.168 2.96 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.948 0 O4'-C4'-C3' 108.74 3.14 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.958 0 O5'-C5'-C4' 114.957 3.398 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.073 0 O4'-C1'-N19 110.841 3.802 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.843 0 P-O3'-C3' 123.302 3.002 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.308 0 O4'-C1'-N19 110.235 3.044 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.991 0 O5'-C5'-C4' 113.908 2.649 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.563 -3.02 0 P-O3'-C3' 123.772 3.394 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.087 1 C5'-C4'-C3' 106.657 -5.362 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.777 0 O5'-C5'-C4' 113.309 2.221 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.42 1 O4'-C1'-N19 111.514 4.643 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.658 0 O4'-C4'-C3' 109.15 3.55 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.542 1 O4'-C1'-N19 111.295 4.369 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.613 0.244 . . . . 1.0 111.631 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 50.8 mmt-85 -69.68 61.24 0.16 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 126.124 1.769 . . . . 1.0 112.915 175.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.8 mttt -58.12 131.67 51.21 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 128.413 2.685 . . . . 1.0 110.577 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.3 t -70.66 134.53 29.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 113.572 -1.649 . . . . 1.0 110.996 171.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.4 mttt -107.99 120.1 41.34 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 106.833 -1.543 . . . . 1.0 106.833 167.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.91 143.69 31.48 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 103.21 -2.885 . . . . 1.0 103.21 167.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -127.2 142.5 51.47 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.841 -1.17 . . . . 1.0 107.841 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.68 142.32 49.79 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.869 1.268 . . . . 1.0 109.546 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -109.26 109.6 60.45 Favored Pre-proline 0 CA--C 1.548 0.892 0 N-CA-C 112.846 0.684 . . . . 1.0 112.846 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_exo -53.13 -27.58 37.7 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 124.345 3.363 . . . . 1.0 115.743 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -89.35 -21.62 23.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.774 1.229 . . . . 1.0 114.087 -173.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.5 p -127.04 -17.97 4.72 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 114.286 1.217 . . . . 1.0 114.286 -171.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.71 11.16 72.89 Favored Glycine 0 CA--C 1.541 1.699 0 C-N-CA 123.843 0.735 . . . . 1.0 114.218 -174.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -78.18 150.92 33.45 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.716 1.606 . . . . 1.0 109.696 174.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 t -132.97 154.7 40.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 126.614 1.966 . . . . 1.0 108.913 172.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.28 168.35 10.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 127.372 2.269 . . . . 1.0 109.575 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -146.95 119.77 8.66 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 127.669 2.388 . . . . 1.0 109.605 172.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.97 149.87 34.03 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.894 0.878 . . . . 1.0 109.748 -178.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -92.41 9.9 32.26 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 120.851 -1.155 . . . . 1.0 111.907 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.89 -166.1 20.66 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 127.105 2.288 . . . . 1.0 113.363 -170.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.51 168.2 27.21 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 125.466 1.508 . . . . 1.0 116.818 170.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -56.95 102.57 0.09 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 127.234 2.214 . . . . 1.0 109.077 169.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -130.8 135.13 47.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.031 1.332 . . . . 1.0 111.061 177.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -49.46 -69.17 0.12 Allowed 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 126.2 1.8 . . . . 1.0 114.811 -169.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 38.2 m -62.09 -39.51 92.72 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.35 -0.844 . . . . 1.0 111.942 -175.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.4 tp -58.6 -39.42 80.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.464 1.106 . . . . 1.0 111.557 176.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -67.52 -36.23 80.62 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.656 0.783 . . . . 1.0 112.273 175.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -67.32 -42.03 84.31 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.106 0.866 . . . . 1.0 111.313 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 34.9 m0 -61.78 -37.23 83.56 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.69 0.626 . . . . 1.0 112.69 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -64.85 -36.0 82.95 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 121.343 -0.848 . . . . 1.0 112.139 172.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.07 -49.01 66.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.667 0.746 . . . . 1.0 110.816 176.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -69.82 -37.37 76.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.531 1.533 . . . . 1.0 113.726 -170.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 11.6 m-90 -133.84 -54.55 0.87 Allowed 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.62 0.97 . . . . 1.0 113.62 -175.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 147.75 157.24 7.37 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-N 118.974 0.806 . . . . 1.0 114.934 172.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.78 -30.29 68.69 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.954 2.436 . . . . 1.0 113.842 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -62.43 -46.86 86.63 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.083 0.953 . . . . 1.0 111.086 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.84 -52.68 64.68 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.048 1.339 . . . . 1.0 109.979 176.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 38.0 t -57.42 -47.88 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 C-N-CA 125.843 1.657 . . . . 1.0 111.842 -176.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.63 -37.84 88.95 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.838 0.855 . . . . 1.0 112.587 173.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.5 m -65.31 -29.06 69.78 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.771 -0.581 . . . . 1.0 112.535 -178.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -80.74 -5.71 57.47 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.374 1.249 . . . . 1.0 114.374 174.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.27 168.65 16.86 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 124.026 1.87 . . . . 1.0 115.1 -172.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 67.7 m -142.12 135.64 29.27 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 130.083 3.353 . . . . 1.0 108.696 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 26.6 tp -87.86 126.87 35.27 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.641 1.176 . . . . 1.0 110.163 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.7 mt -131.56 145.1 51.55 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.936 2.095 . . . . 1.0 110.361 176.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -56.52 157.21 10.77 Favored Glycine 0 CA--C 1.545 1.909 0 CA-C-N 115.117 -0.947 . . . . 1.0 114.226 171.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 . . . . . 0 C--O 1.255 1.343 0 C-N-CA 125.212 1.405 . . . . 1.0 112.971 179.745 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.075 0 O4'-C4'-C3' 109.222 3.622 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.03 0 O5'-C5'-C4' 114.445 3.032 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.434 0 O4'-C4'-C3' 109.334 3.734 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.307 0 O4'-C4'-C3' 108.523 2.923 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.142 0 O4'-C4'-C3' 108.713 3.113 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.071 0 O5'-C5'-C4' 114.93 3.379 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.585 0 P-O3'-C3' 123.66 3.3 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.19 0 O5'-C5'-C4' 114.614 3.153 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.801 0 O4'-C4'-C3' 109.485 3.885 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.621 0 O4'-C4'-C3' 108.946 3.346 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.652 0 O4'-C4'-C3' 108.998 3.398 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.17 0 O4'-C1'-N19 110.236 3.045 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.704 0 O5'-C5'-C4' 114.291 2.922 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.373 0 O5'-C5'-C4' 114.834 3.31 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.179 0 O4'-C1'-N19 110.919 3.899 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.745 0 O5'-C5'-C4' 114.388 2.991 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.125 0 O4'-C1'-N19 110.074 2.843 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.97 0 O5'-C5'-C4' 113.832 2.594 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.657 0 P-O3'-C3' 123.877 3.481 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.01 1 C5'-C4'-C3' 106.675 -5.35 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.646 0 O5'-C5'-C4' 113.368 2.263 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.418 1 O4'-C1'-N19 111.552 4.69 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.559 0 O4'-C4'-C3' 109.204 3.604 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.148 1 O4'-C1'-N19 111.031 4.039 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.282 0.087 . . . . 1.0 111.15 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.9 mmt-85 -67.56 59.16 0.06 Allowed 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 126.611 1.964 . . . . 1.0 112.996 175.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.4 mttt -54.91 132.75 47.32 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 128.869 2.867 . . . . 1.0 111.074 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.1 t -74.77 134.73 28.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 113.464 -1.698 . . . . 1.0 111.692 174.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.5 mttp -108.68 122.51 47.27 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 106.598 -1.63 . . . . 1.0 106.598 167.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.19 145.68 28.23 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 104.607 -2.368 . . . . 1.0 104.607 168.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -128.03 142.12 51.32 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.907 -1.146 . . . . 1.0 107.907 172.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -133.83 138.03 45.41 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.989 1.316 . . . . 1.0 109.137 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -105.51 110.31 64.14 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 112.348 0.499 . . . . 1.0 112.348 -173.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -53.29 -27.76 39.99 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 124.405 3.404 . . . . 1.0 115.694 176.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -86.58 -17.47 33.89 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.771 1.228 . . . . 1.0 114.216 -174.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.5 p -129.45 -22.32 3.06 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.267 1.21 . . . . 1.0 114.267 -174.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.95 8.13 82.32 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.369 0.985 . . . . 1.0 114.169 -172.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.15 156.67 29.76 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 119.141 1.47 . . . . 1.0 110.745 173.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -136.62 154.97 33.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 126.799 2.04 . . . . 1.0 109.194 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.71 168.02 10.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 127.513 2.325 . . . . 1.0 109.28 178.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -147.49 121.83 9.64 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 127.735 2.414 . . . . 1.0 109.148 174.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.31 153.6 41.44 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.731 0.812 . . . . 1.0 109.663 -179.081 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -94.51 8.13 43.22 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.964 -1.085 . . . . 1.0 111.807 174.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.51 -166.66 20.97 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 126.919 2.2 . . . . 1.0 113.4 -172.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.47 169.82 26.83 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-O 123.603 1.668 . . . . 1.0 116.886 169.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -57.69 102.97 0.11 Allowed 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 127.644 2.378 . . . . 1.0 108.818 169.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.4 t60 -130.51 131.87 45.32 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 1.0 109.767 178.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.4 tttt -49.75 -66.02 0.46 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 115.903 1.816 . . . . 1.0 115.903 -168.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 41.2 m -60.49 -41.23 93.84 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 119.488 1.04 . . . . 1.0 111.891 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.1 tp -59.05 -38.52 79.57 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.103 0.961 . . . . 1.0 111.482 177.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.31 -36.11 78.83 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.681 0.792 . . . . 1.0 112.399 175.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -66.8 -42.14 86.43 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.331 0.969 . . . . 1.0 110.75 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -61.71 -38.45 87.9 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.695 0.628 . . . . 1.0 112.695 177.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -65.34 -34.28 77.95 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.53 -0.732 . . . . 1.0 112.38 172.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.02 58.87 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.567 0.699 . . . . 1.0 111.24 176.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -74.58 -34.09 62.81 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.906 1.682 . . . . 1.0 114.669 -169.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -132.89 -47.16 0.86 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.588 0.958 . . . . 1.0 113.588 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.34 154.21 6.3 Favored Glycine 0 N--CA 1.477 1.368 0 CA-C-N 118.952 0.796 . . . . 1.0 115.084 169.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.65 -33.89 85.38 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.088 2.526 . . . . 1.0 113.864 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -61.23 -45.98 92.32 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 122.038 0.923 . . . . 1.0 111.286 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.66 -54.84 41.75 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 114.211 -1.358 . . . . 1.0 109.827 175.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 36.4 t -58.07 -47.37 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 125.462 1.505 . . . . 1.0 112.043 -174.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.32 -35.76 80.08 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.778 -0.576 . . . . 1.0 111.979 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.2 t -65.4 -33.62 76.38 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.476 0.58 . . . . 1.0 112.195 178.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 28.1 m0 -71.55 -11.84 61.06 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.093 1.146 . . . . 1.0 114.093 174.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.15 168.52 17.02 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 124.041 1.877 . . . . 1.0 114.98 -171.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 91.2 m -144.29 143.45 31.01 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 130.213 3.405 . . . . 1.0 107.958 -175.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -108.41 124.25 50.1 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.899 0.88 . . . . 1.0 109.587 -176.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.6 mt -121.89 128.83 52.03 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.817 2.047 . . . . 1.0 110.819 -172.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -91.61 -13.09 58.71 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.377 0.989 . . . . 1.0 115.548 -173.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 . . . . . 0 C--O 1.255 1.366 0 C-N-CA 125.806 1.642 . . . . 1.0 110.992 -179.893 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.845 0 O4'-C4'-C3' 109.075 3.475 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.025 0 O4'-C4'-C3' 108.532 2.932 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.453 0 O4'-C4'-C3' 109.364 3.764 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.694 0 O4'-C4'-C3' 108.377 2.777 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.261 0 O4'-C4'-C3' 108.631 3.031 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.084 0 O4'-C4'-C3' 109.185 3.585 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.879 0 O4'-C1'-N19 110.936 3.92 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.128 0 O5'-C5'-C4' 114.421 3.015 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.938 1 O4'-C4'-C3' 109.689 4.089 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.412 0 O4'-C4'-C3' 108.815 3.215 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.86 0 O4'-C4'-C3' 109.035 3.435 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.17 0 O4'-C1'-N19 110.297 3.121 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.829 0 O5'-C5'-C4' 114.16 2.829 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.057 0 O5'-C5'-C4' 114.999 3.428 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.196 1 O4'-C1'-N19 111.241 4.301 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.123 0 P-O3'-C3' 123.346 3.038 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.193 0 O4'-C1'-N19 110.222 3.027 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.947 0 C2'-C3'-O3' 117.399 2.518 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.567 -2.642 0 P-O3'-C3' 123.993 3.577 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.292 1 C5'-C4'-C3' 107.588 -4.741 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.555 0 O4'-C4'-C3' 107.894 2.294 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.445 1 O4'-C1'-N19 111.475 4.594 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.808 0 O4'-C4'-C3' 109.244 3.644 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.204 1 O4'-C1'-N19 111.347 4.434 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.425 0.155 . . . . 1.0 111.349 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.2 mmt-85 -69.65 56.22 0.12 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 126.602 1.961 . . . . 1.0 113.049 176.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -55.07 130.87 43.5 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 129.056 2.943 . . . . 1.0 111.123 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 74.2 t -73.39 132.84 32.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 113.729 -1.578 . . . . 1.0 111.973 173.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.9 mttt -106.43 121.92 45.24 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.753 -1.573 . . . . 1.0 106.753 167.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -83.83 144.66 29.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 103.714 -2.698 . . . . 1.0 103.714 167.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -126.78 142.84 51.43 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.918 -1.141 . . . . 1.0 107.918 172.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -132.72 138.51 47.26 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.934 1.294 . . . . 1.0 109.088 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -105.02 110.66 64.8 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 112.317 0.488 . . . . 1.0 112.317 -174.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -53.05 -27.53 36.74 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.33 3.353 . . . . 1.0 115.998 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -87.41 -17.16 32.91 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.83 1.252 . . . . 1.0 114.086 -174.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 42.6 p -129.78 -22.46 2.94 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.362 1.245 . . . . 1.0 114.362 -174.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.76 7.24 83.36 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 124.369 0.985 . . . . 1.0 114.251 -172.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -77.79 156.79 30.29 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 123.14 1.448 . . . . 1.0 110.738 173.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -137.37 155.12 31.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 126.795 2.038 . . . . 1.0 109.461 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.25 169.64 9.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 127.266 2.226 . . . . 1.0 109.79 177.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -146.15 123.17 11.4 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 128.017 2.527 . . . . 1.0 109.641 170.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.06 155.42 43.34 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.897 0.879 . . . . 1.0 109.735 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.4 mttp -95.2 8.67 42.34 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.121 0.968 . . . . 1.0 111.872 173.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 125.94 -165.82 18.96 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 126.907 2.194 . . . . 1.0 113.232 -170.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.6 168.75 25.14 Favored Glycine 0 CA--C 1.535 1.3 0 N-CA-C 117.021 1.568 . . . . 1.0 117.021 170.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -57.68 102.05 0.09 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.322 2.249 . . . . 1.0 108.796 169.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -130.42 127.78 39.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.349 1.46 . . . . 1.0 109.6 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.1 tttt -45.39 -66.69 0.36 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 116.036 1.865 . . . . 1.0 116.036 -168.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.8 m -60.12 -41.25 92.24 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.23 0.923 . . . . 1.0 112.28 -177.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.5 tp -59.95 -38.7 83.19 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.897 0.879 . . . . 1.0 111.576 178.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -68.74 -32.78 72.79 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.679 0.792 . . . . 1.0 112.707 174.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -68.33 -42.9 78.66 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.563 1.074 . . . . 1.0 110.947 176.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.0 m0 -61.61 -36.37 80.52 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.555 0.576 . . . . 1.0 112.555 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.82 -36.05 82.39 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.45 -0.781 . . . . 1.0 112.432 172.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.2 -48.68 67.17 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.701 0.763 . . . . 1.0 111.024 176.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -75.38 -33.56 61.03 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.782 1.633 . . . . 1.0 114.336 -169.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.3 m-90 -134.46 -48.16 0.77 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.987 1.106 . . . . 1.0 113.987 -175.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.82 153.22 5.93 Favored Glycine 0 N--CA 1.479 1.518 0 CA-C-N 119.142 0.883 . . . . 1.0 115.225 169.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.3 -32.51 81.8 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.093 2.529 . . . . 1.0 114.356 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -62.43 -46.63 87.66 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 122.136 0.97 . . . . 1.0 111.03 176.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.39 -53.22 60.63 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 114.15 -1.386 . . . . 1.0 110.179 176.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 34.4 t -57.71 -47.49 85.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 C-N-CA 125.644 1.578 . . . . 1.0 111.88 -175.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.6 -38.08 89.77 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.451 0.7 . . . . 1.0 112.322 173.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.4 m -66.35 -29.66 69.89 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.414 0.524 . . . . 1.0 112.414 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -76.52 -8.85 58.03 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.953 1.094 . . . . 1.0 113.953 173.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -72.42 168.8 17.71 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 124.032 1.872 . . . . 1.0 114.866 -171.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 95.8 m -144.21 136.29 26.35 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 129.63 3.172 . . . . 1.0 108.444 -175.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 27.6 tp -92.76 128.16 38.53 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 124.663 1.185 . . . . 1.0 109.657 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.6 mt -127.91 131.42 49.39 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.866 1.666 . . . . 1.0 111.246 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -78.81 12.75 21.52 Favored Glycine 0 CA--C 1.541 1.67 0 C-N-CA 125.316 1.436 . . . . 1.0 114.85 175.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 55.6 m170 . . . . . 0 C--O 1.254 1.317 0 C-N-CA 125.321 1.448 . . . . 1.0 113.293 176.197 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.919 0 O4'-C4'-C3' 109.123 3.523 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.996 0 O5'-C5'-C4' 114.504 3.074 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.227 0 O4'-C4'-C3' 109.27 3.67 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.519 0 O4'-C4'-C3' 108.398 2.798 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.137 0 O4'-C4'-C3' 108.697 3.097 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.623 2.984 0 O4'-C4'-C3' 109.0 3.4 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.703 0 O4'-C1'-N19 110.979 3.974 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.247 0 O5'-C5'-C4' 114.409 3.006 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.196 1 O4'-C4'-C3' 109.859 4.259 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.438 0 O4'-C1'-N19 110.364 3.205 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.762 0 O4'-C4'-C3' 108.998 3.398 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.282 0 O4'-C1'-N19 110.079 2.849 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.747 0 O5'-C5'-C4' 114.489 3.063 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.201 0 O5'-C5'-C4' 115.012 3.437 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.336 0 O4'-C1'-N19 110.825 3.781 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.76 0 P-O3'-C3' 123.473 3.145 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.439 0 O4'-C4'-C3' 108.57 2.97 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.766 0 O5'-C5'-C4' 113.984 2.703 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.566 -2.743 0 P-O3'-C3' 123.821 3.434 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.944 1 C5'-C4'-C3' 106.824 -5.251 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.571 0 O4'-C4'-C3' 108.004 2.404 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.501 1 O4'-C1'-N19 111.589 4.737 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.488 0 O4'-C4'-C3' 109.156 3.556 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.114 1 O4'-C1'-N19 111.154 4.192 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 120.348 0.118 . . . . 1.0 111.202 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.2 mmt-85 -68.84 56.51 0.09 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.741 2.016 . . . . 1.0 113.048 175.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 66.3 mttt -56.66 129.12 39.71 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 128.404 2.682 . . . . 1.0 110.538 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.6 t -72.57 132.36 33.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 113.488 -1.687 . . . . 1.0 110.763 173.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -106.39 122.22 45.83 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 106.649 -1.612 . . . . 1.0 106.649 167.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.08 144.9 28.75 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 103.706 -2.702 . . . . 1.0 103.706 167.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -128.28 141.03 51.56 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.745 -1.205 . . . . 1.0 107.745 174.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -131.77 140.57 49.25 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.688 1.195 . . . . 1.0 109.318 177.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -106.35 109.64 63.29 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 123.266 0.627 . . . . 1.0 112.283 -174.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -52.79 -27.33 33.91 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 124.129 3.22 . . . . 1.0 115.847 175.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -88.72 -19.12 26.51 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.558 1.143 . . . . 1.0 113.926 -173.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.0 p -129.84 -20.32 3.18 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 114.561 1.319 . . . . 1.0 114.561 -172.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.79 10.68 77.19 Favored Glycine 0 CA--C 1.537 1.456 0 CA-C-N 118.73 0.696 . . . . 1.0 114.145 -173.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -74.14 149.12 41.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.194 1.397 . . . . 1.0 109.426 170.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -133.13 154.23 39.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 C-N-CA 126.776 2.03 . . . . 1.0 109.0 173.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.15 168.65 10.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 127.456 2.303 . . . . 1.0 109.331 178.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -147.62 120.87 8.94 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 127.843 2.457 . . . . 1.0 109.27 173.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.27 155.21 42.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.086 0.954 . . . . 1.0 109.968 -178.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -96.04 10.57 37.06 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 120.88 -1.137 . . . . 1.0 112.023 176.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 124.77 -167.68 17.06 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 127.106 2.288 . . . . 1.0 112.969 -171.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.67 170.14 31.43 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 116.999 1.559 . . . . 1.0 116.999 170.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -57.03 103.15 0.1 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.452 2.301 . . . . 1.0 109.218 169.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -130.47 134.89 47.44 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.344 1.458 . . . . 1.0 110.243 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -52.44 -66.77 0.33 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 115.918 1.822 . . . . 1.0 115.918 -168.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 34.4 m -60.1 -40.93 91.36 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 119.41 1.004 . . . . 1.0 111.963 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.5 tp -57.55 -39.12 75.96 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.269 1.027 . . . . 1.0 111.765 176.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -68.6 -35.78 77.8 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.829 0.851 . . . . 1.0 112.502 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -67.0 -41.31 86.93 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.278 0.945 . . . . 1.0 110.838 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 34.6 m0 -61.71 -37.31 83.69 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.67 0.618 . . . . 1.0 112.67 175.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -65.16 -36.23 83.59 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.444 -0.785 . . . . 1.0 112.107 172.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.92 -48.27 69.17 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.724 0.774 . . . . 1.0 110.971 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -76.43 -34.12 58.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.384 1.474 . . . . 1.0 114.538 -169.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 13.4 m-90 -133.5 -47.84 0.82 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.053 1.131 . . . . 1.0 114.053 -175.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.08 153.47 6.05 Favored Glycine 0 N--CA 1.479 1.543 0 CA-C-N 119.226 0.921 . . . . 1.0 115.354 169.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.15 -33.08 82.88 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.281 2.654 . . . . 1.0 114.359 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -63.35 -46.54 86.11 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.716 0.807 . . . . 1.0 110.875 177.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.9 -53.31 59.87 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.331 1.452 . . . . 1.0 109.812 176.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 29.3 t -57.52 -47.7 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 C-N-CA 125.904 1.682 . . . . 1.0 111.981 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -66.15 -36.17 82.42 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.29 0.636 . . . . 1.0 112.563 173.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 64.4 m -66.63 -30.66 70.99 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.544 0.572 . . . . 1.0 112.544 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -75.89 -8.84 57.86 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.057 1.132 . . . . 1.0 114.057 173.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.52 168.98 16.41 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 124.218 1.961 . . . . 1.0 114.613 -173.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 89.8 m -142.98 139.63 30.71 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 129.851 3.26 . . . . 1.0 108.215 -176.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -97.43 126.75 42.87 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.376 1.071 . . . . 1.0 109.972 -177.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 85.9 mt -125.63 121.33 33.22 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.92 1.688 . . . . 1.0 110.944 -177.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -87.79 -7.98 73.87 Favored Glycine 0 CA--C 1.536 1.367 0 CA-C-N 114.927 -1.033 . . . . 1.0 115.516 -174.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 126.066 1.746 . . . . 1.0 111.477 -178.608 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.881 0 O4'-C4'-C3' 109.235 3.635 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.948 0 O5'-C5'-C4' 114.376 2.983 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.262 0 O4'-C4'-C3' 109.374 3.774 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.586 0 O4'-C4'-C3' 108.33 2.73 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.514 0 O4'-C4'-C3' 108.895 3.295 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.623 3.042 0 O4'-C4'-C3' 109.255 3.655 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.697 0 O4'-C1'-N19 110.764 3.705 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.061 0 O5'-C5'-C4' 114.534 3.096 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.407 1 O4'-C4'-C3' 109.627 4.027 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.8 0 O4'-C4'-C3' 108.708 3.108 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.616 0 O4'-C4'-C3' 108.854 3.254 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.4 0 O4'-C1'-N19 110.042 2.803 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.954 0 O5'-C5'-C4' 114.329 2.949 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.036 0 O5'-C5'-C4' 114.887 3.348 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.445 0 O4'-C1'-N19 110.952 3.939 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.757 0 P-O3'-C3' 123.365 3.054 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.195 0 O4'-C4'-C3' 108.674 3.074 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.852 0 O5'-C5'-C4' 113.864 2.617 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.696 0 P-O3'-C3' 124.012 3.593 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.949 1 C5'-C4'-C3' 106.982 -5.145 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.551 0 O4'-C4'-C3' 107.974 2.374 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.28 1 O4'-C1'-N19 111.386 4.483 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.586 0 O4'-C4'-C3' 109.234 3.634 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.143 1 O4'-C1'-N19 111.249 4.311 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.121 0.01 . . . . 1.0 111.024 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -66.28 60.77 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.458 1.903 . . . . 1.0 113.737 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.0 mttt -55.32 137.2 48.22 Favored 'General case' 0 CA--C 1.523 -0.091 0 C-N-CA 128.854 2.862 . . . . 1.0 110.464 175.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 97.1 t -77.06 135.82 25.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 113.56 -1.654 . . . . 1.0 110.843 171.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -116.32 121.8 43.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.627 -1.249 . . . . 1.0 107.627 167.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.01 147.07 35.0 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 105.239 -2.134 . . . . 1.0 105.239 168.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -129.06 140.03 51.77 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.795 -1.187 . . . . 1.0 107.795 172.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -132.81 129.52 38.63 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.711 1.205 . . . . 1.0 109.659 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -95.03 110.91 52.62 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 123.074 0.55 . . . . 1.0 111.597 -172.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.97 -15.25 48.06 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.324 2.682 . . . . 1.0 114.36 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -89.24 -20.52 24.05 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.281 1.215 . . . . 1.0 114.281 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.1 p -130.03 -21.24 3.01 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 114.894 1.442 . . . . 1.0 114.894 -172.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.19 9.42 84.13 Favored Glycine 0 CA--C 1.54 1.596 0 CA-C-N 118.808 0.731 . . . . 1.0 114.373 -173.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -72.95 148.82 43.92 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.684 1.242 . . . . 1.0 109.524 170.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 t -133.03 153.4 37.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 C-N-CA 126.605 1.962 . . . . 1.0 109.501 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.08 168.7 10.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 127.458 2.303 . . . . 1.0 109.198 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -147.78 121.42 9.2 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 128.205 2.602 . . . . 1.0 108.996 173.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.32 155.66 42.79 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.773 0.829 . . . . 1.0 109.653 -178.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -96.79 6.13 49.27 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.225 1.01 . . . . 1.0 111.789 173.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 132.11 -165.05 23.66 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.855 2.169 . . . . 1.0 113.609 -175.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.84 170.74 26.43 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 123.461 1.589 . . . . 1.0 117.042 169.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -57.82 101.36 0.07 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.466 2.306 . . . . 1.0 109.014 169.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -130.4 126.36 36.86 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.719 1.608 . . . . 1.0 109.592 178.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -44.84 -67.17 0.31 Allowed 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 116.07 1.878 . . . . 1.0 116.07 -169.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.2 m -60.11 -40.98 91.56 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 119.212 0.914 . . . . 1.0 112.214 -175.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 41.1 tp -59.44 -39.04 82.29 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.23 1.012 . . . . 1.0 111.611 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -68.58 -32.62 72.66 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.753 0.821 . . . . 1.0 113.151 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -69.12 -42.68 75.74 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 119.593 1.088 . . . . 1.0 110.777 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -60.57 -36.91 79.64 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.668 0.618 . . . . 1.0 112.668 177.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.28 -36.53 84.39 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 121.475 -0.765 . . . . 1.0 112.526 172.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.35 -48.37 70.44 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.854 0.835 . . . . 1.0 111.087 176.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -76.31 -33.57 59.05 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.342 1.457 . . . . 1.0 114.58 -169.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.3 m-90 -133.47 -48.83 0.83 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.923 1.083 . . . . 1.0 113.923 -176.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 141.19 153.44 5.96 Favored Glycine 0 N--CA 1.477 1.421 0 CA-C-N 119.046 0.839 . . . . 1.0 115.041 169.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -62.6 -32.94 79.23 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.075 2.517 . . . . 1.0 114.378 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -61.94 -46.64 88.42 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.89 0.852 . . . . 1.0 111.15 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.61 -53.96 51.97 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.996 1.318 . . . . 1.0 109.836 176.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 34.4 t -57.74 -46.69 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 125.425 1.49 . . . . 1.0 112.077 -175.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -64.98 -37.66 88.39 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.354 0.662 . . . . 1.0 112.388 173.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 55.6 m -66.46 -30.14 70.42 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.163 0.585 . . . . 1.0 112.365 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -74.95 -10.02 59.08 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.979 1.103 . . . . 1.0 113.979 173.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.14 167.23 19.77 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 124.032 1.872 . . . . 1.0 114.501 -173.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 95.8 m -146.37 133.11 19.98 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 129.305 3.042 . . . . 1.0 108.466 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.8 tt -100.37 124.83 46.35 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.685 0.794 . . . . 1.0 110.016 -171.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.8 mt -121.73 124.32 43.96 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.657 1.983 . . . . 1.0 111.056 -170.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -74.78 -19.21 80.01 Favored Glycine 0 CA--C 1.538 1.522 0 CA-C-N 115.289 -0.869 . . . . 1.0 115.137 -174.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.257 1.471 0 C-N-CA 125.822 1.649 . . . . 1.0 111.962 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.948 0 O4'-C4'-C3' 109.054 3.454 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.8 0 O5'-C5'-C4' 114.583 3.131 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.397 0 O4'-C4'-C3' 109.192 3.592 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.571 0 O4'-C4'-C3' 108.596 2.996 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.87 0 O4'-C4'-C3' 108.528 2.928 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.135 0 O5'-C5'-C4' 114.859 3.328 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.687 0 O4'-C1'-N19 110.837 3.796 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.832 0 O5'-C5'-C4' 114.665 3.189 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.728 1 O4'-C4'-C3' 109.772 4.172 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.704 0 O4'-C1'-N19 110.242 3.052 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.719 0 O4'-C4'-C3' 109.116 3.516 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.421 0 O4'-C1'-N19 110.229 3.036 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.993 0 O4'-C4'-C3' 108.632 3.032 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.177 0 O5'-C5'-C4' 114.816 3.297 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.197 0 O4'-C1'-N19 110.963 3.954 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.024 0 P-O3'-C3' 123.416 3.097 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.045 0 O4'-C1'-N19 110.24 3.05 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.815 0 O5'-C5'-C4' 113.832 2.594 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.563 -2.953 0 P-O3'-C3' 123.631 3.276 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.997 1 C5'-C4'-C3' 107.731 -4.646 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.502 0 O5'-C5'-C4' 114.387 2.991 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.484 1 O4'-C1'-N19 111.247 4.309 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.482 0 O4'-C4'-C3' 109.237 3.637 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.793 1 O4'-C1'-N19 111.364 4.455 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 111.137 0.051 . . . . 1.0 111.137 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 61.2 mmt-85 -65.41 61.58 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 126.658 1.983 . . . . 1.0 113.482 176.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -54.51 132.8 45.53 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 128.45 2.7 . . . . 1.0 111.04 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 74.5 t -70.88 135.22 28.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 113.088 -1.869 . . . . 1.0 111.264 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.3 mttp -107.44 120.62 42.67 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.304 -1.739 . . . . 1.0 106.304 167.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.85 144.66 29.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 104.108 -2.553 . . . . 1.0 104.108 168.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -127.24 140.17 52.41 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.994 -1.113 . . . . 1.0 107.994 173.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -132.08 130.95 41.91 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.7 1.2 . . . . 1.0 109.704 178.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -97.63 110.95 57.31 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 122.777 0.431 . . . . 1.0 111.31 -173.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -66.32 -14.63 45.05 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.45 2.767 . . . . 1.0 114.666 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -88.63 -17.63 29.67 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.726 1.21 . . . . 1.0 114.219 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 40.0 p -129.75 -23.56 2.82 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 114.534 1.309 . . . . 1.0 114.534 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.87 7.48 87.43 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.294 0.949 . . . . 1.0 114.234 -172.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.44 156.44 29.39 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.098 1.449 . . . . 1.0 110.976 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -136.37 154.11 32.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 126.681 1.992 . . . . 1.0 109.632 179.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.88 168.01 11.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 127.672 2.389 . . . . 1.0 109.525 177.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -147.03 120.76 9.21 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.585 2.354 . . . . 1.0 109.481 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.32 151.33 37.33 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.753 0.821 . . . . 1.0 109.685 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -95.17 10.13 37.07 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.1 -1.0 . . . . 1.0 111.826 176.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 129.33 -166.09 21.77 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 126.982 2.229 . . . . 1.0 113.093 -172.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.68 169.16 22.39 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 117.195 1.638 . . . . 1.0 117.195 170.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -57.66 100.99 0.06 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.717 2.407 . . . . 1.0 109.2 169.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.8 t60 -130.5 130.74 44.56 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.623 1.569 . . . . 1.0 109.939 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -49.52 -66.96 0.31 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.647 1.721 . . . . 1.0 115.647 -168.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.5 m -60.01 -40.94 90.96 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 119.323 0.965 . . . . 1.0 111.911 -175.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.9 tp -58.89 -38.39 78.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.014 0.926 . . . . 1.0 111.756 177.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.05 -36.33 79.7 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.574 0.75 . . . . 1.0 112.281 175.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.92 -42.14 85.87 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.102 0.865 . . . . 1.0 110.839 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.3 m0 -62.17 -38.03 87.52 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.587 0.588 . . . . 1.0 112.587 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.7 -33.87 76.87 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.535 -0.728 . . . . 1.0 112.181 172.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.48 -49.27 56.36 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.435 0.636 . . . . 1.0 111.451 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -74.24 -34.13 63.56 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.204 1.802 . . . . 1.0 114.67 -169.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.7 m-90 -133.05 -46.5 0.85 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.574 0.953 . . . . 1.0 113.574 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.42 153.84 6.32 Favored Glycine 0 N--CA 1.48 1.613 0 C-N-CA 123.849 0.738 . . . . 1.0 114.871 170.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.32 -33.59 89.02 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 122.98 2.453 . . . . 1.0 113.67 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -61.26 -45.88 92.65 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.987 0.899 . . . . 1.0 111.387 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.86 -55.16 37.58 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.218 -1.355 . . . . 1.0 109.923 175.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.6 t -57.3 -47.78 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 C-N-CA 125.59 1.556 . . . . 1.0 111.997 -175.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -67.28 -34.61 77.77 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.936 -0.477 . . . . 1.0 112.263 176.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.2 t -65.96 -33.99 77.09 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.73 -0.606 . . . . 1.0 112.234 177.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -71.5 -11.93 61.12 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.031 1.123 . . . . 1.0 114.031 174.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.82 168.71 16.18 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 124.117 1.913 . . . . 1.0 115.116 -170.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 79.5 m -142.26 141.83 32.51 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 130.107 3.363 . . . . 1.0 108.323 -177.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.3 tt -104.44 120.54 41.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.374 1.07 . . . . 1.0 110.206 -176.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 74.9 mt -124.37 154.05 40.95 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.3 2.24 . . . . 1.0 110.92 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -66.64 -179.91 11.57 Favored Glycine 0 CA--C 1.543 1.814 0 C-N-CA 125.632 1.586 . . . . 1.0 115.342 176.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.281 0 C-N-CA 126.154 1.782 . . . . 1.0 110.781 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.818 0 O4'-C4'-C3' 109.093 3.493 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.035 0 O5'-C5'-C4' 114.551 3.108 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.222 0 O4'-C4'-C3' 109.285 3.685 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.433 0 O4'-C4'-C3' 108.642 3.042 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.884 0 O4'-C4'-C3' 108.638 3.038 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.107 0 O5'-C5'-C4' 115.027 3.448 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.766 1 O4'-C1'-N19 111.376 4.47 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.202 0 O5'-C5'-C4' 114.36 2.971 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.869 1 O4'-C4'-C3' 109.874 4.274 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.61 0 O4'-C1'-N19 110.576 3.47 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.718 0 O4'-C4'-C3' 109.091 3.491 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.267 0 O4'-C1'-N19 110.177 2.972 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.887 0 O4'-C4'-C3' 108.544 2.944 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.093 0 O5'-C5'-C4' 114.935 3.382 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.41 0 O4'-C1'-N19 110.975 3.969 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.01 0 P-O3'-C3' 123.375 3.062 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.21 0 O4'-C1'-N19 110.421 3.276 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.041 0 O5'-C5'-C4' 113.765 2.546 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.811 0 P-O3'-C3' 123.982 3.569 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.481 1 C5'-C4'-C3' 107.018 -5.121 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.682 0 O4'-C4'-C3' 107.772 2.172 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.5 1 O4'-C1'-N19 111.617 4.772 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.584 0 O4'-C4'-C3' 109.271 3.671 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.205 1 O4'-C1'-N19 111.237 4.296 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.386 0.136 . . . . 1.0 111.264 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 31.4 mmt-85 -67.81 58.73 0.07 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 126.813 2.045 . . . . 1.0 113.077 175.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.8 mttt -55.54 131.26 45.73 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 128.769 2.828 . . . . 1.0 111.08 178.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 85.7 t -73.77 134.48 29.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 113.629 -1.623 . . . . 1.0 111.433 173.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.8 mttp -108.54 122.92 48.07 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 106.577 -1.638 . . . . 1.0 106.577 167.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.27 145.59 28.22 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 104.442 -2.429 . . . . 1.0 104.442 168.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -128.39 142.29 51.15 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.199 -1.037 . . . . 1.0 108.199 173.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -132.74 139.74 47.75 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.938 1.295 . . . . 1.0 109.485 177.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -106.82 109.75 63.28 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 123.234 0.614 . . . . 1.0 112.483 -173.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -53.36 -26.67 36.07 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.269 3.312 . . . . 1.0 115.957 176.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -88.99 -18.79 26.68 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.52 1.128 . . . . 1.0 113.996 -174.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.9 p -129.54 -19.76 3.36 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.49 1.292 . . . . 1.0 114.49 -172.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.61 11.44 72.74 Favored Glycine 0 CA--C 1.54 1.647 0 CA-C-N 118.741 0.7 . . . . 1.0 114.159 -173.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -75.32 149.61 38.69 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.39 1.476 . . . . 1.0 109.4 171.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.5 t -132.47 154.75 40.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 126.754 2.022 . . . . 1.0 109.035 172.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.89 167.69 12.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 127.318 2.247 . . . . 1.0 109.384 177.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -146.84 120.31 9.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 127.483 2.313 . . . . 1.0 108.888 173.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.22 153.58 41.49 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.75 0.82 . . . . 1.0 109.588 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.4 mttp -95.72 9.05 41.71 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.1 -1.0 . . . . 1.0 111.573 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.84 -166.68 20.4 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 127.238 2.352 . . . . 1.0 113.202 -171.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.92 169.16 27.1 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 117.272 1.669 . . . . 1.0 117.272 169.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -57.64 101.42 0.07 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 127.708 2.403 . . . . 1.0 108.944 169.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -130.66 130.2 43.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.478 1.511 . . . . 1.0 109.625 178.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -48.68 -65.52 0.55 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 115.971 1.841 . . . . 1.0 115.971 -169.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 44.3 m -62.22 -39.22 92.08 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 119.266 0.939 . . . . 1.0 111.925 -175.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.5 tp -59.67 -39.44 84.51 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.773 0.829 . . . . 1.0 111.72 176.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -67.41 -35.83 80.06 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.664 0.786 . . . . 1.0 112.485 175.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -67.2 -43.87 81.05 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.06 0.846 . . . . 1.0 110.271 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.8 m0 -60.22 -38.54 83.7 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.73 -0.668 . . . . 1.0 112.487 176.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -65.18 -34.54 78.62 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.512 -0.742 . . . . 1.0 112.53 172.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.86 -49.85 59.81 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.804 0.812 . . . . 1.0 111.191 176.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -75.58 -34.13 60.64 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.859 1.664 . . . . 1.0 114.822 -169.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.6 m-90 -132.75 -47.01 0.87 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 113.651 0.982 . . . . 1.0 113.651 -176.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.01 154.01 6.28 Favored Glycine 0 N--CA 1.479 1.507 0 CA-C-N 118.944 0.793 . . . . 1.0 114.967 169.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -61.76 -33.83 84.46 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.075 2.517 . . . . 1.0 113.928 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -60.9 -45.96 92.55 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 122.07 0.938 . . . . 1.0 111.376 177.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.69 -54.97 40.23 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.182 -1.372 . . . . 1.0 109.916 175.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.2 t -58.11 -47.82 86.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 125.694 1.598 . . . . 1.0 111.786 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.14 -35.29 79.41 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.127 0.571 . . . . 1.0 112.157 176.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.3 t -65.43 -34.01 77.29 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.079 0.552 . . . . 1.0 112.189 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 24.3 m0 -72.28 -10.06 59.29 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.963 1.097 . . . . 1.0 113.963 174.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.45 168.46 17.45 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 124.172 1.939 . . . . 1.0 115.045 -172.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 92.8 m -144.14 142.81 30.79 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 130.133 3.373 . . . . 1.0 107.812 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -107.92 123.55 48.78 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.893 0.877 . . . . 1.0 109.767 -176.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.7 mt -121.22 129.8 53.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.758 2.023 . . . . 1.0 110.69 -172.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -77.48 -15.38 81.48 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.582 0.993 . . . . 1.0 115.582 -173.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 . . . . . 0 C--O 1.252 1.233 0 C-N-CA 126.49 1.916 . . . . 1.0 111.072 179.786 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.098 0 O4'-C4'-C3' 109.184 3.584 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.025 0 O5'-C5'-C4' 114.49 3.064 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.565 0 O4'-C4'-C3' 109.377 3.777 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.708 0 O4'-C4'-C3' 108.495 2.895 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.227 0 O4'-C4'-C3' 108.699 3.099 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.072 0 O4'-C4'-C3' 108.994 3.394 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.651 0 O4'-C1'-N19 110.645 3.557 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.265 0 O5'-C5'-C4' 114.456 3.04 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.162 1 O4'-C4'-C3' 109.641 4.041 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.496 0 O4'-C1'-N19 110.486 3.357 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.925 0 O4'-C4'-C3' 108.913 3.313 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.402 0 O4'-C1'-N19 110.248 3.06 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.65 0 O4'-C4'-C3' 108.645 3.045 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.149 0 O5'-C5'-C4' 114.89 3.35 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.214 1 O4'-C1'-N19 111.122 4.153 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.916 0 P-O3'-C3' 123.203 2.919 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.293 0 O4'-C1'-N19 110.253 3.067 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.859 0 O5'-C5'-C4' 113.865 2.618 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.776 0 P-O3'-C3' 124.166 3.721 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.213 1 C5'-C4'-C3' 107.116 -5.056 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.693 0 O4'-C4'-C3' 107.783 2.183 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.56 1 O4'-C1'-N19 111.564 4.705 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.559 0 O4'-C4'-C3' 109.228 3.628 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.315 1 O4'-C1'-N19 111.282 4.352 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 111.13 0.048 . . . . 1.0 111.13 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.6 mmp_? -65.59 57.37 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 127.268 2.227 . . . . 1.0 114.191 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -56.59 127.97 33.94 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 128.795 2.838 . . . . 1.0 110.221 175.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.6 t -70.65 133.86 31.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 113.62 -1.627 . . . . 1.0 110.646 174.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -108.09 121.87 45.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.529 -1.656 . . . . 1.0 106.529 168.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.63 144.46 28.58 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 103.694 -2.706 . . . . 1.0 103.694 167.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -127.66 140.36 52.13 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 107.691 -1.226 . . . . 1.0 107.691 174.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -131.83 139.25 48.79 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.848 1.259 . . . . 1.0 109.462 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -105.63 110.38 64.17 Favored Pre-proline 0 CA--C 1.544 0.713 0 N-CA-C 112.413 0.523 . . . . 1.0 112.413 -173.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo -52.73 -27.5 34.14 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 124.338 3.359 . . . . 1.0 115.87 176.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -87.97 -17.24 31.71 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.833 1.253 . . . . 1.0 114.273 -174.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.4 p -129.9 -22.1 2.95 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.114 1.153 . . . . 1.0 114.114 -174.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.01 7.52 81.75 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 124.09 0.852 . . . . 1.0 114.443 -172.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -77.45 156.49 31.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.011 1.406 . . . . 1.0 110.681 173.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.0 t -136.11 155.29 34.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 C-N-CA 126.986 2.115 . . . . 1.0 109.536 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.47 168.42 10.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 127.85 2.46 . . . . 1.0 109.404 177.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -147.48 121.84 9.65 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.757 2.423 . . . . 1.0 109.023 173.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.64 156.68 43.38 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.931 0.892 . . . . 1.0 109.972 -178.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -96.37 9.51 41.01 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.893 -1.129 . . . . 1.0 112.101 175.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 125.24 -167.56 17.57 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 127.186 2.327 . . . . 1.0 112.969 -171.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.1 170.07 32.68 Favored Glycine 0 CA--C 1.537 1.467 0 N-CA-C 117.082 1.593 . . . . 1.0 117.082 169.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -57.33 101.38 0.07 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.703 2.401 . . . . 1.0 108.945 169.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -130.68 133.95 46.52 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.121 1.369 . . . . 1.0 110.638 178.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -45.33 -70.55 0.1 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 125.895 1.678 . . . . 1.0 115.408 -169.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.4 m -61.04 -41.21 96.15 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.571 0.748 . . . . 1.0 111.949 -175.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 40.0 tp -58.44 -39.54 80.12 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.099 0.96 . . . . 1.0 111.69 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -69.72 -32.52 71.13 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.778 0.831 . . . . 1.0 112.965 175.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -68.44 -43.17 77.68 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.798 1.181 . . . . 1.0 111.221 175.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -61.56 -35.43 77.75 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.678 0.622 . . . . 1.0 112.678 178.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.76 -36.53 83.83 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 121.515 -0.741 . . . . 1.0 112.514 171.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.7 -48.45 69.24 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.826 0.822 . . . . 1.0 110.818 176.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.94 -32.84 59.74 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.657 1.583 . . . . 1.0 114.448 -169.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -134.87 -50.17 0.76 Allowed 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.008 1.114 . . . . 1.0 114.008 -176.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.2 153.87 6.02 Favored Glycine 0 N--CA 1.477 1.385 0 CA-C-N 119.315 0.962 . . . . 1.0 115.458 169.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.47 -33.24 79.65 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.264 2.643 . . . . 1.0 114.262 -178.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -63.76 -46.71 84.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.927 0.87 . . . . 1.0 110.887 177.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.08 -53.45 58.06 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.223 1.409 . . . . 1.0 110.197 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 25.7 t -57.43 -48.07 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 125.769 1.628 . . . . 1.0 111.804 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.7 -35.79 80.97 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.574 0.583 . . . . 1.0 112.574 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 21.9 t -65.73 -33.44 75.88 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.228 0.611 . . . . 1.0 112.067 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -72.75 -10.97 60.41 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.012 1.116 . . . . 1.0 114.012 174.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.88 169.25 15.12 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 124.321 2.01 . . . . 1.0 114.86 -172.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.0 m -143.67 142.26 30.92 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 130.148 3.379 . . . . 1.0 107.711 -176.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.1 tt -106.98 123.04 47.61 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.067 0.947 . . . . 1.0 109.586 -175.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.4 mt -120.85 126.44 50.07 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.424 1.89 . . . . 1.0 110.888 -172.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -84.37 -15.64 68.47 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 115.337 0.895 . . . . 1.0 115.337 -173.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 125.864 1.665 . . . . 1.0 111.061 -179.903 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.703 0 O4'-C4'-C3' 109.055 3.455 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.973 0 O5'-C5'-C4' 114.477 3.055 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.387 0 O4'-C4'-C3' 109.096 3.496 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.4 0 O4'-C4'-C3' 108.533 2.933 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.209 0 O4'-C4'-C3' 108.606 3.006 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.469 0 O4'-C4'-C3' 108.84 3.24 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.786 0 P-O3'-C3' 124.094 3.662 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.333 0 O5'-C5'-C4' 114.357 2.969 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.003 0 O4'-C4'-C3' 109.444 3.844 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.585 0 O4'-C4'-C3' 108.898 3.298 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.649 0 O4'-C4'-C3' 109.129 3.529 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.35 0 O4'-C1'-N19 110.137 2.921 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.839 0 O4'-C4'-C3' 108.571 2.971 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.035 0 O5'-C5'-C4' 115.104 3.503 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.276 0 O4'-C1'-N19 110.788 3.735 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.065 0 P-O3'-C3' 123.173 2.895 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.329 0 O4'-C4'-C3' 108.43 2.83 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.993 0 O5'-C5'-C4' 114.0 2.714 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.562 -3.127 0 P-O3'-C3' 123.395 3.079 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.127 2 C5'-C4'-C3' 106.801 -5.266 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.049 0 O4'-C4'-C3' 108.085 2.485 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.462 1 O4'-C1'-N19 111.394 4.492 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.515 0 O4'-C4'-C3' 109.334 3.734 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.009 1 O4'-C1'-N19 111.507 4.634 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 111.326 0.121 . . . . 1.0 111.326 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 51.9 mmt-85 -65.41 66.77 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 126.277 1.831 . . . . 1.0 112.637 175.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 44.8 mttt -62.94 137.33 58.24 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 128.934 2.894 . . . . 1.0 110.575 178.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 87.8 t -76.37 136.14 25.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 C-N-CA 125.723 1.609 . . . . 1.0 111.309 172.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -109.63 122.56 47.74 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 106.179 -1.786 . . . . 1.0 106.179 167.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.21 145.27 28.43 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 104.269 -2.493 . . . . 1.0 104.269 168.265 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -127.36 141.76 51.61 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.028 -1.101 . . . . 1.0 108.028 172.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -133.28 137.43 46.02 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.884 1.274 . . . . 1.0 109.041 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -107.45 110.89 63.13 Favored Pre-proline 0 CA--C 1.548 0.888 0 N-CA-C 112.417 0.525 . . . . 1.0 112.417 -172.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -53.19 -27.22 36.74 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 124.636 3.557 . . . . 1.0 115.593 175.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -89.05 -15.08 34.9 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.119 1.368 . . . . 1.0 114.575 -174.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.6 p -128.93 -21.83 3.28 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.351 1.061 . . . . 1.0 113.831 -176.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.77 9.75 79.39 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.577 1.084 . . . . 1.0 114.023 -172.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -83.47 158.89 21.87 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.03 1.415 . . . . 1.0 110.853 175.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -136.74 155.51 33.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 C-N-CA 126.96 2.104 . . . . 1.0 109.577 178.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.99 168.53 9.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 127.468 2.307 . . . . 1.0 109.29 178.206 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -147.22 121.66 9.69 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.685 2.394 . . . . 1.0 109.287 173.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.25 153.61 40.78 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.851 0.861 . . . . 1.0 109.727 -179.392 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 33.7 mttp -97.06 10.75 38.44 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.875 -1.141 . . . . 1.0 111.5 174.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.98 -165.53 21.73 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 127.253 2.358 . . . . 1.0 113.133 -173.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.12 168.9 23.81 Favored Glycine 0 CA--C 1.537 1.433 0 CA-C-O 123.5 1.611 . . . . 1.0 117.054 170.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -57.72 101.9 0.08 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 127.498 2.319 . . . . 1.0 109.093 169.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -130.51 123.7 30.24 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.497 1.519 . . . . 1.0 109.711 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -43.94 -65.37 0.51 Allowed 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 115.486 1.662 . . . . 1.0 115.486 -169.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.7 m -58.69 -41.59 86.59 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 119.379 0.99 . . . . 1.0 112.454 -176.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.2 tp -60.97 -37.9 84.06 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.058 0.943 . . . . 1.0 111.457 177.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -69.5 -32.79 71.87 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.533 0.733 . . . . 1.0 112.773 174.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.03 -42.1 76.82 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.823 1.192 . . . . 1.0 110.973 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -62.39 -37.65 86.57 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.554 0.576 . . . . 1.0 112.554 177.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -65.67 -32.06 73.42 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.668 -0.645 . . . . 1.0 112.332 172.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.36 -51.4 24.35 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.434 0.635 . . . . 1.0 110.968 176.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.437 ' HE3' ' CH2' ' A' ' 111' ' ' TRP . 47.1 mtmt -74.68 -29.06 61.09 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 115.309 1.596 . . . . 1.0 115.309 -169.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.437 ' CH2' ' HE3' ' A' ' 110' ' ' LYS . 16.5 m-90 -134.76 -47.51 0.74 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.176 1.176 . . . . 1.0 114.176 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.1 154.18 6.31 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 119.09 0.859 . . . . 1.0 114.942 170.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -61.03 -33.95 91.18 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.268 2.645 . . . . 1.0 113.759 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -61.41 -45.82 92.73 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.877 0.846 . . . . 1.0 111.238 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.74 -55.11 38.36 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 114.326 -1.306 . . . . 1.0 110.073 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 32.9 t -57.42 -48.24 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 125.819 1.648 . . . . 1.0 111.923 -174.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -66.94 -34.7 78.35 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.085 0.554 . . . . 1.0 112.147 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.6 m -67.58 -30.45 70.06 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 112.641 0.608 . . . . 1.0 112.641 178.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 17.9 m0 -74.55 -10.97 60.07 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.212 1.19 . . . . 1.0 114.212 173.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.7 168.46 16.51 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 124.091 1.901 . . . . 1.0 114.823 -170.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 99.6 m -142.95 143.19 31.87 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 130.133 3.373 . . . . 1.0 107.909 -176.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.69 122.91 47.31 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.082 0.953 . . . . 1.0 109.818 -176.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt -122.86 137.43 54.94 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.651 1.98 . . . . 1.0 110.52 -174.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -63.64 159.18 39.0 Favored Glycine 0 CA--C 1.54 1.63 0 CA-C-N 115.016 -0.993 . . . . 1.0 114.596 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.326 1.851 . . . . 1.0 110.674 178.235 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.035 0 O4'-C4'-C3' 109.044 3.444 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.236 0 O5'-C5'-C4' 114.513 3.081 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.289 0 O4'-C4'-C3' 109.41 3.81 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.446 0 O4'-C4'-C3' 108.474 2.874 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.077 0 O4'-C4'-C3' 108.856 3.256 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.046 0 O5'-C5'-C4' 114.849 3.321 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.601 1 O4'-C1'-N19 111.031 4.038 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.074 0 O5'-C5'-C4' 114.406 3.004 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.949 0 O4'-C4'-C3' 109.532 3.932 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.28 0 O4'-C1'-N19 110.524 3.405 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.573 0 O4'-C4'-C3' 108.889 3.289 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.117 0 O4'-C1'-N19 110.048 2.81 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.875 0 O4'-C4'-C3' 108.605 3.005 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.073 0 O5'-C5'-C4' 114.901 3.358 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.339 0 O4'-C1'-N19 110.777 3.721 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.685 0 P-O3'-C3' 123.185 2.904 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.252 0 O4'-C1'-N19 110.226 3.033 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.92 0 O5'-C5'-C4' 114.214 2.867 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.564 -2.873 0 P-O3'-C3' 123.755 3.379 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.384 1 C5'-C4'-C3' 107.162 -5.026 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.585 0 O4'-C4'-C3' 107.988 2.388 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.255 1 O4'-C1'-N19 111.879 5.099 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.845 0 O4'-C4'-C3' 109.087 3.487 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.131 1 O4'-C1'-N19 111.148 4.185 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 111.275 0.102 . . . . 1.0 111.275 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 36.7 mmt-85 -66.74 59.57 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 126.627 1.971 . . . . 1.0 113.053 174.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.7 mttt -54.05 133.01 43.67 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 128.744 2.817 . . . . 1.0 111.152 178.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.1 t -75.6 135.05 27.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 113.45 -1.704 . . . . 1.0 111.607 172.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.0 mttp -110.18 123.55 49.97 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 106.928 -1.508 . . . . 1.0 106.928 167.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -83.94 145.4 28.58 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 104.414 -2.439 . . . . 1.0 104.414 168.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -128.48 142.65 51.02 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.04 -1.096 . . . . 1.0 108.04 173.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -132.71 140.85 48.29 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.711 1.204 . . . . 1.0 109.467 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -107.81 109.57 62.26 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 123.077 0.551 . . . . 1.0 112.271 -173.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -53.28 -26.89 36.2 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 124.57 3.513 . . . . 1.0 115.785 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -88.68 -18.82 27.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.506 1.122 . . . . 1.0 113.928 -174.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 47.0 p -129.64 -19.85 3.31 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 114.543 1.312 . . . . 1.0 114.543 -172.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.88 11.53 73.99 Favored Glycine 0 CA--C 1.538 1.473 0 C-N-CA 123.879 0.752 . . . . 1.0 114.276 -173.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -75.72 149.82 37.98 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.176 1.39 . . . . 1.0 109.454 171.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -132.94 154.73 40.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 126.802 2.041 . . . . 1.0 108.962 172.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.84 168.15 11.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 127.45 2.3 . . . . 1.0 109.448 178.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -147.0 121.1 9.44 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 127.844 2.458 . . . . 1.0 109.097 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.71 152.58 39.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.73 0.812 . . . . 1.0 109.826 -178.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -93.06 7.57 43.61 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 120.921 -1.112 . . . . 1.0 111.988 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.77 -166.44 21.26 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 126.989 2.233 . . . . 1.0 113.133 -171.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.66 169.66 27.16 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-O 123.366 1.537 . . . . 1.0 116.807 169.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -57.26 103.0 0.1 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.533 2.333 . . . . 1.0 108.92 169.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -130.64 131.87 45.14 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.275 1.43 . . . . 1.0 110.161 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -48.96 -67.46 0.26 Allowed 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 115.909 1.818 . . . . 1.0 115.909 -168.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 34.1 m -59.95 -41.02 90.97 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 119.008 0.822 . . . . 1.0 111.893 -176.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.1 tp -58.53 -38.94 78.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.085 0.954 . . . . 1.0 111.571 177.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -68.54 -35.81 77.95 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.686 0.794 . . . . 1.0 112.352 175.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -66.79 -42.11 86.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.368 0.986 . . . . 1.0 110.744 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -61.47 -38.79 88.53 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.5 0.555 . . . . 1.0 112.5 176.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -65.06 -34.48 78.52 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.424 -0.797 . . . . 1.0 112.081 173.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.65 -48.74 63.25 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.737 0.779 . . . . 1.0 111.388 176.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.62 -33.89 60.53 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.773 1.629 . . . . 1.0 114.822 -169.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.4 m-90 -133.23 -45.89 0.84 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.814 1.042 . . . . 1.0 113.814 -176.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.64 154.23 6.39 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-N 119.073 0.851 . . . . 1.0 115.223 169.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.62 -34.47 84.41 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.063 2.509 . . . . 1.0 113.795 178.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -60.57 -45.87 92.34 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 122.072 0.939 . . . . 1.0 111.357 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.85 -54.84 41.52 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.017 -1.447 . . . . 1.0 110.067 175.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.9 t -57.91 -47.67 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 125.528 1.531 . . . . 1.0 112.201 -175.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -67.04 -35.21 79.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.95 0.5 . . . . 1.0 112.232 175.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.6 t -65.38 -33.99 77.26 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.688 -0.633 . . . . 1.0 112.331 177.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.6 m0 -72.63 -9.6 58.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.994 1.109 . . . . 1.0 113.994 174.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.51 168.29 16.56 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 124.041 1.877 . . . . 1.0 114.893 -173.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 89.7 m -143.89 138.92 28.91 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 129.79 3.236 . . . . 1.0 108.157 -176.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 30.8 tp -98.63 127.64 44.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.335 1.054 . . . . 1.0 109.718 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.5 mt -125.58 122.13 35.59 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.999 1.72 . . . . 1.0 110.878 -176.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -72.49 -20.13 79.3 Favored Glycine 0 CA--C 1.537 1.444 0 CA-C-N 115.259 -0.882 . . . . 1.0 115.113 -175.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.178 0 C-N-CA 126.031 1.733 . . . . 1.0 112.145 178.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.844 0 O4'-C4'-C3' 109.22 3.62 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.823 0 O4'-C1'-N19 110.213 3.017 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.039 0 O4'-C4'-C3' 109.267 3.667 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.369 0 O4'-C4'-C3' 108.385 2.785 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.325 0 O4'-C4'-C3' 108.602 3.002 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.045 0 O4'-C4'-C3' 108.963 3.363 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.663 0 O4'-C1'-N19 110.991 3.989 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.998 0 O5'-C5'-C4' 114.494 3.067 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.054 1 O4'-C4'-C3' 109.768 4.168 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.519 0 P-O3'-C3' 123.391 3.076 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.667 0 O4'-C4'-C3' 109.19 3.59 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.957 0 O4'-C1'-N19 110.164 2.956 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.659 0 O4'-C4'-C3' 108.488 2.888 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.032 0 O5'-C5'-C4' 115.091 3.493 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.464 0 O4'-C1'-N19 110.943 3.929 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.695 0 P-O3'-C3' 123.324 3.02 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.433 0 O4'-C4'-C3' 108.569 2.969 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.048 0 O5'-C5'-C4' 113.826 2.59 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.568 -2.515 0 P-O3'-C3' 124.029 3.608 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.066 1 C5'-C4'-C3' 107.297 -4.936 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.759 0 O4'-C4'-C3' 107.799 2.199 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.437 1 O4'-C1'-N19 111.4 4.501 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.402 0 O4'-C4'-C3' 109.07 3.47 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.054 1 O4'-C1'-N19 111.166 4.207 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 111.689 0.255 . . . . 1.0 111.689 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.1 mmp_? -69.31 58.32 0.11 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.731 2.013 . . . . 1.0 113.518 174.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -53.42 128.19 27.74 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 128.22 2.608 . . . . 1.0 110.179 174.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.8 t -72.3 134.39 29.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 113.633 -1.621 . . . . 1.0 110.521 171.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -108.33 121.57 45.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.516 -1.661 . . . . 1.0 106.516 167.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.81 143.82 28.85 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 103.896 -2.631 . . . . 1.0 103.896 167.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -127.66 139.96 52.39 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.761 -1.199 . . . . 1.0 107.761 175.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.48 140.0 49.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.546 1.139 . . . . 1.0 108.986 177.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -105.57 109.89 63.68 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 112.542 0.571 . . . . 1.0 112.542 -174.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -52.96 -26.77 32.9 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.18 3.253 . . . . 1.0 115.878 176.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -87.65 -17.44 31.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.883 1.273 . . . . 1.0 114.232 -174.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.3 p -129.79 -22.59 2.92 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 114.028 1.122 . . . . 1.0 114.028 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.42 8.78 80.94 Favored Glycine 0 CA--C 1.539 1.554 0 C-N-CA 124.048 0.832 . . . . 1.0 114.352 -172.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.32 156.0 29.83 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 119.061 1.43 . . . . 1.0 110.506 172.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -135.83 155.52 36.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 C-N-CA 126.917 2.087 . . . . 1.0 109.563 178.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.69 168.1 10.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 127.689 2.396 . . . . 1.0 109.261 177.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -146.92 122.01 10.11 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 127.772 2.429 . . . . 1.0 109.288 172.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.08 156.4 42.98 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.919 0.888 . . . . 1.0 109.861 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.0 mttp -97.13 10.34 39.64 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.038 -1.039 . . . . 1.0 111.986 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 124.98 -166.65 17.6 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 127.253 2.359 . . . . 1.0 112.858 -171.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.5 169.52 29.72 Favored Glycine 0 CA--C 1.537 1.408 0 N-CA-C 117.405 1.722 . . . . 1.0 117.405 169.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -57.74 100.37 0.05 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.607 2.363 . . . . 1.0 109.265 169.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -130.43 130.96 44.96 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.446 1.498 . . . . 1.0 109.75 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -47.17 -67.09 0.31 Allowed 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 115.501 1.667 . . . . 1.0 115.501 -168.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.7 m -60.15 -41.02 91.87 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 119.29 0.95 . . . . 1.0 112.083 -174.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 46.4 tp -59.28 -39.52 83.19 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.243 1.017 . . . . 1.0 111.522 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -68.84 -32.44 72.12 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 113.193 0.812 . . . . 1.0 113.193 175.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.33 -42.99 74.6 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 119.422 1.01 . . . . 1.0 110.858 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -61.53 -35.66 78.36 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.761 0.652 . . . . 1.0 112.761 177.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -65.13 -36.91 85.76 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 121.39 -0.819 . . . . 1.0 112.696 171.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.92 -48.26 69.18 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.703 0.763 . . . . 1.0 110.863 176.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -76.07 -32.89 59.48 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.568 1.547 . . . . 1.0 114.415 -169.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -135.0 -49.76 0.75 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.019 1.118 . . . . 1.0 114.019 -176.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.44 153.62 5.95 Favored Glycine 0 N--CA 1.48 1.577 0 CA-C-N 119.416 1.007 . . . . 1.0 115.353 169.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.1 -33.24 82.91 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.26 2.64 . . . . 1.0 114.328 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -63.11 -46.76 85.82 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 122.009 0.909 . . . . 1.0 110.966 177.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.64 -53.56 57.02 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.065 1.346 . . . . 1.0 110.032 176.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 27.7 t -57.15 -48.24 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.991 1.717 . . . . 1.0 111.81 -176.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -66.24 -36.01 81.9 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.076 0.551 . . . . 1.0 112.442 174.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.7 m -67.12 -30.58 70.62 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.644 0.609 . . . . 1.0 112.644 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 23.0 m0 -75.05 -10.04 59.1 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.805 1.039 . . . . 1.0 113.805 173.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.98 168.77 16.29 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 124.375 2.036 . . . . 1.0 114.689 -172.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.5 m -141.99 141.07 32.86 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 130.156 3.382 . . . . 1.0 107.736 -177.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.3 tt -104.98 121.72 44.33 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.928 0.891 . . . . 1.0 109.787 -175.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt -120.01 123.66 44.01 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.395 1.878 . . . . 1.0 110.917 -174.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -74.47 -19.38 79.87 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-N 115.223 -0.899 . . . . 1.0 115.201 -174.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.225 0 C-N-CA 126.056 1.742 . . . . 1.0 112.166 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.795 0 O4'-C4'-C3' 109.004 3.404 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.086 0 O5'-C5'-C4' 114.558 3.113 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.403 0 O4'-C4'-C3' 109.147 3.547 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.444 0 O4'-C4'-C3' 108.485 2.885 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.222 0 O4'-C4'-C3' 108.708 3.108 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.624 3.118 0 O4'-C4'-C3' 108.866 3.266 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.684 0 P-O3'-C3' 124.052 3.627 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.985 0 O5'-C5'-C4' 114.51 3.079 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.381 1 O4'-C4'-C3' 109.741 4.141 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.678 0 O4'-C4'-C3' 108.789 3.189 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.504 0 O4'-C4'-C3' 109.063 3.463 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.032 0 O4'-C1'-N19 110.012 2.764 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.79 0 O5'-C5'-C4' 114.452 3.037 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.133 0 O5'-C5'-C4' 115.043 3.459 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.438 0 O4'-C1'-N19 110.989 3.987 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.819 0 P-O3'-C3' 123.208 2.923 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.358 0 O4'-C1'-N19 110.29 3.112 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.714 0 O5'-C5'-C4' 113.966 2.69 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.564 -2.914 0 P-O3'-C3' 123.533 3.194 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.231 2 C5'-C4'-C3' 106.736 -5.309 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.172 0 O4'-C4'-C3' 108.193 2.593 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.311 1 O4'-C1'-N19 111.374 4.468 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.59 0 O4'-C4'-C3' 109.152 3.552 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.139 1 O4'-C1'-N19 111.286 4.357 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 120.414 0.15 . . . . 1.0 111.34 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 28.1 mmt-85 -68.57 57.19 0.08 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 126.458 1.903 . . . . 1.0 113.001 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.2 mttt -54.39 131.08 41.48 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 128.915 2.886 . . . . 1.0 111.041 177.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.3 t -73.58 134.17 30.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 113.607 -1.633 . . . . 1.0 111.59 172.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -107.97 121.91 45.75 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.703 -1.592 . . . . 1.0 106.703 167.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.09 143.98 29.35 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 104.055 -2.572 . . . . 1.0 104.055 167.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -127.06 141.71 51.71 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.925 -1.139 . . . . 1.0 107.925 173.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.84 141.59 49.47 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.794 1.238 . . . . 1.0 109.149 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -108.32 110.14 61.75 Favored Pre-proline 0 CA--C 1.548 0.899 0 N-CA-C 112.658 0.614 . . . . 1.0 112.658 -173.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -52.69 -27.52 33.96 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.417 3.411 . . . . 1.0 116.04 174.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -88.57 -19.86 25.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.85 1.26 . . . . 1.0 114.286 -174.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.8 p -127.57 -19.93 4.08 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.726 1.009 . . . . 1.0 113.726 -173.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.95 8.22 77.6 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.062 0.839 . . . . 1.0 114.151 -172.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -80.62 157.0 26.12 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 119.055 1.428 . . . . 1.0 110.892 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.49 155.11 33.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 C-N-CA 126.746 2.018 . . . . 1.0 109.332 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.26 168.83 10.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 127.463 2.305 . . . . 1.0 109.601 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -146.65 122.63 10.71 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 127.885 2.474 . . . . 1.0 109.407 171.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.01 155.27 42.69 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.949 0.9 . . . . 1.0 110.085 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -95.64 8.75 42.52 Favored 'General case' 0 N--CA 1.48 1.075 0 O-C-N 120.94 -1.1 . . . . 1.0 111.884 174.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.07 -164.76 20.52 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 127.15 2.31 . . . . 1.0 113.112 -171.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.59 168.87 21.32 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 117.018 1.567 . . . . 1.0 117.018 170.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -57.22 101.73 0.07 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.403 2.281 . . . . 1.0 108.763 169.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -130.25 128.48 41.71 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.13 1.372 . . . . 1.0 109.783 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 31.2 tttt -46.41 -65.92 0.48 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.958 1.836 . . . . 1.0 115.958 -168.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.0 m -59.49 -41.76 90.6 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 119.175 0.898 . . . . 1.0 112.204 -177.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.3 tp -59.92 -38.83 83.45 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.109 0.964 . . . . 1.0 111.574 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -68.86 -32.07 71.48 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.7 0.8 . . . . 1.0 112.973 174.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -68.46 -43.16 77.6 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.623 1.101 . . . . 1.0 110.907 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -62.78 -36.18 82.26 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.509 0.559 . . . . 1.0 112.509 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -65.09 -36.28 83.81 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.404 -0.81 . . . . 1.0 112.413 171.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.78 -48.62 68.47 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.597 0.713 . . . . 1.0 110.914 176.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -69.78 -37.43 76.35 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.561 1.544 . . . . 1.0 113.407 -171.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 11.7 m-90 -134.12 -55.82 0.86 Allowed 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.66 0.985 . . . . 1.0 113.66 -175.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 149.78 156.71 7.36 Favored Glycine 0 CA--C 1.537 1.43 0 CA-C-N 119.062 0.846 . . . . 1.0 114.932 172.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.57 -30.98 71.1 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.054 2.503 . . . . 1.0 114.158 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -62.54 -46.2 89.47 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.037 0.922 . . . . 1.0 111.181 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.38 -52.95 63.43 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 125.051 1.34 . . . . 1.0 109.972 176.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.7 t -58.01 -47.49 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 125.848 1.659 . . . . 1.0 111.669 -175.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.77 -37.64 88.3 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.675 0.79 . . . . 1.0 112.274 173.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.3 m -66.05 -29.72 70.12 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.009 0.523 . . . . 1.0 112.288 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 13.3 m0 -78.97 -6.19 55.67 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.085 1.143 . . . . 1.0 114.085 173.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.49 169.12 16.09 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 124.133 1.921 . . . . 1.0 114.624 -173.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 83.1 m -144.6 138.51 27.48 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 129.606 3.162 . . . . 1.0 108.156 -176.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -96.95 126.22 41.94 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.369 1.067 . . . . 1.0 109.81 -177.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.4 mt . . . . . 0 CA--C 1.533 0.297 0 C-N-CA 125.947 1.699 . . . . 1.0 110.926 -177.508 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 111.265 0.098 . . . . 1.0 111.265 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 47.0 mmt-85 -65.32 62.25 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 126.783 2.033 . . . . 1.0 112.942 173.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -54.95 133.75 48.39 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 128.636 2.775 . . . . 1.0 110.91 177.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 95.1 t -75.12 135.83 26.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 113.445 -1.707 . . . . 1.0 111.019 171.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.1 mttp -111.09 124.39 52.09 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.681 -1.6 . . . . 1.0 106.681 167.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.04 145.86 28.26 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 104.599 -2.371 . . . . 1.0 104.599 167.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -128.96 141.47 51.25 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.73 -1.211 . . . . 1.0 107.73 173.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -132.82 139.63 47.59 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.897 1.279 . . . . 1.0 109.157 178.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -106.7 109.7 63.27 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.002 0.521 . . . . 1.0 112.275 -174.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -52.5 -27.97 34.3 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.325 3.35 . . . . 1.0 115.808 175.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -86.29 -17.27 35.06 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.218 1.192 . . . . 1.0 114.218 -174.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.3 p -129.85 -22.45 2.92 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.046 1.128 . . . . 1.0 114.046 -174.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.4 7.73 82.97 Favored Glycine 0 CA--C 1.538 1.527 0 C-N-CA 124.308 0.956 . . . . 1.0 114.274 -172.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.08 156.82 29.8 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.071 1.436 . . . . 1.0 110.698 173.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.94 155.01 32.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 126.912 2.085 . . . . 1.0 109.55 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.38 168.38 10.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 C-N-CA 127.621 2.369 . . . . 1.0 109.299 177.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -147.51 121.46 9.38 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 127.715 2.406 . . . . 1.0 109.139 173.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.94 151.45 37.03 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.833 0.853 . . . . 1.0 109.977 -178.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -90.32 7.71 37.08 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 120.952 -1.093 . . . . 1.0 112.443 174.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.63 -165.34 21.53 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 126.66 2.076 . . . . 1.0 113.414 -172.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.39 170.29 27.48 Favored Glycine 0 CA--C 1.537 1.414 0 N-CA-C 117.071 1.588 . . . . 1.0 117.071 169.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -57.96 102.56 0.1 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.382 2.273 . . . . 1.0 108.667 169.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -130.3 132.99 46.14 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.121 1.368 . . . . 1.0 109.747 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.5 tttt -50.39 -66.34 0.41 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.677 1.732 . . . . 1.0 115.677 -168.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 40.8 m -60.46 -41.66 94.61 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 119.301 0.955 . . . . 1.0 112.032 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 46.0 tp -58.49 -38.26 77.27 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.154 0.981 . . . . 1.0 111.62 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -69.05 -36.06 77.26 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.971 0.908 . . . . 1.0 112.358 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -66.45 -42.03 88.24 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.463 1.029 . . . . 1.0 110.444 178.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -61.92 -37.95 86.58 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.454 0.539 . . . . 1.0 112.454 177.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -65.52 -34.8 79.1 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.489 -0.757 . . . . 1.0 112.175 172.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.63 -49.04 62.35 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.537 0.684 . . . . 1.0 111.317 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -74.79 -33.74 62.29 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.909 1.683 . . . . 1.0 114.58 -169.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.1 m-90 -133.41 -47.99 0.83 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.7 1.0 . . . . 1.0 113.7 -176.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.54 154.17 6.18 Favored Glycine 0 N--CA 1.478 1.436 0 N-CA-C 115.047 0.779 . . . . 1.0 115.047 169.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -61.17 -35.06 87.76 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.111 2.541 . . . . 1.0 114.051 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.4 -45.62 93.56 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.722 0.773 . . . . 1.0 111.449 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.81 -54.92 40.66 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.138 -1.392 . . . . 1.0 109.831 175.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 32.5 t -57.7 -48.34 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.62 1.568 . . . . 1.0 112.06 -174.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -66.42 -35.25 79.84 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.11 0.564 . . . . 1.0 111.906 175.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.9 m -67.81 -30.19 69.54 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.67 -0.644 . . . . 1.0 112.608 178.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.2 m0 -74.2 -10.16 59.33 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.776 1.028 . . . . 1.0 113.776 173.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.73 168.47 16.53 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 124.048 1.88 . . . . 1.0 114.707 -172.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 87.2 m -144.0 138.7 28.59 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 129.6 3.16 . . . . 1.0 107.895 -175.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -99.03 127.03 44.87 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.373 1.069 . . . . 1.0 109.657 -176.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.4 mt . . . . . 0 CA--C 1.538 0.515 0 C-N-CA 126.039 1.736 . . . . 1.0 111.34 -175.165 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 111.173 0.064 . . . . 1.0 111.173 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.0 mmt85 -66.47 61.36 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 126.448 1.899 . . . . 1.0 113.661 176.074 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -54.83 130.1 39.75 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 128.855 2.862 . . . . 1.0 110.549 177.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 83.1 t -71.69 133.2 32.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 113.683 -1.599 . . . . 1.0 111.01 173.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -106.56 120.94 43.26 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.442 -1.688 . . . . 1.0 106.442 167.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.16 144.06 29.24 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 103.899 -2.63 . . . . 1.0 103.899 167.893 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -127.24 139.4 52.95 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.791 -1.188 . . . . 1.0 107.791 175.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -131.78 139.49 48.94 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.678 1.191 . . . . 1.0 109.256 176.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -105.79 110.52 64.23 Favored Pre-proline 0 CA--C 1.545 0.761 0 N-CA-C 112.337 0.495 . . . . 1.0 112.337 -174.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -52.81 -27.79 35.94 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 124.441 3.427 . . . . 1.0 115.728 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -87.35 -17.22 32.89 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.777 1.231 . . . . 1.0 114.185 -174.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.1 p -130.2 -21.83 2.89 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.247 1.203 . . . . 1.0 114.247 -174.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.1 8.74 79.43 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.434 1.016 . . . . 1.0 114.295 -172.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -78.42 156.48 29.4 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.072 1.436 . . . . 1.0 110.727 172.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.5 t -136.41 154.99 33.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 126.907 2.083 . . . . 1.0 109.733 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.86 168.77 8.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 127.795 2.438 . . . . 1.0 109.558 177.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -147.26 121.49 9.55 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.762 2.425 . . . . 1.0 109.273 173.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.83 153.55 39.32 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.579 0.752 . . . . 1.0 109.913 -179.181 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -95.52 6.24 49.48 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.515 1.126 . . . . 1.0 111.927 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 131.38 -166.41 22.88 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 127.229 2.347 . . . . 1.0 113.515 -173.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.04 170.79 27.33 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-O 123.627 1.682 . . . . 1.0 117.301 169.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -57.58 100.45 0.05 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 127.938 2.495 . . . . 1.0 109.202 169.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -130.64 133.17 45.91 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.685 1.594 . . . . 1.0 110.139 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -50.55 -67.27 0.27 Allowed 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 115.875 1.805 . . . . 1.0 115.875 -168.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 37.4 m -59.7 -41.01 89.8 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 119.254 0.933 . . . . 1.0 112.056 -175.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 47.6 tp -58.57 -39.07 79.28 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.46 1.104 . . . . 1.0 111.694 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -68.09 -36.02 79.12 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.813 0.845 . . . . 1.0 112.292 175.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.94 -41.86 86.27 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.308 0.958 . . . . 1.0 110.752 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -63.02 -36.06 82.31 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.69 0.626 . . . . 1.0 112.69 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.2 -36.37 83.99 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.428 -0.795 . . . . 1.0 112.396 171.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.87 -48.08 67.08 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.303 0.573 . . . . 1.0 111.085 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -76.54 -33.61 58.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.633 1.573 . . . . 1.0 114.254 -169.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.0 m-90 -134.11 -46.92 0.78 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.108 1.151 . . . . 1.0 114.108 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.39 154.2 6.29 Favored Glycine 0 N--CA 1.479 1.561 0 CA-C-N 119.292 0.951 . . . . 1.0 115.318 169.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -62.88 -31.91 77.37 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.218 2.612 . . . . 1.0 113.93 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -63.1 -46.63 86.43 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.906 0.882 . . . . 1.0 111.016 176.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.99 -53.67 55.78 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 125.174 1.39 . . . . 1.0 109.89 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 24.9 t -56.85 -47.82 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 126.059 1.744 . . . . 1.0 111.771 -176.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -67.99 -34.57 76.78 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.419 0.526 . . . . 1.0 112.419 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.8 m -67.09 -31.76 72.46 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.829 0.677 . . . . 1.0 112.829 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -74.63 -11.38 60.18 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.21 1.189 . . . . 1.0 114.21 174.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.43 168.99 14.96 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 124.245 1.974 . . . . 1.0 115.131 -170.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.7 m -142.24 142.73 32.64 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 130.157 3.383 . . . . 1.0 107.636 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.2 tt -108.11 122.59 47.21 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.82 0.848 . . . . 1.0 109.409 -174.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 CA--C 1.538 0.499 0 C-N-CA 126.489 1.916 . . . . 1.0 110.814 -172.417 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 111.231 0.085 . . . . 1.0 111.231 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -67.41 58.81 0.05 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 126.654 1.982 . . . . 1.0 113.077 175.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.9 mttt -54.43 132.46 44.44 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 128.814 2.846 . . . . 1.0 111.48 177.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.0 t -75.14 134.77 28.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 113.403 -1.726 . . . . 1.0 111.574 173.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -109.61 123.13 48.92 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 106.96 -1.496 . . . . 1.0 106.96 167.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.13 143.9 29.38 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 104.287 -2.486 . . . . 1.0 104.287 168.082 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -123.55 136.01 54.31 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.257 -1.386 . . . . 1.0 107.257 173.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -135.3 97.4 3.7 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.246 1.018 . . . . 1.0 109.886 -169.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -72.09 119.52 75.02 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.465 1.106 . . . . 1.0 112.864 -169.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.1 -20.0 22.2 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 123.678 2.918 . . . . 1.0 114.239 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -83.91 -22.07 31.69 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.575 1.15 . . . . 1.0 113.793 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 62.6 p -127.42 -22.89 3.59 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.156 1.169 . . . . 1.0 114.156 -172.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.8 4.88 77.88 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-O 118.932 -0.927 . . . . 1.0 114.144 -171.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -74.13 155.45 38.41 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.46 1.63 . . . . 1.0 110.607 171.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 5.1 t -137.74 153.04 27.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 113.358 -1.746 . . . . 1.0 109.262 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.06 169.21 12.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 126.924 2.09 . . . . 1.0 109.122 177.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -147.44 121.52 9.46 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 127.537 2.335 . . . . 1.0 109.14 173.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.93 154.14 41.6 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.911 0.884 . . . . 1.0 109.756 -179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -95.41 8.79 42.16 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.109 -0.995 . . . . 1.0 112.002 174.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.38 -165.42 21.3 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 127.126 2.298 . . . . 1.0 113.335 -172.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.78 169.6 23.82 Favored Glycine 0 CA--C 1.537 1.453 0 N-CA-C 117.445 1.738 . . . . 1.0 117.445 169.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -57.76 101.25 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.559 2.344 . . . . 1.0 109.056 169.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -130.37 131.03 45.12 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.634 1.573 . . . . 1.0 109.839 178.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -49.39 -66.85 0.33 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.577 1.695 . . . . 1.0 115.577 -168.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.0 m -60.36 -40.39 90.57 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 119.36 0.982 . . . . 1.0 112.207 -175.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.7 tp -58.86 -38.47 78.86 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.334 1.053 . . . . 1.0 111.801 176.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.01 -36.51 80.09 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.476 0.711 . . . . 1.0 112.528 174.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.82 -41.98 86.61 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.296 0.953 . . . . 1.0 110.786 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -61.94 -38.41 88.38 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.532 0.568 . . . . 1.0 112.532 177.288 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -64.84 -34.77 79.16 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.529 -0.732 . . . . 1.0 112.177 172.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.61 -49.07 62.11 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.623 0.725 . . . . 1.0 110.945 176.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -73.22 -35.68 66.34 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.082 1.753 . . . . 1.0 114.425 -169.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.1 m-90 -132.81 -47.5 0.87 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.695 0.998 . . . . 1.0 113.695 -175.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.3 155.21 6.57 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.995 0.816 . . . . 1.0 114.676 169.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -61.77 -34.25 83.38 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.073 2.515 . . . . 1.0 113.788 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -61.12 -45.5 94.44 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 122.07 0.938 . . . . 1.0 111.339 177.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.47 -54.92 41.03 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 114.125 -1.398 . . . . 1.0 109.975 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.3 t -58.08 -46.32 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 125.448 1.499 . . . . 1.0 112.246 -174.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.0 -34.81 78.55 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.876 -0.515 . . . . 1.0 112.295 175.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.5 t -66.03 -32.38 73.82 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.622 -0.674 . . . . 1.0 112.339 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 27.9 m0 -73.37 -5.52 40.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.904 1.282 . . . . 1.0 113.663 173.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -75.16 168.48 19.9 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 124.151 1.929 . . . . 1.0 114.706 -175.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 84.0 m -147.86 139.72 24.01 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 130.134 3.373 . . . . 1.0 107.674 -176.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 30.3 tp -99.24 127.07 45.18 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.315 1.046 . . . . 1.0 109.786 -177.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.5 mt . . . . . 0 CA--C 1.537 0.471 0 C-N-CA 126.175 1.79 . . . . 1.0 110.993 -176.487 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 120.807 0.337 . . . . 1.0 111.652 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.4 mmt-85 -60.0 63.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 127.936 2.494 . . . . 1.0 113.083 170.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.6 mtpt -51.48 135.86 26.96 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 128.956 2.903 . . . . 1.0 112.038 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.4 t -75.69 135.53 26.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 112.936 -1.938 . . . . 1.0 110.642 169.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -111.03 123.47 50.25 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.521 -1.659 . . . . 1.0 106.521 167.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -83.47 145.08 29.15 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 104.209 -2.515 . . . . 1.0 104.209 168.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -127.61 140.27 52.21 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 107.668 -1.234 . . . . 1.0 107.668 172.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -131.7 131.1 42.8 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.42 1.088 . . . . 1.0 109.736 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -96.81 110.1 51.83 Favored Pre-proline 0 CA--C 1.543 0.696 0 C-N-CA 123.043 0.537 . . . . 1.0 111.784 -173.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -65.48 -15.56 50.18 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.583 2.855 . . . . 1.0 114.312 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -88.88 -17.48 29.54 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 114.444 1.276 . . . . 1.0 114.444 178.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 38.5 p -129.72 -22.77 2.93 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 114.481 1.289 . . . . 1.0 114.481 -175.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.51 7.2 87.11 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 124.359 0.98 . . . . 1.0 114.36 -172.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.18 156.08 30.04 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.211 1.505 . . . . 1.0 110.785 173.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.12 153.66 32.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 C-N-CA 126.695 1.998 . . . . 1.0 109.635 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.68 167.74 12.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 127.626 2.371 . . . . 1.0 109.193 177.215 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -146.8 121.57 9.89 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.752 2.421 . . . . 1.0 109.279 173.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.84 152.01 38.02 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.683 0.793 . . . . 1.0 109.904 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -92.1 7.93 40.17 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 121.069 -1.019 . . . . 1.0 112.116 174.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 130.36 -166.01 22.43 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 126.702 2.096 . . . . 1.0 113.432 -173.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.99 170.34 26.27 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 117.196 1.638 . . . . 1.0 117.196 169.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -57.71 100.42 0.05 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.698 2.399 . . . . 1.0 109.015 169.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -130.52 128.04 40.35 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.559 1.544 . . . . 1.0 109.764 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -44.25 -68.29 0.21 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.386 1.624 . . . . 1.0 115.386 -168.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.8 m -59.83 -41.68 91.87 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 119.185 0.902 . . . . 1.0 112.17 -174.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.5 tp -59.27 -38.89 81.23 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.146 0.979 . . . . 1.0 111.545 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.0 mmmt -69.75 -32.46 71.0 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 118.527 -0.749 . . . . 1.0 112.965 175.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -69.12 -42.44 76.04 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.514 1.052 . . . . 1.0 110.922 176.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -61.49 -37.35 83.35 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.685 0.624 . . . . 1.0 112.685 178.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -66.09 -34.45 78.08 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.548 -0.72 . . . . 1.0 112.38 172.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.53 -48.73 63.56 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.824 0.821 . . . . 1.0 111.236 175.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -74.54 -34.15 62.9 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.941 1.697 . . . . 1.0 114.567 -169.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 17.1 m-90 -132.75 -48.06 0.88 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 113.78 1.03 . . . . 1.0 113.78 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.57 153.75 6.07 Favored Glycine 0 N--CA 1.476 1.333 0 CA-C-N 118.908 0.776 . . . . 1.0 114.648 169.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.61 -34.68 84.03 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.061 2.507 . . . . 1.0 113.806 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.24 -45.3 95.09 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.986 0.898 . . . . 1.0 111.124 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.18 -55.98 27.21 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.263 -1.335 . . . . 1.0 109.72 175.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 38.9 t -57.87 -46.55 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 125.466 1.506 . . . . 1.0 112.111 -174.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -67.27 -35.69 80.04 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.86 -0.525 . . . . 1.0 112.048 176.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.3 t -65.63 -34.04 77.3 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.72 -0.613 . . . . 1.0 112.217 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 25.6 m0 -70.72 -11.53 61.0 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.027 1.121 . . . . 1.0 114.027 174.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.95 168.32 17.22 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 124.141 1.924 . . . . 1.0 114.76 -171.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 88.5 m -143.58 136.55 27.62 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 129.314 3.045 . . . . 1.0 108.243 -176.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 38.6 tp -96.03 126.54 41.34 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.254 1.022 . . . . 1.0 110.115 -176.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.9 mt . . . . . 0 CA--C 1.537 0.479 0 C-N-CA 125.654 1.582 . . . . 1.0 110.812 -175.773 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 119.845 -0.121 . . . . 1.0 110.81 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.0 mmp_? -63.45 59.25 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 127.432 2.293 . . . . 1.0 114.465 175.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -55.02 131.04 43.98 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 128.8 2.84 . . . . 1.0 110.395 174.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 85.0 t -74.26 133.86 30.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 113.437 -1.71 . . . . 1.0 111.315 173.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.4 mttp -107.77 122.17 46.2 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 106.505 -1.665 . . . . 1.0 106.505 167.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.04 145.17 28.63 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 104.32 -2.474 . . . . 1.0 104.32 168.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -128.06 142.84 51.1 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.158 -1.052 . . . . 1.0 108.158 172.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -132.68 141.08 48.43 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.046 1.338 . . . . 1.0 109.576 177.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -108.13 109.12 61.82 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 123.119 0.567 . . . . 1.0 112.496 -173.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -53.28 -26.8 35.81 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.36 3.374 . . . . 1.0 115.603 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -87.91 -19.6 27.1 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.475 1.11 . . . . 1.0 113.731 -174.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 45.9 p -129.97 -19.45 3.24 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.563 1.319 . . . . 1.0 114.563 -171.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.12 11.69 75.17 Favored Glycine 0 CA--C 1.539 1.57 0 C-N-CA 124.002 0.81 . . . . 1.0 114.215 -173.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -75.89 150.74 37.51 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.429 1.492 . . . . 1.0 109.405 171.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -133.08 155.09 40.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 C-N-CA 126.506 1.923 . . . . 1.0 108.936 172.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.7 167.9 12.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 127.537 2.335 . . . . 1.0 109.267 177.079 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -146.96 121.14 9.5 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 127.653 2.381 . . . . 1.0 108.92 173.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.0 154.54 42.65 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.825 0.85 . . . . 1.0 109.937 -178.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -95.67 9.83 38.97 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 121.118 -0.989 . . . . 1.0 111.856 174.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 126.1 -166.38 18.89 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 127.086 2.279 . . . . 1.0 113.396 -172.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.05 170.12 29.35 Favored Glycine 0 CA--C 1.535 1.311 0 N-CA-C 117.481 1.752 . . . . 1.0 117.481 169.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -57.49 100.02 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 128.119 2.568 . . . . 1.0 109.147 169.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.3 t60 -130.4 136.9 49.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.344 1.458 . . . . 1.0 110.69 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -49.99 -70.92 0.07 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 125.525 1.53 . . . . 1.0 114.809 -169.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.0 m -60.5 -40.68 92.26 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 118.918 0.781 . . . . 1.0 111.87 -173.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.96 -39.34 77.88 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.282 1.033 . . . . 1.0 111.725 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.82 -36.05 77.73 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.493 0.717 . . . . 1.0 112.407 175.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -67.27 -42.37 83.97 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.248 0.931 . . . . 1.0 110.977 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -61.37 -38.6 87.59 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.821 0.675 . . . . 1.0 112.821 176.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -64.74 -34.9 79.42 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.694 -0.628 . . . . 1.0 112.148 173.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.27 -48.74 64.21 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.645 0.736 . . . . 1.0 110.978 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.58 -34.63 60.66 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.658 1.583 . . . . 1.0 114.79 -169.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.7 m-90 -132.01 -48.15 0.94 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.832 1.049 . . . . 1.0 113.832 -176.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.96 153.94 6.17 Favored Glycine 0 N--CA 1.479 1.557 0 CA-C-N 118.908 0.776 . . . . 1.0 114.856 169.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -61.51 -34.5 85.47 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.945 2.43 . . . . 1.0 113.959 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -60.96 -45.94 92.73 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 122.032 0.92 . . . . 1.0 111.248 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.91 -54.74 42.65 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.296 -1.32 . . . . 1.0 109.922 176.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.4 t -57.87 -47.34 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 125.594 1.557 . . . . 1.0 112.074 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -66.92 -35.59 80.33 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.273 0.629 . . . . 1.0 112.163 175.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.5 m -66.47 -30.07 70.33 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 118.537 0.608 . . . . 1.0 112.514 178.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 19.2 m0 -75.6 -8.89 57.92 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.057 1.132 . . . . 1.0 114.057 173.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.1 168.81 16.34 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 124.118 1.913 . . . . 1.0 114.939 -172.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 91.4 m -144.54 142.92 30.56 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 130.177 3.391 . . . . 1.0 108.161 -176.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.96 123.6 48.41 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.025 0.93 . . . . 1.0 109.703 -176.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 CA--C 1.539 0.545 0 C-N-CA 126.744 2.018 . . . . 1.0 110.77 -173.563 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 120.336 0.112 . . . . 1.0 111.03 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 44.8 mmt-85 -67.47 61.51 0.06 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 126.392 1.877 . . . . 1.0 112.806 174.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -55.21 132.72 48.33 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 128.739 2.816 . . . . 1.0 111.207 178.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 84.3 t -74.02 134.12 30.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 113.411 -1.722 . . . . 1.0 111.78 173.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -108.0 123.13 48.19 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 106.379 -1.711 . . . . 1.0 106.379 167.331 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.4 145.24 28.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 104.38 -2.452 . . . . 1.0 104.38 168.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -127.5 141.83 51.55 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.027 -1.101 . . . . 1.0 108.027 172.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -133.04 139.1 47.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.629 1.172 . . . . 1.0 109.27 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.8 t-20 -106.08 110.51 64.07 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 112.372 0.508 . . . . 1.0 112.372 -173.278 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -52.96 -28.27 39.04 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 124.469 3.446 . . . . 1.0 115.793 175.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -86.34 -17.88 33.35 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.32 1.23 . . . . 1.0 114.32 -174.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.1 p -129.27 -22.8 3.06 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 114.0 1.111 . . . . 1.0 114.0 -173.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.37 8.31 83.56 Favored Glycine 0 CA--C 1.538 1.531 0 C-N-CA 124.265 0.936 . . . . 1.0 114.175 -172.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -79.18 157.12 27.93 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 123.137 1.446 . . . . 1.0 110.683 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.1 t -136.65 154.6 32.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 C-N-CA 127.149 2.18 . . . . 1.0 109.496 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.14 167.72 11.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 127.335 2.254 . . . . 1.0 109.301 177.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -146.99 120.58 9.12 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 127.674 2.389 . . . . 1.0 109.206 174.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.58 153.07 39.93 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.707 0.803 . . . . 1.0 109.93 -179.122 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -95.36 7.33 46.53 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.332 1.053 . . . . 1.0 111.609 176.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 130.82 -166.76 22.46 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 127.006 2.241 . . . . 1.0 113.444 -172.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.41 170.2 23.4 Favored Glycine 0 CA--C 1.536 1.398 0 N-CA-C 117.505 1.762 . . . . 1.0 117.505 170.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -57.6 100.91 0.06 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.728 2.411 . . . . 1.0 108.984 169.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -130.51 131.79 45.28 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.378 1.471 . . . . 1.0 109.875 177.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -48.72 -67.68 0.25 Allowed 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.767 1.766 . . . . 1.0 115.767 -168.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 36.9 m -59.72 -41.29 90.53 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-N 119.194 0.907 . . . . 1.0 112.084 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.9 tp -58.45 -39.12 79.0 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.939 0.896 . . . . 1.0 111.736 177.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -68.34 -35.81 78.32 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.35 0.66 . . . . 1.0 112.293 175.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -67.15 -42.02 85.05 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.366 0.984 . . . . 1.0 110.779 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -62.52 -37.82 87.53 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.606 0.595 . . . . 1.0 112.606 177.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -65.44 -34.3 77.96 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.701 -0.624 . . . . 1.0 112.528 172.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.14 -48.99 60.92 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.505 0.669 . . . . 1.0 111.17 176.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -74.53 -34.69 63.06 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.087 1.755 . . . . 1.0 114.587 -169.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.0 m-90 -132.89 -46.11 0.86 Allowed 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.847 1.054 . . . . 1.0 113.847 -176.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.46 153.9 6.33 Favored Glycine 0 N--CA 1.479 1.505 0 CA-C-N 118.94 0.791 . . . . 1.0 115.024 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -61.75 -33.35 85.71 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.947 2.431 . . . . 1.0 113.949 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -61.18 -45.98 92.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.836 0.826 . . . . 1.0 111.316 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.87 -54.94 40.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.107 1.363 . . . . 1.0 109.967 175.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.9 t -57.98 -47.91 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 125.577 1.551 . . . . 1.0 111.889 -174.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -67.09 -34.89 78.62 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.918 -0.489 . . . . 1.0 112.098 176.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.2 m -67.39 -30.3 70.04 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.667 -0.645 . . . . 1.0 112.572 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.3 m0 -74.41 -10.77 59.9 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.04 1.126 . . . . 1.0 114.04 173.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.65 168.39 17.79 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 124.213 1.959 . . . . 1.0 114.809 -171.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 93.4 m -144.21 142.44 30.51 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 130.083 3.353 . . . . 1.0 107.91 -175.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -107.24 124.13 49.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.925 0.89 . . . . 1.0 109.624 -176.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.6 mt . . . . . 0 CA--C 1.538 0.494 0 C-N-CA 126.524 1.93 . . . . 1.0 110.962 -173.218 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.386 0.136 . . . . 1.0 111.253 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.5 mmt-85 -69.03 56.25 0.09 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 126.667 1.987 . . . . 1.0 113.168 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -56.05 128.92 37.72 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 128.594 2.757 . . . . 1.0 110.715 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 91.2 t -71.98 135.21 28.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 113.618 -1.628 . . . . 1.0 110.801 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -109.31 121.72 45.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 106.691 -1.596 . . . . 1.0 106.691 167.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.01 144.11 29.33 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 103.887 -2.634 . . . . 1.0 103.887 167.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -127.38 140.03 52.45 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.87 -1.159 . . . . 1.0 107.87 174.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -131.75 134.78 46.23 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.738 1.215 . . . . 1.0 109.616 178.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -99.82 110.41 59.03 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 123.209 0.604 . . . . 1.0 111.651 -173.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -66.37 -14.83 45.85 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.181 2.588 . . . . 1.0 114.3 -179.179 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -89.17 -20.77 23.8 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.599 1.16 . . . . 1.0 114.084 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.6 p -129.99 -20.98 3.05 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.24 1.57 . . . . 1.0 115.24 -171.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.33 10.71 82.14 Favored Glycine 0 CA--C 1.541 1.696 0 C-N-CA 123.857 0.742 . . . . 1.0 114.302 -173.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -74.06 148.76 41.61 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.181 1.392 . . . . 1.0 109.273 170.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.8 t -132.19 154.74 40.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 C-N-CA 126.362 1.865 . . . . 1.0 108.974 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.43 168.08 10.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 127.53 2.332 . . . . 1.0 109.417 177.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -147.21 120.26 8.81 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.808 2.443 . . . . 1.0 109.174 173.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.98 157.79 43.87 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.16 0.984 . . . . 1.0 109.98 -178.243 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -99.07 11.59 38.57 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 120.792 -1.192 . . . . 1.0 111.855 176.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 123.71 -167.01 16.03 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 127.165 2.317 . . . . 1.0 112.971 -171.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.23 169.5 32.03 Favored Glycine 0 CA--C 1.536 1.393 0 N-CA-C 117.329 1.692 . . . . 1.0 117.329 169.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -57.7 99.3 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 128.057 2.543 . . . . 1.0 109.14 169.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -130.55 132.87 45.8 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.345 1.458 . . . . 1.0 110.583 178.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.7 tppt? -44.83 -71.24 0.08 Allowed 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 125.747 1.619 . . . . 1.0 114.995 -169.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.8 m -61.45 -40.06 93.11 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 118.532 0.605 . . . . 1.0 111.947 -173.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.7 tp -58.25 -40.4 81.68 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.259 1.024 . . . . 1.0 111.488 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -69.65 -32.2 70.72 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.681 0.792 . . . . 1.0 112.982 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.95 -42.59 76.45 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.619 1.1 . . . . 1.0 111.225 176.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.0 m0 -61.14 -36.69 80.44 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.627 0.603 . . . . 1.0 112.627 177.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -65.11 -36.47 84.39 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.424 -0.798 . . . . 1.0 112.611 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.24 -48.01 71.91 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.472 0.653 . . . . 1.0 110.989 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -76.27 -34.05 59.13 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.304 1.442 . . . . 1.0 114.64 -169.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.6 m-90 -134.02 -48.26 0.79 Allowed 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.942 1.089 . . . . 1.0 113.942 -176.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.7 153.73 6.06 Favored Glycine 0 N--CA 1.48 1.627 0 CA-C-N 119.34 0.973 . . . . 1.0 115.265 169.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.57 -33.34 78.42 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 123.212 2.608 . . . . 1.0 114.214 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -62.85 -46.79 86.25 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 122.168 0.985 . . . . 1.0 111.042 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.78 -53.66 55.91 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.313 1.445 . . . . 1.0 109.935 176.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 28.1 t -57.29 -47.79 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 125.774 1.629 . . . . 1.0 111.778 -175.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.89 -36.0 82.2 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.3 0.64 . . . . 1.0 112.562 174.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.2 m -66.84 -30.75 71.02 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.585 0.587 . . . . 1.0 112.585 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 16.2 m0 -75.83 -8.78 57.7 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.947 1.091 . . . . 1.0 113.947 173.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.7 168.9 16.78 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 124.032 1.872 . . . . 1.0 114.831 -172.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 94.9 m -142.53 141.74 32.12 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 130.521 3.529 . . . . 1.0 107.632 -176.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.08 123.32 47.83 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.779 0.832 . . . . 1.0 109.64 -175.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.4 mt . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 126.525 1.93 . . . . 1.0 110.927 -173.496 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.462 0 CA-C-O 120.491 0.186 . . . . 1.0 111.337 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 29.9 mmt-85 -69.46 58.27 0.12 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 126.483 1.913 . . . . 1.0 112.637 175.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -55.89 130.96 45.74 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 128.634 2.774 . . . . 1.0 110.995 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.5 t -73.62 134.1 30.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 113.584 -1.643 . . . . 1.0 110.95 172.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 40.2 mttt -108.45 122.32 46.78 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 106.777 -1.564 . . . . 1.0 106.777 167.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.53 144.1 28.9 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 103.932 -2.618 . . . . 1.0 103.932 167.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.4 ' CD1' ' HB2' ' A' ' 120' ' ' ALA . 76.4 m-85 -127.46 138.58 52.99 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 107.84 -1.17 . . . . 1.0 107.84 173.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -131.73 125.97 33.33 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.61 1.164 . . . . 1.0 109.847 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -92.41 110.79 47.11 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 123.163 0.585 . . . . 1.0 111.767 -172.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -65.87 -14.56 45.16 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.371 2.714 . . . . 1.0 114.659 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -88.94 -18.08 28.21 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.169 1.174 . . . . 1.0 114.169 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.2 p -129.51 -22.9 2.97 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.382 1.252 . . . . 1.0 114.382 -174.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 76.86 7.55 86.32 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 124.361 0.982 . . . . 1.0 114.486 -172.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -78.05 156.33 30.12 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 119.243 1.521 . . . . 1.0 110.877 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 20.9 t -136.44 153.66 31.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 C-N-CA 126.691 1.997 . . . . 1.0 109.814 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.58 168.07 12.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 127.658 2.383 . . . . 1.0 109.405 177.129 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -146.74 120.89 9.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.736 2.414 . . . . 1.0 109.136 173.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.92 155.89 43.16 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.898 0.879 . . . . 1.0 109.897 -178.631 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -97.81 10.15 40.85 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.113 -0.992 . . . . 1.0 111.693 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 126.12 -165.31 19.36 Favored Glycine 0 CA--C 1.532 1.143 0 C-N-CA 127.227 2.346 . . . . 1.0 113.085 -171.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.07 168.44 26.14 Favored Glycine 0 CA--C 1.535 1.32 0 N-CA-C 117.157 1.623 . . . . 1.0 117.157 169.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -57.59 100.49 0.05 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 127.421 2.288 . . . . 1.0 109.035 169.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -130.38 126.34 36.83 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.692 1.597 . . . . 1.0 109.534 178.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -44.84 -66.6 0.37 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 115.774 1.768 . . . . 1.0 115.774 -168.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.8 m -60.46 -40.98 93.17 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.403 1.001 . . . . 1.0 112.132 -175.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.6 tp -59.5 -39.07 82.61 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.053 0.941 . . . . 1.0 111.545 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -68.56 -32.56 72.57 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.628 0.771 . . . . 1.0 113.036 175.056 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -68.87 -42.64 76.74 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.426 1.012 . . . . 1.0 110.909 176.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.8 m0 -62.06 -36.01 80.35 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.426 0.528 . . . . 1.0 112.426 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.9 -36.11 82.48 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.5 -0.75 . . . . 1.0 112.464 172.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.07 -48.89 66.87 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.859 0.837 . . . . 1.0 111.004 176.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.2 -33.02 61.37 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.706 1.602 . . . . 1.0 114.546 -169.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -134.5 -48.43 0.77 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.832 1.049 . . . . 1.0 113.832 -176.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.62 153.91 6.11 Favored Glycine 0 N--CA 1.479 1.529 0 CA-C-N 119.35 0.977 . . . . 1.0 115.148 169.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.49 -32.87 80.18 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 123.043 2.496 . . . . 1.0 114.187 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -62.64 -46.61 87.41 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.0 0.905 . . . . 1.0 111.027 176.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.85 -53.81 54.19 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.202 1.401 . . . . 1.0 109.648 176.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.8 t -57.53 -47.09 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 C-N-CA 125.872 1.669 . . . . 1.0 111.788 -175.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.81 -37.99 89.48 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.362 0.665 . . . . 1.0 112.373 173.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 56.7 m -66.51 -29.88 70.08 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.051 0.54 . . . . 1.0 112.435 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 26.8 m0 -74.83 -10.3 59.37 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.184 1.179 . . . . 1.0 114.184 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.4 ' HB2' ' CD1' ' A' ' 85' ' ' TYR . . . -71.83 168.73 17.26 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 124.09 1.9 . . . . 1.0 115.075 -171.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 63.7 m -144.18 139.59 28.84 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 129.857 3.263 . . . . 1.0 108.369 -176.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.6 tp -97.86 126.44 43.24 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.4 1.08 . . . . 1.0 109.763 -177.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.6 mt . . . . . 0 CA--C 1.537 0.446 0 C-N-CA 125.776 1.631 . . . . 1.0 111.12 -177.293 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.613 0.244 . . . . 1.0 111.631 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 50.8 mmt-85 -69.68 61.24 0.16 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 126.124 1.769 . . . . 1.0 112.915 175.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.8 mttt -58.12 131.67 51.21 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 128.413 2.685 . . . . 1.0 110.577 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.3 t -70.66 134.53 29.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 113.572 -1.649 . . . . 1.0 110.996 171.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.4 mttt -107.99 120.1 41.34 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 106.833 -1.543 . . . . 1.0 106.833 167.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.91 143.69 31.48 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 103.21 -2.885 . . . . 1.0 103.21 167.488 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -127.2 142.5 51.47 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.841 -1.17 . . . . 1.0 107.841 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.68 142.32 49.79 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.869 1.268 . . . . 1.0 109.546 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -109.26 109.6 60.45 Favored Pre-proline 0 CA--C 1.548 0.892 0 N-CA-C 112.846 0.684 . . . . 1.0 112.846 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_exo -53.13 -27.58 37.7 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 124.345 3.363 . . . . 1.0 115.743 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -89.35 -21.62 23.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.774 1.229 . . . . 1.0 114.087 -173.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.5 p -127.04 -17.97 4.72 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 114.286 1.217 . . . . 1.0 114.286 -171.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.71 11.16 72.89 Favored Glycine 0 CA--C 1.541 1.699 0 C-N-CA 123.843 0.735 . . . . 1.0 114.218 -174.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -78.18 150.92 33.45 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.716 1.606 . . . . 1.0 109.696 174.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 t -132.97 154.7 40.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 126.614 1.966 . . . . 1.0 108.913 172.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.28 168.35 10.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 127.372 2.269 . . . . 1.0 109.575 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -146.95 119.77 8.66 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 127.669 2.388 . . . . 1.0 109.605 172.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.97 149.87 34.03 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.894 0.878 . . . . 1.0 109.748 -178.718 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -92.41 9.9 32.26 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 120.851 -1.155 . . . . 1.0 111.907 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.89 -166.1 20.66 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 127.105 2.288 . . . . 1.0 113.363 -170.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.51 168.2 27.21 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 125.466 1.508 . . . . 1.0 116.818 170.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -56.95 102.57 0.09 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 127.234 2.214 . . . . 1.0 109.077 169.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -130.8 135.13 47.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.031 1.332 . . . . 1.0 111.061 177.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -49.46 -69.17 0.12 Allowed 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 126.2 1.8 . . . . 1.0 114.811 -169.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 38.2 m -62.09 -39.51 92.72 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.35 -0.844 . . . . 1.0 111.942 -175.148 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.4 tp -58.6 -39.42 80.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.464 1.106 . . . . 1.0 111.557 176.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -67.52 -36.23 80.62 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.656 0.783 . . . . 1.0 112.273 175.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -67.32 -42.03 84.31 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.106 0.866 . . . . 1.0 111.313 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 34.9 m0 -61.78 -37.23 83.56 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.69 0.626 . . . . 1.0 112.69 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -64.85 -36.0 82.95 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 121.343 -0.848 . . . . 1.0 112.139 172.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.07 -49.01 66.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.667 0.746 . . . . 1.0 110.816 176.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -69.82 -37.37 76.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.531 1.533 . . . . 1.0 113.726 -170.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 11.6 m-90 -133.84 -54.55 0.87 Allowed 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.62 0.97 . . . . 1.0 113.62 -175.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 147.75 157.24 7.37 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-N 118.974 0.806 . . . . 1.0 114.934 172.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.78 -30.29 68.69 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.954 2.436 . . . . 1.0 113.842 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -62.43 -46.86 86.63 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.083 0.953 . . . . 1.0 111.086 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.84 -52.68 64.68 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.048 1.339 . . . . 1.0 109.979 176.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 38.0 t -57.42 -47.88 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 C-N-CA 125.843 1.657 . . . . 1.0 111.842 -176.476 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.63 -37.84 88.95 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.838 0.855 . . . . 1.0 112.587 173.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.5 m -65.31 -29.06 69.78 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.771 -0.581 . . . . 1.0 112.535 -178.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -80.74 -5.71 57.47 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.374 1.249 . . . . 1.0 114.374 174.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.27 168.65 16.86 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 124.026 1.87 . . . . 1.0 115.1 -172.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 67.7 m -142.12 135.64 29.27 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 130.083 3.353 . . . . 1.0 108.696 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 26.6 tp -87.86 126.87 35.27 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.641 1.176 . . . . 1.0 110.163 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 CA--C 1.543 0.688 0 C-N-CA 126.936 2.095 . . . . 1.0 110.361 176.905 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.282 0.087 . . . . 1.0 111.15 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.9 mmt-85 -67.56 59.16 0.06 Allowed 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 126.611 1.964 . . . . 1.0 112.996 175.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.4 mttt -54.91 132.75 47.32 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 128.869 2.867 . . . . 1.0 111.074 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.1 t -74.77 134.73 28.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 113.464 -1.698 . . . . 1.0 111.692 174.003 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.5 mttp -108.68 122.51 47.27 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 106.598 -1.63 . . . . 1.0 106.598 167.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.19 145.68 28.23 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 104.607 -2.368 . . . . 1.0 104.607 168.233 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -128.03 142.12 51.32 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.907 -1.146 . . . . 1.0 107.907 172.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -133.83 138.03 45.41 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.989 1.316 . . . . 1.0 109.137 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -105.51 110.31 64.14 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 112.348 0.499 . . . . 1.0 112.348 -173.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -53.29 -27.76 39.99 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 124.405 3.404 . . . . 1.0 115.694 176.282 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -86.58 -17.47 33.89 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.771 1.228 . . . . 1.0 114.216 -174.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.5 p -129.45 -22.32 3.06 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.267 1.21 . . . . 1.0 114.267 -174.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.95 8.13 82.32 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.369 0.985 . . . . 1.0 114.169 -172.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.15 156.67 29.76 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 119.141 1.47 . . . . 1.0 110.745 173.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -136.62 154.97 33.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 126.799 2.04 . . . . 1.0 109.194 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.71 168.02 10.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 127.513 2.325 . . . . 1.0 109.28 178.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -147.49 121.83 9.64 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 127.735 2.414 . . . . 1.0 109.148 174.137 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.31 153.6 41.44 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.731 0.812 . . . . 1.0 109.663 -179.081 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -94.51 8.13 43.22 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.964 -1.085 . . . . 1.0 111.807 174.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.51 -166.66 20.97 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 126.919 2.2 . . . . 1.0 113.4 -172.04 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.47 169.82 26.83 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-O 123.603 1.668 . . . . 1.0 116.886 169.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -57.69 102.97 0.11 Allowed 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 127.644 2.378 . . . . 1.0 108.818 169.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.4 t60 -130.51 131.87 45.32 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 1.0 109.767 178.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.4 tttt -49.75 -66.02 0.46 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 115.903 1.816 . . . . 1.0 115.903 -168.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 41.2 m -60.49 -41.23 93.84 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 119.488 1.04 . . . . 1.0 111.891 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.1 tp -59.05 -38.52 79.57 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.103 0.961 . . . . 1.0 111.482 177.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.31 -36.11 78.83 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.681 0.792 . . . . 1.0 112.399 175.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -66.8 -42.14 86.43 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.331 0.969 . . . . 1.0 110.75 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -61.71 -38.45 87.9 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.695 0.628 . . . . 1.0 112.695 177.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -65.34 -34.28 77.95 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.53 -0.732 . . . . 1.0 112.38 172.365 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.02 58.87 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.567 0.699 . . . . 1.0 111.24 176.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -74.58 -34.09 62.81 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.906 1.682 . . . . 1.0 114.669 -169.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -132.89 -47.16 0.86 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.588 0.958 . . . . 1.0 113.588 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.34 154.21 6.3 Favored Glycine 0 N--CA 1.477 1.368 0 CA-C-N 118.952 0.796 . . . . 1.0 115.084 169.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.65 -33.89 85.38 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.088 2.526 . . . . 1.0 113.864 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -61.23 -45.98 92.32 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 122.038 0.923 . . . . 1.0 111.286 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.66 -54.84 41.75 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 114.211 -1.358 . . . . 1.0 109.827 175.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 36.4 t -58.07 -47.37 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 125.462 1.505 . . . . 1.0 112.043 -174.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.32 -35.76 80.08 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.778 -0.576 . . . . 1.0 111.979 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.2 t -65.4 -33.62 76.38 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.476 0.58 . . . . 1.0 112.195 178.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 28.1 m0 -71.55 -11.84 61.06 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.093 1.146 . . . . 1.0 114.093 174.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.15 168.52 17.02 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 124.041 1.877 . . . . 1.0 114.98 -171.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 91.2 m -144.29 143.45 31.01 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 130.213 3.405 . . . . 1.0 107.958 -175.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -108.41 124.25 50.1 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.899 0.88 . . . . 1.0 109.587 -176.159 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.6 mt . . . . . 0 CA--C 1.538 0.49 0 C-N-CA 126.817 2.047 . . . . 1.0 110.819 -172.671 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.425 0.155 . . . . 1.0 111.349 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.2 mmt-85 -69.65 56.22 0.12 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 126.602 1.961 . . . . 1.0 113.049 176.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -55.07 130.87 43.5 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 129.056 2.943 . . . . 1.0 111.123 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 74.2 t -73.39 132.84 32.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 113.729 -1.578 . . . . 1.0 111.973 173.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.9 mttt -106.43 121.92 45.24 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.753 -1.573 . . . . 1.0 106.753 167.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -83.83 144.66 29.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 103.714 -2.698 . . . . 1.0 103.714 167.778 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.401 ' CD1' ' HB2' ' A' ' 120' ' ' ALA . 71.2 m-85 -126.78 142.84 51.43 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.918 -1.141 . . . . 1.0 107.918 172.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -132.72 138.51 47.26 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.934 1.294 . . . . 1.0 109.088 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -105.02 110.66 64.8 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 112.317 0.488 . . . . 1.0 112.317 -174.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -53.05 -27.53 36.74 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.33 3.353 . . . . 1.0 115.998 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -87.41 -17.16 32.91 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.83 1.252 . . . . 1.0 114.086 -174.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 42.6 p -129.78 -22.46 2.94 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.362 1.245 . . . . 1.0 114.362 -174.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.76 7.24 83.36 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 124.369 0.985 . . . . 1.0 114.251 -172.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -77.79 156.79 30.29 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 123.14 1.448 . . . . 1.0 110.738 173.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -137.37 155.12 31.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 126.795 2.038 . . . . 1.0 109.461 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.25 169.64 9.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 127.266 2.226 . . . . 1.0 109.79 177.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -146.15 123.17 11.4 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 128.017 2.527 . . . . 1.0 109.641 170.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.06 155.42 43.34 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.897 0.879 . . . . 1.0 109.735 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.4 mttp -95.2 8.67 42.34 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.121 0.968 . . . . 1.0 111.872 173.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 125.94 -165.82 18.96 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 126.907 2.194 . . . . 1.0 113.232 -170.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.6 168.75 25.14 Favored Glycine 0 CA--C 1.535 1.3 0 N-CA-C 117.021 1.568 . . . . 1.0 117.021 170.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -57.68 102.05 0.09 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.322 2.249 . . . . 1.0 108.796 169.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -130.42 127.78 39.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.349 1.46 . . . . 1.0 109.6 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.1 tttt -45.39 -66.69 0.36 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 116.036 1.865 . . . . 1.0 116.036 -168.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.8 m -60.12 -41.25 92.24 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.23 0.923 . . . . 1.0 112.28 -177.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.5 tp -59.95 -38.7 83.19 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.897 0.879 . . . . 1.0 111.576 178.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -68.74 -32.78 72.79 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.679 0.792 . . . . 1.0 112.707 174.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -68.33 -42.9 78.66 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.563 1.074 . . . . 1.0 110.947 176.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.0 m0 -61.61 -36.37 80.52 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.555 0.576 . . . . 1.0 112.555 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.82 -36.05 82.39 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.45 -0.781 . . . . 1.0 112.432 172.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.2 -48.68 67.17 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.701 0.763 . . . . 1.0 111.024 176.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -75.38 -33.56 61.03 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.782 1.633 . . . . 1.0 114.336 -169.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.3 m-90 -134.46 -48.16 0.77 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.987 1.106 . . . . 1.0 113.987 -175.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.82 153.22 5.93 Favored Glycine 0 N--CA 1.479 1.518 0 CA-C-N 119.142 0.883 . . . . 1.0 115.225 169.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.3 -32.51 81.8 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.093 2.529 . . . . 1.0 114.356 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -62.43 -46.63 87.66 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 122.136 0.97 . . . . 1.0 111.03 176.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.39 -53.22 60.63 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 114.15 -1.386 . . . . 1.0 110.179 176.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 34.4 t -57.71 -47.49 85.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 C-N-CA 125.644 1.578 . . . . 1.0 111.88 -175.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.6 -38.08 89.77 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.451 0.7 . . . . 1.0 112.322 173.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.4 m -66.35 -29.66 69.89 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.414 0.524 . . . . 1.0 112.414 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -76.52 -8.85 58.03 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.953 1.094 . . . . 1.0 113.953 173.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.401 ' HB2' ' CD1' ' A' ' 85' ' ' TYR . . . -72.42 168.8 17.71 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 124.032 1.872 . . . . 1.0 114.866 -171.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 95.8 m -144.21 136.29 26.35 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 129.63 3.172 . . . . 1.0 108.444 -175.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 27.6 tp -92.76 128.16 38.53 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 124.663 1.185 . . . . 1.0 109.657 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.6 mt . . . . . 0 CA--C 1.535 0.4 0 C-N-CA 125.866 1.666 . . . . 1.0 111.246 -179.058 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 120.348 0.118 . . . . 1.0 111.202 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.2 mmt-85 -68.84 56.51 0.09 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.741 2.016 . . . . 1.0 113.048 175.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 66.3 mttt -56.66 129.12 39.71 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 128.404 2.682 . . . . 1.0 110.538 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.6 t -72.57 132.36 33.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 113.488 -1.687 . . . . 1.0 110.763 173.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -106.39 122.22 45.83 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 106.649 -1.612 . . . . 1.0 106.649 167.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.08 144.9 28.75 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 103.706 -2.702 . . . . 1.0 103.706 167.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -128.28 141.03 51.56 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.745 -1.205 . . . . 1.0 107.745 174.1 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -131.77 140.57 49.25 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.688 1.195 . . . . 1.0 109.318 177.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -106.35 109.64 63.29 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 123.266 0.627 . . . . 1.0 112.283 -174.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -52.79 -27.33 33.91 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 124.129 3.22 . . . . 1.0 115.847 175.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -88.72 -19.12 26.51 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.558 1.143 . . . . 1.0 113.926 -173.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.0 p -129.84 -20.32 3.18 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 114.561 1.319 . . . . 1.0 114.561 -172.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.79 10.68 77.19 Favored Glycine 0 CA--C 1.537 1.456 0 CA-C-N 118.73 0.696 . . . . 1.0 114.145 -173.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -74.14 149.12 41.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.194 1.397 . . . . 1.0 109.426 170.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -133.13 154.23 39.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 C-N-CA 126.776 2.03 . . . . 1.0 109.0 173.081 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.15 168.65 10.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 127.456 2.303 . . . . 1.0 109.331 178.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -147.62 120.87 8.94 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 127.843 2.457 . . . . 1.0 109.27 173.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.27 155.21 42.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.086 0.954 . . . . 1.0 109.968 -178.447 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -96.04 10.57 37.06 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 120.88 -1.137 . . . . 1.0 112.023 176.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 124.77 -167.68 17.06 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 127.106 2.288 . . . . 1.0 112.969 -171.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.67 170.14 31.43 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 116.999 1.559 . . . . 1.0 116.999 170.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -57.03 103.15 0.1 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.452 2.301 . . . . 1.0 109.218 169.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -130.47 134.89 47.44 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.344 1.458 . . . . 1.0 110.243 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -52.44 -66.77 0.33 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 115.918 1.822 . . . . 1.0 115.918 -168.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 34.4 m -60.1 -40.93 91.36 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 119.41 1.004 . . . . 1.0 111.963 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.5 tp -57.55 -39.12 75.96 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.269 1.027 . . . . 1.0 111.765 176.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -68.6 -35.78 77.8 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.829 0.851 . . . . 1.0 112.502 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -67.0 -41.31 86.93 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.278 0.945 . . . . 1.0 110.838 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 34.6 m0 -61.71 -37.31 83.69 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.67 0.618 . . . . 1.0 112.67 175.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -65.16 -36.23 83.59 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.444 -0.785 . . . . 1.0 112.107 172.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.92 -48.27 69.17 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.724 0.774 . . . . 1.0 110.971 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -76.43 -34.12 58.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.384 1.474 . . . . 1.0 114.538 -169.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 13.4 m-90 -133.5 -47.84 0.82 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.053 1.131 . . . . 1.0 114.053 -175.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.08 153.47 6.05 Favored Glycine 0 N--CA 1.479 1.543 0 CA-C-N 119.226 0.921 . . . . 1.0 115.354 169.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.15 -33.08 82.88 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.281 2.654 . . . . 1.0 114.359 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -63.35 -46.54 86.11 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.716 0.807 . . . . 1.0 110.875 177.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.9 -53.31 59.87 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.331 1.452 . . . . 1.0 109.812 176.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 29.3 t -57.52 -47.7 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 C-N-CA 125.904 1.682 . . . . 1.0 111.981 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -66.15 -36.17 82.42 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.29 0.636 . . . . 1.0 112.563 173.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 64.4 m -66.63 -30.66 70.99 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.544 0.572 . . . . 1.0 112.544 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -75.89 -8.84 57.86 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.057 1.132 . . . . 1.0 114.057 173.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.52 168.98 16.41 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 124.218 1.961 . . . . 1.0 114.613 -173.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 89.8 m -142.98 139.63 30.71 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 129.851 3.26 . . . . 1.0 108.215 -176.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -97.43 126.75 42.87 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.376 1.071 . . . . 1.0 109.972 -177.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 85.9 mt . . . . . 0 CA--C 1.538 0.508 0 C-N-CA 125.92 1.688 . . . . 1.0 110.944 -177.109 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.121 0.01 . . . . 1.0 111.024 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -66.28 60.77 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.458 1.903 . . . . 1.0 113.737 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.0 mttt -55.32 137.2 48.22 Favored 'General case' 0 CA--C 1.523 -0.091 0 C-N-CA 128.854 2.862 . . . . 1.0 110.464 175.08 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 97.1 t -77.06 135.82 25.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 113.56 -1.654 . . . . 1.0 110.843 171.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.522 ' HG2' ' HB1' ' A' ' 120' ' ' ALA . 3.5 ttpt -116.32 121.8 43.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.627 -1.249 . . . . 1.0 107.627 167.271 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.01 147.07 35.0 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 105.239 -2.134 . . . . 1.0 105.239 168.517 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.459 ' CE1' ' HB2' ' A' ' 120' ' ' ALA . 68.3 m-85 -129.06 140.03 51.77 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.795 -1.187 . . . . 1.0 107.795 172.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -132.81 129.52 38.63 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.711 1.205 . . . . 1.0 109.659 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -95.03 110.91 52.62 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 123.074 0.55 . . . . 1.0 111.597 -172.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.97 -15.25 48.06 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.324 2.682 . . . . 1.0 114.36 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -89.24 -20.52 24.05 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.281 1.215 . . . . 1.0 114.281 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.1 p -130.03 -21.24 3.01 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 114.894 1.442 . . . . 1.0 114.894 -172.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.19 9.42 84.13 Favored Glycine 0 CA--C 1.54 1.596 0 CA-C-N 118.808 0.731 . . . . 1.0 114.373 -173.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -72.95 148.82 43.92 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.684 1.242 . . . . 1.0 109.524 170.162 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 t -133.03 153.4 37.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 C-N-CA 126.605 1.962 . . . . 1.0 109.501 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.08 168.7 10.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 127.458 2.303 . . . . 1.0 109.198 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -147.78 121.42 9.2 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 128.205 2.602 . . . . 1.0 108.996 173.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.32 155.66 42.79 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.773 0.829 . . . . 1.0 109.653 -178.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -96.79 6.13 49.27 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.225 1.01 . . . . 1.0 111.789 173.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 132.11 -165.05 23.66 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.855 2.169 . . . . 1.0 113.609 -175.317 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.84 170.74 26.43 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 123.461 1.589 . . . . 1.0 117.042 169.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -57.82 101.36 0.07 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.466 2.306 . . . . 1.0 109.014 169.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -130.4 126.36 36.86 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.719 1.608 . . . . 1.0 109.592 178.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -44.84 -67.17 0.31 Allowed 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 116.07 1.878 . . . . 1.0 116.07 -169.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.2 m -60.11 -40.98 91.56 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 119.212 0.914 . . . . 1.0 112.214 -175.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 41.1 tp -59.44 -39.04 82.29 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.23 1.012 . . . . 1.0 111.611 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -68.58 -32.62 72.66 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.753 0.821 . . . . 1.0 113.151 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -69.12 -42.68 75.74 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 119.593 1.088 . . . . 1.0 110.777 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -60.57 -36.91 79.64 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.668 0.618 . . . . 1.0 112.668 177.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.28 -36.53 84.39 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 121.475 -0.765 . . . . 1.0 112.526 172.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.35 -48.37 70.44 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.854 0.835 . . . . 1.0 111.087 176.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -76.31 -33.57 59.05 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.342 1.457 . . . . 1.0 114.58 -169.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.3 m-90 -133.47 -48.83 0.83 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.923 1.083 . . . . 1.0 113.923 -176.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 141.19 153.44 5.96 Favored Glycine 0 N--CA 1.477 1.421 0 CA-C-N 119.046 0.839 . . . . 1.0 115.041 169.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -62.6 -32.94 79.23 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.075 2.517 . . . . 1.0 114.378 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -61.94 -46.64 88.42 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.89 0.852 . . . . 1.0 111.15 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.61 -53.96 51.97 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.996 1.318 . . . . 1.0 109.836 176.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 34.4 t -57.74 -46.69 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 125.425 1.49 . . . . 1.0 112.077 -175.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -64.98 -37.66 88.39 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.354 0.662 . . . . 1.0 112.388 173.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 55.6 m -66.46 -30.14 70.42 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.163 0.585 . . . . 1.0 112.365 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -74.95 -10.02 59.08 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.979 1.103 . . . . 1.0 113.979 173.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.522 ' HB1' ' HG2' ' A' ' 83' ' ' LYS . . . -71.14 167.23 19.77 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 124.032 1.872 . . . . 1.0 114.501 -173.185 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 95.8 m -146.37 133.11 19.98 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 129.305 3.042 . . . . 1.0 108.466 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.8 tt -100.37 124.83 46.35 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.685 0.794 . . . . 1.0 110.016 -171.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 CA--C 1.533 0.31 0 C-N-CA 126.657 1.983 . . . . 1.0 111.056 -170.868 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 111.137 0.051 . . . . 1.0 111.137 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 61.2 mmt-85 -65.41 61.58 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 126.658 1.983 . . . . 1.0 113.482 176.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -54.51 132.8 45.53 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 128.45 2.7 . . . . 1.0 111.04 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 74.5 t -70.88 135.22 28.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 113.088 -1.869 . . . . 1.0 111.264 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.3 mttp -107.44 120.62 42.67 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.304 -1.739 . . . . 1.0 106.304 167.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.85 144.66 29.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 104.108 -2.553 . . . . 1.0 104.108 168.228 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -127.24 140.17 52.41 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.994 -1.113 . . . . 1.0 107.994 173.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -132.08 130.95 41.91 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.7 1.2 . . . . 1.0 109.704 178.39 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -97.63 110.95 57.31 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 122.777 0.431 . . . . 1.0 111.31 -173.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -66.32 -14.63 45.05 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.45 2.767 . . . . 1.0 114.666 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -88.63 -17.63 29.67 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.726 1.21 . . . . 1.0 114.219 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 40.0 p -129.75 -23.56 2.82 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 114.534 1.309 . . . . 1.0 114.534 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.87 7.48 87.43 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.294 0.949 . . . . 1.0 114.234 -172.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.44 156.44 29.39 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.098 1.449 . . . . 1.0 110.976 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -136.37 154.11 32.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 126.681 1.992 . . . . 1.0 109.632 179.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.88 168.01 11.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 127.672 2.389 . . . . 1.0 109.525 177.453 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -147.03 120.76 9.21 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.585 2.354 . . . . 1.0 109.481 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.32 151.33 37.33 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.753 0.821 . . . . 1.0 109.685 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -95.17 10.13 37.07 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.1 -1.0 . . . . 1.0 111.826 176.061 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 129.33 -166.09 21.77 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 126.982 2.229 . . . . 1.0 113.093 -172.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.68 169.16 22.39 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 117.195 1.638 . . . . 1.0 117.195 170.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -57.66 100.99 0.06 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.717 2.407 . . . . 1.0 109.2 169.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.8 t60 -130.5 130.74 44.56 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.623 1.569 . . . . 1.0 109.939 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -49.52 -66.96 0.31 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.647 1.721 . . . . 1.0 115.647 -168.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.5 m -60.01 -40.94 90.96 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 119.323 0.965 . . . . 1.0 111.911 -175.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.9 tp -58.89 -38.39 78.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.014 0.926 . . . . 1.0 111.756 177.147 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.05 -36.33 79.7 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.574 0.75 . . . . 1.0 112.281 175.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.92 -42.14 85.87 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.102 0.865 . . . . 1.0 110.839 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.3 m0 -62.17 -38.03 87.52 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.587 0.588 . . . . 1.0 112.587 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.7 -33.87 76.87 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.535 -0.728 . . . . 1.0 112.181 172.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.48 -49.27 56.36 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.435 0.636 . . . . 1.0 111.451 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -74.24 -34.13 63.56 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.204 1.802 . . . . 1.0 114.67 -169.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.7 m-90 -133.05 -46.5 0.85 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.574 0.953 . . . . 1.0 113.574 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.42 153.84 6.32 Favored Glycine 0 N--CA 1.48 1.613 0 C-N-CA 123.849 0.738 . . . . 1.0 114.871 170.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.32 -33.59 89.02 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 122.98 2.453 . . . . 1.0 113.67 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -61.26 -45.88 92.65 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.987 0.899 . . . . 1.0 111.387 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.86 -55.16 37.58 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.218 -1.355 . . . . 1.0 109.923 175.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.6 t -57.3 -47.78 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 C-N-CA 125.59 1.556 . . . . 1.0 111.997 -175.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -67.28 -34.61 77.77 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.936 -0.477 . . . . 1.0 112.263 176.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.2 t -65.96 -33.99 77.09 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.73 -0.606 . . . . 1.0 112.234 177.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -71.5 -11.93 61.12 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.031 1.123 . . . . 1.0 114.031 174.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.82 168.71 16.18 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 124.117 1.913 . . . . 1.0 115.116 -170.302 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 79.5 m -142.26 141.83 32.51 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 130.107 3.363 . . . . 1.0 108.323 -177.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.3 tt -104.44 120.54 41.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.374 1.07 . . . . 1.0 110.206 -176.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 74.9 mt . . . . . 0 CA--C 1.54 0.579 0 C-N-CA 127.3 2.24 . . . . 1.0 110.92 -175.752 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.386 0.136 . . . . 1.0 111.264 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 31.4 mmt-85 -67.81 58.73 0.07 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 126.813 2.045 . . . . 1.0 113.077 175.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.8 mttt -55.54 131.26 45.73 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 128.769 2.828 . . . . 1.0 111.08 178.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 85.7 t -73.77 134.48 29.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 113.629 -1.623 . . . . 1.0 111.433 173.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.8 mttp -108.54 122.92 48.07 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 106.577 -1.638 . . . . 1.0 106.577 167.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.27 145.59 28.22 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 104.442 -2.429 . . . . 1.0 104.442 168.079 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -128.39 142.29 51.15 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.199 -1.037 . . . . 1.0 108.199 173.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -132.74 139.74 47.75 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.938 1.295 . . . . 1.0 109.485 177.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -106.82 109.75 63.28 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 123.234 0.614 . . . . 1.0 112.483 -173.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -53.36 -26.67 36.07 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.269 3.312 . . . . 1.0 115.957 176.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -88.99 -18.79 26.68 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.52 1.128 . . . . 1.0 113.996 -174.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.9 p -129.54 -19.76 3.36 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.49 1.292 . . . . 1.0 114.49 -172.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.61 11.44 72.74 Favored Glycine 0 CA--C 1.54 1.647 0 CA-C-N 118.741 0.7 . . . . 1.0 114.159 -173.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -75.32 149.61 38.69 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.39 1.476 . . . . 1.0 109.4 171.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.5 t -132.47 154.75 40.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 126.754 2.022 . . . . 1.0 109.035 172.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.89 167.69 12.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 127.318 2.247 . . . . 1.0 109.384 177.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -146.84 120.31 9.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 127.483 2.313 . . . . 1.0 108.888 173.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.22 153.58 41.49 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.75 0.82 . . . . 1.0 109.588 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.4 mttp -95.72 9.05 41.71 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.1 -1.0 . . . . 1.0 111.573 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.84 -166.68 20.4 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 127.238 2.352 . . . . 1.0 113.202 -171.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.92 169.16 27.1 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 117.272 1.669 . . . . 1.0 117.272 169.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -57.64 101.42 0.07 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 127.708 2.403 . . . . 1.0 108.944 169.426 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -130.66 130.2 43.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.478 1.511 . . . . 1.0 109.625 178.015 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -48.68 -65.52 0.55 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 115.971 1.841 . . . . 1.0 115.971 -169.042 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 44.3 m -62.22 -39.22 92.08 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 119.266 0.939 . . . . 1.0 111.925 -175.468 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.5 tp -59.67 -39.44 84.51 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.773 0.829 . . . . 1.0 111.72 176.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -67.41 -35.83 80.06 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.664 0.786 . . . . 1.0 112.485 175.014 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -67.2 -43.87 81.05 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.06 0.846 . . . . 1.0 110.271 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.8 m0 -60.22 -38.54 83.7 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.73 -0.668 . . . . 1.0 112.487 176.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -65.18 -34.54 78.62 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.512 -0.742 . . . . 1.0 112.53 172.063 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.86 -49.85 59.81 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.804 0.812 . . . . 1.0 111.191 176.511 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -75.58 -34.13 60.64 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.859 1.664 . . . . 1.0 114.822 -169.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.6 m-90 -132.75 -47.01 0.87 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 113.651 0.982 . . . . 1.0 113.651 -176.046 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.01 154.01 6.28 Favored Glycine 0 N--CA 1.479 1.507 0 CA-C-N 118.944 0.793 . . . . 1.0 114.967 169.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -61.76 -33.83 84.46 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.075 2.517 . . . . 1.0 113.928 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -60.9 -45.96 92.55 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 122.07 0.938 . . . . 1.0 111.376 177.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.69 -54.97 40.23 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.182 -1.372 . . . . 1.0 109.916 175.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.2 t -58.11 -47.82 86.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 125.694 1.598 . . . . 1.0 111.786 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.14 -35.29 79.41 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.127 0.571 . . . . 1.0 112.157 176.34 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.3 t -65.43 -34.01 77.29 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.079 0.552 . . . . 1.0 112.189 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 24.3 m0 -72.28 -10.06 59.29 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.963 1.097 . . . . 1.0 113.963 174.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.45 168.46 17.45 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 124.172 1.939 . . . . 1.0 115.045 -172.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 92.8 m -144.14 142.81 30.79 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 130.133 3.373 . . . . 1.0 107.812 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -107.92 123.55 48.78 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.893 0.877 . . . . 1.0 109.767 -176.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.7 mt . . . . . 0 CA--C 1.54 0.572 0 C-N-CA 126.758 2.023 . . . . 1.0 110.69 -172.869 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 111.13 0.048 . . . . 1.0 111.13 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.6 mmp_? -65.59 57.37 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 127.268 2.227 . . . . 1.0 114.191 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -56.59 127.97 33.94 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 128.795 2.838 . . . . 1.0 110.221 175.517 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.6 t -70.65 133.86 31.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 113.62 -1.627 . . . . 1.0 110.646 174.083 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -108.09 121.87 45.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.529 -1.656 . . . . 1.0 106.529 168.016 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.63 144.46 28.58 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 103.694 -2.706 . . . . 1.0 103.694 167.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -127.66 140.36 52.13 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 107.691 -1.226 . . . . 1.0 107.691 174.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -131.83 139.25 48.79 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.848 1.259 . . . . 1.0 109.462 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -105.63 110.38 64.17 Favored Pre-proline 0 CA--C 1.544 0.713 0 N-CA-C 112.413 0.523 . . . . 1.0 112.413 -173.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo -52.73 -27.5 34.14 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 124.338 3.359 . . . . 1.0 115.87 176.114 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -87.97 -17.24 31.71 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.833 1.253 . . . . 1.0 114.273 -174.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.4 p -129.9 -22.1 2.95 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.114 1.153 . . . . 1.0 114.114 -174.508 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.01 7.52 81.75 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 124.09 0.852 . . . . 1.0 114.443 -172.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -77.45 156.49 31.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.011 1.406 . . . . 1.0 110.681 173.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.0 t -136.11 155.29 34.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 C-N-CA 126.986 2.115 . . . . 1.0 109.536 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.47 168.42 10.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 127.85 2.46 . . . . 1.0 109.404 177.322 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -147.48 121.84 9.65 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.757 2.423 . . . . 1.0 109.023 173.258 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.64 156.68 43.38 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.931 0.892 . . . . 1.0 109.972 -178.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -96.37 9.51 41.01 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.893 -1.129 . . . . 1.0 112.101 175.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 125.24 -167.56 17.57 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 127.186 2.327 . . . . 1.0 112.969 -171.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.1 170.07 32.68 Favored Glycine 0 CA--C 1.537 1.467 0 N-CA-C 117.082 1.593 . . . . 1.0 117.082 169.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -57.33 101.38 0.07 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.703 2.401 . . . . 1.0 108.945 169.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -130.68 133.95 46.52 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.121 1.369 . . . . 1.0 110.638 178.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -45.33 -70.55 0.1 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 125.895 1.678 . . . . 1.0 115.408 -169.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.4 m -61.04 -41.21 96.15 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.571 0.748 . . . . 1.0 111.949 -175.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 40.0 tp -58.44 -39.54 80.12 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.099 0.96 . . . . 1.0 111.69 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -69.72 -32.52 71.13 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.778 0.831 . . . . 1.0 112.965 175.224 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -68.44 -43.17 77.68 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.798 1.181 . . . . 1.0 111.221 175.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -61.56 -35.43 77.75 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.678 0.622 . . . . 1.0 112.678 178.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.76 -36.53 83.83 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 121.515 -0.741 . . . . 1.0 112.514 171.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.7 -48.45 69.24 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.826 0.822 . . . . 1.0 110.818 176.609 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.94 -32.84 59.74 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.657 1.583 . . . . 1.0 114.448 -169.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -134.87 -50.17 0.76 Allowed 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.008 1.114 . . . . 1.0 114.008 -176.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.2 153.87 6.02 Favored Glycine 0 N--CA 1.477 1.385 0 CA-C-N 119.315 0.962 . . . . 1.0 115.458 169.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.47 -33.24 79.65 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.264 2.643 . . . . 1.0 114.262 -178.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -63.76 -46.71 84.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.927 0.87 . . . . 1.0 110.887 177.669 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.08 -53.45 58.06 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.223 1.409 . . . . 1.0 110.197 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 25.7 t -57.43 -48.07 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 125.769 1.628 . . . . 1.0 111.804 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.7 -35.79 80.97 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.574 0.583 . . . . 1.0 112.574 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 21.9 t -65.73 -33.44 75.88 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.228 0.611 . . . . 1.0 112.067 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -72.75 -10.97 60.41 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.012 1.116 . . . . 1.0 114.012 174.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.88 169.25 15.12 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 124.321 2.01 . . . . 1.0 114.86 -172.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.0 m -143.67 142.26 30.92 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 130.148 3.379 . . . . 1.0 107.711 -176.586 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.1 tt -106.98 123.04 47.61 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.067 0.947 . . . . 1.0 109.586 -175.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.4 mt . . . . . 0 CA--C 1.537 0.479 0 C-N-CA 126.424 1.89 . . . . 1.0 110.888 -172.981 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 111.326 0.121 . . . . 1.0 111.326 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 51.9 mmt-85 -65.41 66.77 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 126.277 1.831 . . . . 1.0 112.637 175.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 44.8 mttt -62.94 137.33 58.24 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 128.934 2.894 . . . . 1.0 110.575 178.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 87.8 t -76.37 136.14 25.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 C-N-CA 125.723 1.609 . . . . 1.0 111.309 172.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -109.63 122.56 47.74 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 106.179 -1.786 . . . . 1.0 106.179 167.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.21 145.27 28.43 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 104.269 -2.493 . . . . 1.0 104.269 168.265 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -127.36 141.76 51.61 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.028 -1.101 . . . . 1.0 108.028 172.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -133.28 137.43 46.02 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.884 1.274 . . . . 1.0 109.041 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -107.45 110.89 63.13 Favored Pre-proline 0 CA--C 1.548 0.888 0 N-CA-C 112.417 0.525 . . . . 1.0 112.417 -172.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -53.19 -27.22 36.74 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 124.636 3.557 . . . . 1.0 115.593 175.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -89.05 -15.08 34.9 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.119 1.368 . . . . 1.0 114.575 -174.384 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.6 p -128.93 -21.83 3.28 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.351 1.061 . . . . 1.0 113.831 -176.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.77 9.75 79.39 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.577 1.084 . . . . 1.0 114.023 -172.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -83.47 158.89 21.87 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.03 1.415 . . . . 1.0 110.853 175.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -136.74 155.51 33.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 C-N-CA 126.96 2.104 . . . . 1.0 109.577 178.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.99 168.53 9.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 127.468 2.307 . . . . 1.0 109.29 178.206 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -147.22 121.66 9.69 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.685 2.394 . . . . 1.0 109.287 173.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.25 153.61 40.78 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.851 0.861 . . . . 1.0 109.727 -179.392 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 33.7 mttp -97.06 10.75 38.44 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.875 -1.141 . . . . 1.0 111.5 174.155 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.98 -165.53 21.73 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 127.253 2.358 . . . . 1.0 113.133 -173.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.12 168.9 23.81 Favored Glycine 0 CA--C 1.537 1.433 0 CA-C-O 123.5 1.611 . . . . 1.0 117.054 170.035 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -57.72 101.9 0.08 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 127.498 2.319 . . . . 1.0 109.093 169.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -130.51 123.7 30.24 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.497 1.519 . . . . 1.0 109.711 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -43.94 -65.37 0.51 Allowed 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 115.486 1.662 . . . . 1.0 115.486 -169.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.7 m -58.69 -41.59 86.59 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 119.379 0.99 . . . . 1.0 112.454 -176.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.2 tp -60.97 -37.9 84.06 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.058 0.943 . . . . 1.0 111.457 177.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -69.5 -32.79 71.87 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.533 0.733 . . . . 1.0 112.773 174.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.03 -42.1 76.82 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.823 1.192 . . . . 1.0 110.973 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -62.39 -37.65 86.57 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.554 0.576 . . . . 1.0 112.554 177.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -65.67 -32.06 73.42 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.668 -0.645 . . . . 1.0 112.332 172.149 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.36 -51.4 24.35 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.434 0.635 . . . . 1.0 110.968 176.348 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HE3' ' CH2' ' A' ' 111' ' ' TRP . 47.1 mtmt -74.68 -29.06 61.09 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 115.309 1.596 . . . . 1.0 115.309 -169.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.432 ' CH2' ' HE3' ' A' ' 110' ' ' LYS . 16.5 m-90 -134.76 -47.51 0.74 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.176 1.176 . . . . 1.0 114.176 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.1 154.18 6.31 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 119.09 0.859 . . . . 1.0 114.942 170.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -61.03 -33.95 91.18 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.268 2.645 . . . . 1.0 113.759 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -61.41 -45.82 92.73 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.877 0.846 . . . . 1.0 111.238 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.74 -55.11 38.36 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 114.326 -1.306 . . . . 1.0 110.073 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 32.9 t -57.42 -48.24 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 125.819 1.648 . . . . 1.0 111.923 -174.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -66.94 -34.7 78.35 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.085 0.554 . . . . 1.0 112.147 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.6 m -67.58 -30.45 70.06 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 112.641 0.608 . . . . 1.0 112.641 178.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 17.9 m0 -74.55 -10.97 60.07 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.212 1.19 . . . . 1.0 114.212 173.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.7 168.46 16.51 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 124.091 1.901 . . . . 1.0 114.823 -170.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 99.6 m -142.95 143.19 31.87 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 130.133 3.373 . . . . 1.0 107.909 -176.186 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.69 122.91 47.31 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.082 0.953 . . . . 1.0 109.818 -176.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 CA--C 1.539 0.542 0 C-N-CA 126.651 1.98 . . . . 1.0 110.52 -174.413 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 111.275 0.102 . . . . 1.0 111.275 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 36.7 mmt-85 -66.74 59.57 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 126.627 1.971 . . . . 1.0 113.053 174.477 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.7 mttt -54.05 133.01 43.67 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 128.744 2.817 . . . . 1.0 111.152 178.047 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.1 t -75.6 135.05 27.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 113.45 -1.704 . . . . 1.0 111.607 172.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.0 mttp -110.18 123.55 49.97 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 106.928 -1.508 . . . . 1.0 106.928 167.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -83.94 145.4 28.58 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 104.414 -2.439 . . . . 1.0 104.414 168.115 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -128.48 142.65 51.02 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.04 -1.096 . . . . 1.0 108.04 173.081 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -132.71 140.85 48.29 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.711 1.204 . . . . 1.0 109.467 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -107.81 109.57 62.26 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 123.077 0.551 . . . . 1.0 112.271 -173.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -53.28 -26.89 36.2 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 124.57 3.513 . . . . 1.0 115.785 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -88.68 -18.82 27.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.506 1.122 . . . . 1.0 113.928 -174.218 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 47.0 p -129.64 -19.85 3.31 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 114.543 1.312 . . . . 1.0 114.543 -172.471 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.88 11.53 73.99 Favored Glycine 0 CA--C 1.538 1.473 0 C-N-CA 123.879 0.752 . . . . 1.0 114.276 -173.155 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -75.72 149.82 37.98 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.176 1.39 . . . . 1.0 109.454 171.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -132.94 154.73 40.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 126.802 2.041 . . . . 1.0 108.962 172.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.84 168.15 11.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 127.45 2.3 . . . . 1.0 109.448 178.003 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -147.0 121.1 9.44 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 127.844 2.458 . . . . 1.0 109.097 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.71 152.58 39.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.73 0.812 . . . . 1.0 109.826 -178.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -93.06 7.57 43.61 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 120.921 -1.112 . . . . 1.0 111.988 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.77 -166.44 21.26 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 126.989 2.233 . . . . 1.0 113.133 -171.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.66 169.66 27.16 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-O 123.366 1.537 . . . . 1.0 116.807 169.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -57.26 103.0 0.1 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.533 2.333 . . . . 1.0 108.92 169.302 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -130.64 131.87 45.14 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.275 1.43 . . . . 1.0 110.161 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -48.96 -67.46 0.26 Allowed 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 115.909 1.818 . . . . 1.0 115.909 -168.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 34.1 m -59.95 -41.02 90.97 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 119.008 0.822 . . . . 1.0 111.893 -176.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.1 tp -58.53 -38.94 78.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.085 0.954 . . . . 1.0 111.571 177.354 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -68.54 -35.81 77.95 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.686 0.794 . . . . 1.0 112.352 175.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -66.79 -42.11 86.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.368 0.986 . . . . 1.0 110.744 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -61.47 -38.79 88.53 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.5 0.555 . . . . 1.0 112.5 176.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -65.06 -34.48 78.52 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.424 -0.797 . . . . 1.0 112.081 173.129 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.65 -48.74 63.25 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.737 0.779 . . . . 1.0 111.388 176.174 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.62 -33.89 60.53 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.773 1.629 . . . . 1.0 114.822 -169.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.4 m-90 -133.23 -45.89 0.84 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.814 1.042 . . . . 1.0 113.814 -176.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.64 154.23 6.39 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-N 119.073 0.851 . . . . 1.0 115.223 169.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.62 -34.47 84.41 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.063 2.509 . . . . 1.0 113.795 178.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -60.57 -45.87 92.34 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 122.072 0.939 . . . . 1.0 111.357 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.85 -54.84 41.52 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.017 -1.447 . . . . 1.0 110.067 175.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.9 t -57.91 -47.67 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 125.528 1.531 . . . . 1.0 112.201 -175.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -67.04 -35.21 79.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.95 0.5 . . . . 1.0 112.232 175.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.6 t -65.38 -33.99 77.26 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.688 -0.633 . . . . 1.0 112.331 177.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.6 m0 -72.63 -9.6 58.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.994 1.109 . . . . 1.0 113.994 174.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.51 168.29 16.56 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 124.041 1.877 . . . . 1.0 114.893 -173.272 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 89.7 m -143.89 138.92 28.91 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 129.79 3.236 . . . . 1.0 108.157 -176.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 30.8 tp -98.63 127.64 44.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.335 1.054 . . . . 1.0 109.718 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.5 mt . . . . . 0 CA--C 1.533 0.317 0 C-N-CA 125.999 1.72 . . . . 1.0 110.878 -176.376 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 111.689 0.255 . . . . 1.0 111.689 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.1 mmp_? -69.31 58.32 0.11 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.731 2.013 . . . . 1.0 113.518 174.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -53.42 128.19 27.74 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 128.22 2.608 . . . . 1.0 110.179 174.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.8 t -72.3 134.39 29.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 113.633 -1.621 . . . . 1.0 110.521 171.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -108.33 121.57 45.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.516 -1.661 . . . . 1.0 106.516 167.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.81 143.82 28.85 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 103.896 -2.631 . . . . 1.0 103.896 167.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -127.66 139.96 52.39 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.761 -1.199 . . . . 1.0 107.761 175.065 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.48 140.0 49.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.546 1.139 . . . . 1.0 108.986 177.395 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -105.57 109.89 63.68 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 112.542 0.571 . . . . 1.0 112.542 -174.555 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -52.96 -26.77 32.9 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.18 3.253 . . . . 1.0 115.878 176.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -87.65 -17.44 31.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.883 1.273 . . . . 1.0 114.232 -174.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.3 p -129.79 -22.59 2.92 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 114.028 1.122 . . . . 1.0 114.028 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.42 8.78 80.94 Favored Glycine 0 CA--C 1.539 1.554 0 C-N-CA 124.048 0.832 . . . . 1.0 114.352 -172.477 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.32 156.0 29.83 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 119.061 1.43 . . . . 1.0 110.506 172.521 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -135.83 155.52 36.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 C-N-CA 126.917 2.087 . . . . 1.0 109.563 178.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.69 168.1 10.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 127.689 2.396 . . . . 1.0 109.261 177.741 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -146.92 122.01 10.11 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 127.772 2.429 . . . . 1.0 109.288 172.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.08 156.4 42.98 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.919 0.888 . . . . 1.0 109.861 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.0 mttp -97.13 10.34 39.64 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.038 -1.039 . . . . 1.0 111.986 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 124.98 -166.65 17.6 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 127.253 2.359 . . . . 1.0 112.858 -171.375 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.5 169.52 29.72 Favored Glycine 0 CA--C 1.537 1.408 0 N-CA-C 117.405 1.722 . . . . 1.0 117.405 169.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -57.74 100.37 0.05 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.607 2.363 . . . . 1.0 109.265 169.367 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -130.43 130.96 44.96 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.446 1.498 . . . . 1.0 109.75 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -47.17 -67.09 0.31 Allowed 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 115.501 1.667 . . . . 1.0 115.501 -168.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.7 m -60.15 -41.02 91.87 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 119.29 0.95 . . . . 1.0 112.083 -174.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 46.4 tp -59.28 -39.52 83.19 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.243 1.017 . . . . 1.0 111.522 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -68.84 -32.44 72.12 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 113.193 0.812 . . . . 1.0 113.193 175.09 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.33 -42.99 74.6 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 119.422 1.01 . . . . 1.0 110.858 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -61.53 -35.66 78.36 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.761 0.652 . . . . 1.0 112.761 177.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -65.13 -36.91 85.76 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 121.39 -0.819 . . . . 1.0 112.696 171.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.92 -48.26 69.18 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.703 0.763 . . . . 1.0 110.863 176.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -76.07 -32.89 59.48 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.568 1.547 . . . . 1.0 114.415 -169.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -135.0 -49.76 0.75 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.019 1.118 . . . . 1.0 114.019 -176.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.44 153.62 5.95 Favored Glycine 0 N--CA 1.48 1.577 0 CA-C-N 119.416 1.007 . . . . 1.0 115.353 169.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.1 -33.24 82.91 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.26 2.64 . . . . 1.0 114.328 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -63.11 -46.76 85.82 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 122.009 0.909 . . . . 1.0 110.966 177.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.64 -53.56 57.02 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.065 1.346 . . . . 1.0 110.032 176.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 27.7 t -57.15 -48.24 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.991 1.717 . . . . 1.0 111.81 -176.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -66.24 -36.01 81.9 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.076 0.551 . . . . 1.0 112.442 174.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.7 m -67.12 -30.58 70.62 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.644 0.609 . . . . 1.0 112.644 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 23.0 m0 -75.05 -10.04 59.1 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.805 1.039 . . . . 1.0 113.805 173.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.98 168.77 16.29 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 124.375 2.036 . . . . 1.0 114.689 -172.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.5 m -141.99 141.07 32.86 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 130.156 3.382 . . . . 1.0 107.736 -177.396 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.3 tt -104.98 121.72 44.33 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.928 0.891 . . . . 1.0 109.787 -175.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 CA--C 1.537 0.468 0 C-N-CA 126.395 1.878 . . . . 1.0 110.917 -174.431 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 120.414 0.15 . . . . 1.0 111.34 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 28.1 mmt-85 -68.57 57.19 0.08 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 126.458 1.903 . . . . 1.0 113.001 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.2 mttt -54.39 131.08 41.48 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 128.915 2.886 . . . . 1.0 111.041 177.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.3 t -73.58 134.17 30.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 113.607 -1.633 . . . . 1.0 111.59 172.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -107.97 121.91 45.75 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.703 -1.592 . . . . 1.0 106.703 167.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.09 143.98 29.35 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 104.055 -2.572 . . . . 1.0 104.055 167.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -127.06 141.71 51.71 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.925 -1.139 . . . . 1.0 107.925 173.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.84 141.59 49.47 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.794 1.238 . . . . 1.0 109.149 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -108.32 110.14 61.75 Favored Pre-proline 0 CA--C 1.548 0.899 0 N-CA-C 112.658 0.614 . . . . 1.0 112.658 -173.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -52.69 -27.52 33.96 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.417 3.411 . . . . 1.0 116.04 174.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -88.57 -19.86 25.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.85 1.26 . . . . 1.0 114.286 -174.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.8 p -127.57 -19.93 4.08 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.726 1.009 . . . . 1.0 113.726 -173.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.95 8.22 77.6 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.062 0.839 . . . . 1.0 114.151 -172.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -80.62 157.0 26.12 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 119.055 1.428 . . . . 1.0 110.892 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.49 155.11 33.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 C-N-CA 126.746 2.018 . . . . 1.0 109.332 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.26 168.83 10.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 127.463 2.305 . . . . 1.0 109.601 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -146.65 122.63 10.71 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 127.885 2.474 . . . . 1.0 109.407 171.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.01 155.27 42.69 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.949 0.9 . . . . 1.0 110.085 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -95.64 8.75 42.52 Favored 'General case' 0 N--CA 1.48 1.075 0 O-C-N 120.94 -1.1 . . . . 1.0 111.884 174.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.07 -164.76 20.52 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 127.15 2.31 . . . . 1.0 113.112 -171.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.59 168.87 21.32 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 117.018 1.567 . . . . 1.0 117.018 170.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -57.22 101.73 0.07 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.403 2.281 . . . . 1.0 108.763 169.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -130.25 128.48 41.71 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.13 1.372 . . . . 1.0 109.783 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 31.2 tttt -46.41 -65.92 0.48 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.958 1.836 . . . . 1.0 115.958 -168.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.0 m -59.49 -41.76 90.6 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 119.175 0.898 . . . . 1.0 112.204 -177.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.3 tp -59.92 -38.83 83.45 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.109 0.964 . . . . 1.0 111.574 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -68.86 -32.07 71.48 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.7 0.8 . . . . 1.0 112.973 174.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -68.46 -43.16 77.6 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.623 1.101 . . . . 1.0 110.907 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -62.78 -36.18 82.26 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.509 0.559 . . . . 1.0 112.509 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -65.09 -36.28 83.81 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.404 -0.81 . . . . 1.0 112.413 171.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.78 -48.62 68.47 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.597 0.713 . . . . 1.0 110.914 176.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -69.78 -37.43 76.35 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.561 1.544 . . . . 1.0 113.407 -171.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 11.7 m-90 -134.12 -55.82 0.86 Allowed 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.66 0.985 . . . . 1.0 113.66 -175.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 149.78 156.71 7.36 Favored Glycine 0 CA--C 1.537 1.43 0 CA-C-N 119.062 0.846 . . . . 1.0 114.932 172.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.57 -30.98 71.1 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.054 2.503 . . . . 1.0 114.158 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -62.54 -46.2 89.47 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.037 0.922 . . . . 1.0 111.181 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.38 -52.95 63.43 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 125.051 1.34 . . . . 1.0 109.972 176.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.7 t -58.01 -47.49 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 125.848 1.659 . . . . 1.0 111.669 -175.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.77 -37.64 88.3 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.675 0.79 . . . . 1.0 112.274 173.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.3 m -66.05 -29.72 70.12 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.009 0.523 . . . . 1.0 112.288 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 13.3 m0 -78.97 -6.19 55.67 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.085 1.143 . . . . 1.0 114.085 173.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.49 169.12 16.09 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 124.133 1.921 . . . . 1.0 114.624 -173.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 83.1 m -144.6 138.51 27.48 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 129.606 3.162 . . . . 1.0 108.156 -176.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -96.95 126.22 41.94 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.369 1.067 . . . . 1.0 109.81 -177.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.4 mt -125.21 122.28 36.57 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.947 1.699 . . . . 1.0 110.926 -177.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -64.99 -30.32 77.7 Favored Glycine 0 CA--C 1.537 1.456 0 CA-C-N 115.114 -0.948 . . . . 1.0 114.283 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 . . . . . 0 C--O 1.256 1.434 0 C-N-CA 127.616 2.367 . . . . 1.0 113.735 -179.878 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.898 0 O4'-C4'-C3' 109.328 3.728 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.153 0 O4'-C4'-C3' 108.669 3.069 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.267 0 O4'-C4'-C3' 109.475 3.875 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.602 0 O5'-C5'-C4' 114.137 2.812 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.314 0 O4'-C4'-C3' 108.755 3.155 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.971 0 O4'-C4'-C3' 109.143 3.543 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.629 0 O4'-C1'-N19 110.822 3.778 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 0 O5'-C5'-C4' 114.465 3.047 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.972 1 O4'-C4'-C3' 109.735 4.135 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.734 0 P-O3'-C3' 123.444 3.12 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.811 0 O4'-C4'-C3' 109.183 3.583 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.347 0 O4'-C1'-N19 110.145 2.931 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.956 0 O4'-C4'-C3' 108.654 3.054 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.209 0 O5'-C5'-C4' 114.793 3.281 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.402 1 O4'-C1'-N19 111.157 4.197 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.789 0 P-O3'-C3' 123.416 3.096 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.298 0 O4'-C1'-N19 110.155 2.944 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.887 0 O5'-C5'-C4' 113.932 2.666 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.698 0 P-O3'-C3' 123.649 3.291 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.716 1 C5'-C4'-C3' 106.554 -5.43 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.483 0 O4'-C4'-C3' 108.035 2.435 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.416 1 O4'-C1'-N19 111.445 4.556 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.815 0 O4'-C4'-C3' 109.011 3.411 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.371 1 O4'-C1'-N19 111.246 4.308 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 111.265 0.098 . . . . 1.0 111.265 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 47.0 mmt-85 -65.32 62.25 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 126.783 2.033 . . . . 1.0 112.942 173.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -54.95 133.75 48.39 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 128.636 2.775 . . . . 1.0 110.91 177.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 95.1 t -75.12 135.83 26.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 113.445 -1.707 . . . . 1.0 111.019 171.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.1 mttp -111.09 124.39 52.09 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.681 -1.6 . . . . 1.0 106.681 167.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.04 145.86 28.26 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 104.599 -2.371 . . . . 1.0 104.599 167.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -128.96 141.47 51.25 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.73 -1.211 . . . . 1.0 107.73 173.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -132.82 139.63 47.59 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.897 1.279 . . . . 1.0 109.157 178.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -106.7 109.7 63.27 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.002 0.521 . . . . 1.0 112.275 -174.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -52.5 -27.97 34.3 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.325 3.35 . . . . 1.0 115.808 175.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -86.29 -17.27 35.06 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.218 1.192 . . . . 1.0 114.218 -174.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.3 p -129.85 -22.45 2.92 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.046 1.128 . . . . 1.0 114.046 -174.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.4 7.73 82.97 Favored Glycine 0 CA--C 1.538 1.527 0 C-N-CA 124.308 0.956 . . . . 1.0 114.274 -172.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.08 156.82 29.8 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.071 1.436 . . . . 1.0 110.698 173.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.94 155.01 32.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 126.912 2.085 . . . . 1.0 109.55 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.38 168.38 10.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 C-N-CA 127.621 2.369 . . . . 1.0 109.299 177.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -147.51 121.46 9.38 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 127.715 2.406 . . . . 1.0 109.139 173.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.94 151.45 37.03 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.833 0.853 . . . . 1.0 109.977 -178.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -90.32 7.71 37.08 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 120.952 -1.093 . . . . 1.0 112.443 174.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.63 -165.34 21.53 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 126.66 2.076 . . . . 1.0 113.414 -172.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.39 170.29 27.48 Favored Glycine 0 CA--C 1.537 1.414 0 N-CA-C 117.071 1.588 . . . . 1.0 117.071 169.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -57.96 102.56 0.1 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.382 2.273 . . . . 1.0 108.667 169.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -130.3 132.99 46.14 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.121 1.368 . . . . 1.0 109.747 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.5 tttt -50.39 -66.34 0.41 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.677 1.732 . . . . 1.0 115.677 -168.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 40.8 m -60.46 -41.66 94.61 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 119.301 0.955 . . . . 1.0 112.032 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 46.0 tp -58.49 -38.26 77.27 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.154 0.981 . . . . 1.0 111.62 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -69.05 -36.06 77.26 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.971 0.908 . . . . 1.0 112.358 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -66.45 -42.03 88.24 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.463 1.029 . . . . 1.0 110.444 178.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -61.92 -37.95 86.58 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.454 0.539 . . . . 1.0 112.454 177.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -65.52 -34.8 79.1 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.489 -0.757 . . . . 1.0 112.175 172.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.63 -49.04 62.35 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.537 0.684 . . . . 1.0 111.317 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -74.79 -33.74 62.29 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.909 1.683 . . . . 1.0 114.58 -169.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.1 m-90 -133.41 -47.99 0.83 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.7 1.0 . . . . 1.0 113.7 -176.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.54 154.17 6.18 Favored Glycine 0 N--CA 1.478 1.436 0 N-CA-C 115.047 0.779 . . . . 1.0 115.047 169.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -61.17 -35.06 87.76 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.111 2.541 . . . . 1.0 114.051 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.4 -45.62 93.56 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.722 0.773 . . . . 1.0 111.449 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.81 -54.92 40.66 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.138 -1.392 . . . . 1.0 109.831 175.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 32.5 t -57.7 -48.34 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.62 1.568 . . . . 1.0 112.06 -174.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -66.42 -35.25 79.84 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.11 0.564 . . . . 1.0 111.906 175.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.9 m -67.81 -30.19 69.54 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.67 -0.644 . . . . 1.0 112.608 178.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.2 m0 -74.2 -10.16 59.33 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.776 1.028 . . . . 1.0 113.776 173.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.73 168.47 16.53 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 124.048 1.88 . . . . 1.0 114.707 -172.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 87.2 m -144.0 138.7 28.59 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 129.6 3.16 . . . . 1.0 107.895 -175.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -99.03 127.03 44.87 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.373 1.069 . . . . 1.0 109.657 -176.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.4 mt -125.18 117.53 24.07 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.039 1.736 . . . . 1.0 111.34 -175.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -83.63 -12.67 77.4 Favored Glycine 0 CA--C 1.537 1.459 0 CA-C-N 114.918 -1.037 . . . . 1.0 115.257 -176.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 77.7 t60 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 126.152 1.781 . . . . 1.0 111.082 179.154 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.852 0 O4'-C4'-C3' 109.105 3.505 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.741 0 O5'-C5'-C4' 114.436 3.026 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.377 0 O4'-C4'-C3' 109.304 3.704 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.336 0 O4'-C4'-C3' 108.493 2.893 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.068 0 O4'-C4'-C3' 108.655 3.055 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.888 0 O4'-C4'-C3' 108.973 3.373 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.476 1 O4'-C1'-N19 111.121 4.151 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.115 0 O5'-C5'-C4' 114.494 3.067 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.936 1 O4'-C4'-C3' 109.817 4.217 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.372 0 O4'-C4'-C3' 108.658 3.058 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.576 0 O4'-C4'-C3' 109.064 3.464 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.576 0 O4'-C1'-N19 110.501 3.376 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.751 0 O4'-C4'-C3' 108.497 2.897 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.172 0 O5'-C5'-C4' 114.858 3.327 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.188 0 O4'-C1'-N19 110.925 3.906 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.825 0 P-O3'-C3' 123.293 2.994 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.143 0 O4'-C4'-C3' 108.56 2.96 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.913 0 O5'-C5'-C4' 113.977 2.698 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.568 -2.544 0 P-O3'-C3' 123.836 3.447 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.356 1 C5'-C4'-C3' 107.981 -4.479 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.463 0 O5'-C5'-C4' 113.101 2.072 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.205 1 O4'-C1'-N19 111.542 4.677 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.694 0 O4'-C4'-C3' 109.166 3.566 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.292 1 O4'-C1'-N19 111.491 4.614 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 111.173 0.064 . . . . 1.0 111.173 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.0 mmt85 -66.47 61.36 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 126.448 1.899 . . . . 1.0 113.661 176.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -54.83 130.1 39.75 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 128.855 2.862 . . . . 1.0 110.549 177.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 83.1 t -71.69 133.2 32.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 113.683 -1.599 . . . . 1.0 111.01 173.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -106.56 120.94 43.26 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.442 -1.688 . . . . 1.0 106.442 167.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.16 144.06 29.24 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 103.899 -2.63 . . . . 1.0 103.899 167.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -127.24 139.4 52.95 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.791 -1.188 . . . . 1.0 107.791 175.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -131.78 139.49 48.94 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.678 1.191 . . . . 1.0 109.256 176.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -105.79 110.52 64.23 Favored Pre-proline 0 CA--C 1.545 0.761 0 N-CA-C 112.337 0.495 . . . . 1.0 112.337 -174.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -52.81 -27.79 35.94 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 124.441 3.427 . . . . 1.0 115.728 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -87.35 -17.22 32.89 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.777 1.231 . . . . 1.0 114.185 -174.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.1 p -130.2 -21.83 2.89 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.247 1.203 . . . . 1.0 114.247 -174.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.1 8.74 79.43 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.434 1.016 . . . . 1.0 114.295 -172.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -78.42 156.48 29.4 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.072 1.436 . . . . 1.0 110.727 172.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.5 t -136.41 154.99 33.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 126.907 2.083 . . . . 1.0 109.733 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.86 168.77 8.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 127.795 2.438 . . . . 1.0 109.558 177.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -147.26 121.49 9.55 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.762 2.425 . . . . 1.0 109.273 173.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.83 153.55 39.32 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.579 0.752 . . . . 1.0 109.913 -179.181 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -95.52 6.24 49.48 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.515 1.126 . . . . 1.0 111.927 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 131.38 -166.41 22.88 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 127.229 2.347 . . . . 1.0 113.515 -173.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.04 170.79 27.33 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-O 123.627 1.682 . . . . 1.0 117.301 169.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -57.58 100.45 0.05 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 127.938 2.495 . . . . 1.0 109.202 169.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -130.64 133.17 45.91 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.685 1.594 . . . . 1.0 110.139 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -50.55 -67.27 0.27 Allowed 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 115.875 1.805 . . . . 1.0 115.875 -168.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 37.4 m -59.7 -41.01 89.8 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 119.254 0.933 . . . . 1.0 112.056 -175.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 47.6 tp -58.57 -39.07 79.28 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.46 1.104 . . . . 1.0 111.694 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -68.09 -36.02 79.12 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.813 0.845 . . . . 1.0 112.292 175.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.94 -41.86 86.27 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.308 0.958 . . . . 1.0 110.752 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -63.02 -36.06 82.31 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.69 0.626 . . . . 1.0 112.69 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.2 -36.37 83.99 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.428 -0.795 . . . . 1.0 112.396 171.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.87 -48.08 67.08 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.303 0.573 . . . . 1.0 111.085 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -76.54 -33.61 58.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.633 1.573 . . . . 1.0 114.254 -169.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.0 m-90 -134.11 -46.92 0.78 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.108 1.151 . . . . 1.0 114.108 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.39 154.2 6.29 Favored Glycine 0 N--CA 1.479 1.561 0 CA-C-N 119.292 0.951 . . . . 1.0 115.318 169.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -62.88 -31.91 77.37 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.218 2.612 . . . . 1.0 113.93 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -63.1 -46.63 86.43 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.906 0.882 . . . . 1.0 111.016 176.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.99 -53.67 55.78 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 125.174 1.39 . . . . 1.0 109.89 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 24.9 t -56.85 -47.82 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 126.059 1.744 . . . . 1.0 111.771 -176.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -67.99 -34.57 76.78 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.419 0.526 . . . . 1.0 112.419 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.8 m -67.09 -31.76 72.46 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.829 0.677 . . . . 1.0 112.829 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -74.63 -11.38 60.18 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.21 1.189 . . . . 1.0 114.21 174.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.43 168.99 14.96 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 124.245 1.974 . . . . 1.0 115.131 -170.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.7 m -142.24 142.73 32.64 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 130.157 3.383 . . . . 1.0 107.636 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.2 tt -108.11 122.59 47.21 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.82 0.848 . . . . 1.0 109.409 -174.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt -120.47 125.96 49.19 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.489 1.916 . . . . 1.0 110.814 -172.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -91.37 -9.26 63.45 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 124.393 0.997 . . . . 1.0 115.2 -173.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.186 0 C-N-CA 125.728 1.611 . . . . 1.0 112.025 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.912 0 O4'-C4'-C3' 109.079 3.479 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.085 0 O5'-C5'-C4' 114.437 3.026 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.238 0 O4'-C4'-C3' 109.17 3.57 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.297 0 O4'-C4'-C3' 108.639 3.039 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.355 0 O4'-C4'-C3' 108.447 2.847 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.421 0 O5'-C5'-C4' 114.651 3.179 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.622 2.922 0 P-O3'-C3' 124.056 3.63 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.055 0 O5'-C5'-C4' 114.858 3.327 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.022 1 O4'-C4'-C3' 109.804 4.204 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.661 0 O4'-C1'-N19 110.248 3.06 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.766 0 O4'-C4'-C3' 108.818 3.218 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.145 0 O4'-C1'-N19 110.166 2.957 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.791 0 O4'-C4'-C3' 108.541 2.941 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.822 0 O5'-C5'-C4' 115.142 3.53 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.145 1 O4'-C1'-N19 111.105 4.131 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.711 0 P-O3'-C3' 123.519 3.182 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.303 0 O4'-C1'-N19 110.239 3.049 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.926 0 O5'-C5'-C4' 114.035 2.739 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.617 0 P-O3'-C3' 123.865 3.471 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.333 1 C5'-C4'-C3' 106.882 -5.212 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.043 0 O4'-C4'-C3' 108.29 2.69 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.437 1 O4'-C1'-N19 111.188 4.235 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.542 0 O4'-C4'-C3' 109.319 3.719 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.058 1 O4'-C1'-N19 111.226 4.282 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 111.231 0.085 . . . . 1.0 111.231 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -67.41 58.81 0.05 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 126.654 1.982 . . . . 1.0 113.077 175.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.9 mttt -54.43 132.46 44.44 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 128.814 2.846 . . . . 1.0 111.48 177.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.0 t -75.14 134.77 28.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 113.403 -1.726 . . . . 1.0 111.574 173.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -109.61 123.13 48.92 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 106.96 -1.496 . . . . 1.0 106.96 167.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.13 143.9 29.38 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 104.287 -2.486 . . . . 1.0 104.287 168.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -123.55 136.01 54.31 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.257 -1.386 . . . . 1.0 107.257 173.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -135.3 97.4 3.7 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.246 1.018 . . . . 1.0 109.886 -169.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -72.09 119.52 75.02 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.465 1.106 . . . . 1.0 112.864 -169.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.1 -20.0 22.2 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 123.678 2.918 . . . . 1.0 114.239 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -83.91 -22.07 31.69 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.575 1.15 . . . . 1.0 113.793 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 62.6 p -127.42 -22.89 3.59 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.156 1.169 . . . . 1.0 114.156 -172.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.8 4.88 77.88 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-O 118.932 -0.927 . . . . 1.0 114.144 -171.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -74.13 155.45 38.41 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.46 1.63 . . . . 1.0 110.607 171.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 5.1 t -137.74 153.04 27.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 113.358 -1.746 . . . . 1.0 109.262 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.06 169.21 12.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 126.924 2.09 . . . . 1.0 109.122 177.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -147.44 121.52 9.46 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 127.537 2.335 . . . . 1.0 109.14 173.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.93 154.14 41.6 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.911 0.884 . . . . 1.0 109.756 -179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -95.41 8.79 42.16 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.109 -0.995 . . . . 1.0 112.002 174.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.38 -165.42 21.3 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 127.126 2.298 . . . . 1.0 113.335 -172.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.78 169.6 23.82 Favored Glycine 0 CA--C 1.537 1.453 0 N-CA-C 117.445 1.738 . . . . 1.0 117.445 169.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -57.76 101.25 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.559 2.344 . . . . 1.0 109.056 169.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -130.37 131.03 45.12 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.634 1.573 . . . . 1.0 109.839 178.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -49.39 -66.85 0.33 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.577 1.695 . . . . 1.0 115.577 -168.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.0 m -60.36 -40.39 90.57 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 119.36 0.982 . . . . 1.0 112.207 -175.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.7 tp -58.86 -38.47 78.86 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.334 1.053 . . . . 1.0 111.801 176.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.01 -36.51 80.09 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.476 0.711 . . . . 1.0 112.528 174.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.82 -41.98 86.61 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.296 0.953 . . . . 1.0 110.786 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -61.94 -38.41 88.38 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.532 0.568 . . . . 1.0 112.532 177.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -64.84 -34.77 79.16 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.529 -0.732 . . . . 1.0 112.177 172.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.61 -49.07 62.11 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.623 0.725 . . . . 1.0 110.945 176.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -73.22 -35.68 66.34 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.082 1.753 . . . . 1.0 114.425 -169.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.1 m-90 -132.81 -47.5 0.87 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.695 0.998 . . . . 1.0 113.695 -175.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.3 155.21 6.57 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.995 0.816 . . . . 1.0 114.676 169.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -61.77 -34.25 83.38 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.073 2.515 . . . . 1.0 113.788 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -61.12 -45.5 94.44 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 122.07 0.938 . . . . 1.0 111.339 177.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.47 -54.92 41.03 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 114.125 -1.398 . . . . 1.0 109.975 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.3 t -58.08 -46.32 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 125.448 1.499 . . . . 1.0 112.246 -174.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.0 -34.81 78.55 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.876 -0.515 . . . . 1.0 112.295 175.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.5 t -66.03 -32.38 73.82 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.622 -0.674 . . . . 1.0 112.339 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 27.9 m0 -73.37 -5.52 40.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.904 1.282 . . . . 1.0 113.663 173.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -75.16 168.48 19.9 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 124.151 1.929 . . . . 1.0 114.706 -175.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 84.0 m -147.86 139.72 24.01 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 130.134 3.373 . . . . 1.0 107.674 -176.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 30.3 tp -99.24 127.07 45.18 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.315 1.046 . . . . 1.0 109.786 -177.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.5 mt -124.37 122.01 36.51 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.175 1.79 . . . . 1.0 110.993 -176.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -77.54 -15.83 80.95 Favored Glycine 0 CA--C 1.539 1.551 0 CA-C-N 115.019 -0.991 . . . . 1.0 115.391 -174.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 41.5 m80 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 126.222 1.809 . . . . 1.0 111.318 -179.851 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.795 0 O4'-C4'-C3' 109.134 3.534 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.069 0 O5'-C5'-C4' 114.61 3.15 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.562 0 O4'-C4'-C3' 109.216 3.616 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.519 0 O4'-C4'-C3' 108.542 2.942 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.131 0 O4'-C4'-C3' 108.622 3.022 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.128 0 O4'-C4'-C3' 108.958 3.358 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.789 0 O4'-C1'-N19 110.99 3.988 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.185 0 O5'-C5'-C4' 114.471 3.051 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.233 1 O4'-C4'-C3' 109.846 4.246 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.592 0 O4'-C1'-N19 110.327 3.159 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.73 0 O4'-C4'-C3' 109.062 3.462 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.282 0 O4'-C1'-N19 110.025 2.781 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.927 0 O4'-C1'-N19 110.3 3.125 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.237 0 O5'-C5'-C4' 114.98 3.415 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.314 0 O4'-C1'-N19 110.837 3.796 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.858 0 P-O3'-C3' 123.393 3.077 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.25 0 O4'-C1'-N19 110.323 3.154 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.065 0 O5'-C5'-C4' 113.774 2.553 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.713 0 P-O3'-C3' 124.042 3.618 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.15 1 C5'-C4'-C3' 107.138 -5.041 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.584 0 O4'-C4'-C3' 107.721 2.121 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.462 1 O4'-C1'-N19 111.395 4.494 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.796 0 O4'-C4'-C3' 109.283 3.683 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.049 1 O4'-C1'-N19 111.215 4.269 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 120.807 0.337 . . . . 1.0 111.652 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.4 mmt-85 -60.0 63.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 127.936 2.494 . . . . 1.0 113.083 170.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.6 mtpt -51.48 135.86 26.96 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 128.956 2.903 . . . . 1.0 112.038 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.4 t -75.69 135.53 26.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 112.936 -1.938 . . . . 1.0 110.642 169.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -111.03 123.47 50.25 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.521 -1.659 . . . . 1.0 106.521 167.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -83.47 145.08 29.15 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 104.209 -2.515 . . . . 1.0 104.209 168.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -127.61 140.27 52.21 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 107.668 -1.234 . . . . 1.0 107.668 172.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -131.7 131.1 42.8 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.42 1.088 . . . . 1.0 109.736 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -96.81 110.1 51.83 Favored Pre-proline 0 CA--C 1.543 0.696 0 C-N-CA 123.043 0.537 . . . . 1.0 111.784 -173.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -65.48 -15.56 50.18 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.583 2.855 . . . . 1.0 114.312 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -88.88 -17.48 29.54 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 114.444 1.276 . . . . 1.0 114.444 178.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 38.5 p -129.72 -22.77 2.93 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 114.481 1.289 . . . . 1.0 114.481 -175.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.51 7.2 87.11 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 124.359 0.98 . . . . 1.0 114.36 -172.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.18 156.08 30.04 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.211 1.505 . . . . 1.0 110.785 173.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.12 153.66 32.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 C-N-CA 126.695 1.998 . . . . 1.0 109.635 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.68 167.74 12.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 127.626 2.371 . . . . 1.0 109.193 177.215 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -146.8 121.57 9.89 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.752 2.421 . . . . 1.0 109.279 173.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.84 152.01 38.02 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.683 0.793 . . . . 1.0 109.904 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -92.1 7.93 40.17 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 121.069 -1.019 . . . . 1.0 112.116 174.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 130.36 -166.01 22.43 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 126.702 2.096 . . . . 1.0 113.432 -173.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.99 170.34 26.27 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 117.196 1.638 . . . . 1.0 117.196 169.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -57.71 100.42 0.05 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.698 2.399 . . . . 1.0 109.015 169.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -130.52 128.04 40.35 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.559 1.544 . . . . 1.0 109.764 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -44.25 -68.29 0.21 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.386 1.624 . . . . 1.0 115.386 -168.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.8 m -59.83 -41.68 91.87 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 119.185 0.902 . . . . 1.0 112.17 -174.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.5 tp -59.27 -38.89 81.23 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.146 0.979 . . . . 1.0 111.545 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.0 mmmt -69.75 -32.46 71.0 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 118.527 -0.749 . . . . 1.0 112.965 175.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -69.12 -42.44 76.04 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.514 1.052 . . . . 1.0 110.922 176.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -61.49 -37.35 83.35 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.685 0.624 . . . . 1.0 112.685 178.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -66.09 -34.45 78.08 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.548 -0.72 . . . . 1.0 112.38 172.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.53 -48.73 63.56 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.824 0.821 . . . . 1.0 111.236 175.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -74.54 -34.15 62.9 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.941 1.697 . . . . 1.0 114.567 -169.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 17.1 m-90 -132.75 -48.06 0.88 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 113.78 1.03 . . . . 1.0 113.78 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.57 153.75 6.07 Favored Glycine 0 N--CA 1.476 1.333 0 CA-C-N 118.908 0.776 . . . . 1.0 114.648 169.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.61 -34.68 84.03 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.061 2.507 . . . . 1.0 113.806 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.24 -45.3 95.09 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.986 0.898 . . . . 1.0 111.124 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.18 -55.98 27.21 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.263 -1.335 . . . . 1.0 109.72 175.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 38.9 t -57.87 -46.55 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 125.466 1.506 . . . . 1.0 112.111 -174.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -67.27 -35.69 80.04 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.86 -0.525 . . . . 1.0 112.048 176.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.3 t -65.63 -34.04 77.3 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.72 -0.613 . . . . 1.0 112.217 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 25.6 m0 -70.72 -11.53 61.0 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.027 1.121 . . . . 1.0 114.027 174.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.95 168.32 17.22 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 124.141 1.924 . . . . 1.0 114.76 -171.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 88.5 m -143.58 136.55 27.62 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 129.314 3.045 . . . . 1.0 108.243 -176.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 38.6 tp -96.03 126.54 41.34 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.254 1.022 . . . . 1.0 110.115 -176.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.9 mt -126.07 117.28 22.86 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.654 1.582 . . . . 1.0 110.812 -175.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -82.76 -11.76 81.09 Favored Glycine 0 CA--C 1.539 1.556 0 CA-C-N 115.074 -0.966 . . . . 1.0 115.084 -175.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 11.7 p-80 . . . . . 0 C--O 1.253 1.269 0 C-N-CA 126.347 1.859 . . . . 1.0 112.093 176.81 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.686 0 O4'-C4'-C3' 109.135 3.535 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.965 0 O5'-C5'-C4' 114.353 2.966 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.194 0 O4'-C4'-C3' 109.257 3.657 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.703 0 O4'-C4'-C3' 108.486 2.886 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.144 0 O4'-C4'-C3' 108.738 3.138 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.215 0 O4'-C4'-C3' 109.026 3.426 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.509 1 O4'-C1'-N19 111.802 5.002 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.17 0 O5'-C5'-C4' 114.705 3.218 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.935 1 O4'-C4'-C3' 109.632 4.032 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.364 0 O4'-C1'-N19 110.448 3.311 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.568 0 O4'-C4'-C3' 108.897 3.297 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.25 0 O4'-C1'-N19 110.202 3.002 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 0 O4'-C1'-N19 110.523 3.404 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.963 0 O5'-C5'-C4' 114.946 3.39 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.341 0 O4'-C1'-N19 110.833 3.791 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.97 0 P-O3'-C3' 123.366 3.055 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.623 2.984 0 O4'-C4'-C3' 108.628 3.028 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.999 0 O5'-C5'-C4' 113.926 2.661 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.564 -2.926 0 P-O3'-C3' 124.185 3.737 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.345 2 O4'-C1'-N19 111.449 4.561 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.502 0 O4'-C4'-C3' 107.807 2.207 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.395 1 O4'-C1'-N19 111.769 4.961 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.761 0 O4'-C4'-C3' 109.282 3.682 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.142 1 O4'-C1'-N19 111.46 4.575 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 119.845 -0.121 . . . . 1.0 110.81 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.0 mmp_? -63.45 59.25 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 127.432 2.293 . . . . 1.0 114.465 175.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -55.02 131.04 43.98 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 128.8 2.84 . . . . 1.0 110.395 174.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 85.0 t -74.26 133.86 30.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 113.437 -1.71 . . . . 1.0 111.315 173.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.4 mttp -107.77 122.17 46.2 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 106.505 -1.665 . . . . 1.0 106.505 167.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.04 145.17 28.63 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 104.32 -2.474 . . . . 1.0 104.32 168.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -128.06 142.84 51.1 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.158 -1.052 . . . . 1.0 108.158 172.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -132.68 141.08 48.43 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.046 1.338 . . . . 1.0 109.576 177.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -108.13 109.12 61.82 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 123.119 0.567 . . . . 1.0 112.496 -173.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -53.28 -26.8 35.81 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.36 3.374 . . . . 1.0 115.603 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -87.91 -19.6 27.1 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.475 1.11 . . . . 1.0 113.731 -174.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 45.9 p -129.97 -19.45 3.24 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.563 1.319 . . . . 1.0 114.563 -171.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.12 11.69 75.17 Favored Glycine 0 CA--C 1.539 1.57 0 C-N-CA 124.002 0.81 . . . . 1.0 114.215 -173.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -75.89 150.74 37.51 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.429 1.492 . . . . 1.0 109.405 171.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -133.08 155.09 40.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 C-N-CA 126.506 1.923 . . . . 1.0 108.936 172.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.7 167.9 12.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 127.537 2.335 . . . . 1.0 109.267 177.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -146.96 121.14 9.5 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 127.653 2.381 . . . . 1.0 108.92 173.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.0 154.54 42.65 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.825 0.85 . . . . 1.0 109.937 -178.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -95.67 9.83 38.97 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 121.118 -0.989 . . . . 1.0 111.856 174.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 126.1 -166.38 18.89 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 127.086 2.279 . . . . 1.0 113.396 -172.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.05 170.12 29.35 Favored Glycine 0 CA--C 1.535 1.311 0 N-CA-C 117.481 1.752 . . . . 1.0 117.481 169.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -57.49 100.02 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 128.119 2.568 . . . . 1.0 109.147 169.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.3 t60 -130.4 136.9 49.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.344 1.458 . . . . 1.0 110.69 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -49.99 -70.92 0.07 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 125.525 1.53 . . . . 1.0 114.809 -169.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.0 m -60.5 -40.68 92.26 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 118.918 0.781 . . . . 1.0 111.87 -173.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.96 -39.34 77.88 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.282 1.033 . . . . 1.0 111.725 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.82 -36.05 77.73 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.493 0.717 . . . . 1.0 112.407 175.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -67.27 -42.37 83.97 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.248 0.931 . . . . 1.0 110.977 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -61.37 -38.6 87.59 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.821 0.675 . . . . 1.0 112.821 176.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -64.74 -34.9 79.42 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.694 -0.628 . . . . 1.0 112.148 173.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.27 -48.74 64.21 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.645 0.736 . . . . 1.0 110.978 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.58 -34.63 60.66 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.658 1.583 . . . . 1.0 114.79 -169.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.7 m-90 -132.01 -48.15 0.94 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.832 1.049 . . . . 1.0 113.832 -176.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.96 153.94 6.17 Favored Glycine 0 N--CA 1.479 1.557 0 CA-C-N 118.908 0.776 . . . . 1.0 114.856 169.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -61.51 -34.5 85.47 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.945 2.43 . . . . 1.0 113.959 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -60.96 -45.94 92.73 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 122.032 0.92 . . . . 1.0 111.248 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.91 -54.74 42.65 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.296 -1.32 . . . . 1.0 109.922 176.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.4 t -57.87 -47.34 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 125.594 1.557 . . . . 1.0 112.074 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -66.92 -35.59 80.33 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.273 0.629 . . . . 1.0 112.163 175.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.5 m -66.47 -30.07 70.33 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 118.537 0.608 . . . . 1.0 112.514 178.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 19.2 m0 -75.6 -8.89 57.92 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.057 1.132 . . . . 1.0 114.057 173.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.1 168.81 16.34 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 124.118 1.913 . . . . 1.0 114.939 -172.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 91.4 m -144.54 142.92 30.56 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 130.177 3.391 . . . . 1.0 108.161 -176.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.96 123.6 48.41 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.025 0.93 . . . . 1.0 109.703 -176.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.8 mt -121.66 129.02 52.5 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.744 2.018 . . . . 1.0 110.77 -173.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -75.71 -18.92 79.48 Favored Glycine 0 CA--C 1.538 1.527 0 CA-C-N 115.222 -0.899 . . . . 1.0 115.283 -173.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.103 0 C-N-CA 125.904 1.682 . . . . 1.0 112.291 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.746 0 O4'-C4'-C3' 109.009 3.409 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.197 0 O5'-C5'-C4' 114.643 3.174 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.561 0 O4'-C4'-C3' 109.44 3.84 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.543 0 O4'-C4'-C3' 108.811 3.211 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.361 0 O4'-C4'-C3' 108.796 3.196 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.236 0 O5'-C5'-C4' 114.838 3.313 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.658 0 P-O3'-C3' 124.095 3.662 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.196 0 O5'-C5'-C4' 114.815 3.296 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.116 0 O4'-C4'-C3' 109.425 3.825 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.407 0 O4'-C4'-C3' 108.786 3.186 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.541 0 O4'-C4'-C3' 109.086 3.486 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.216 0 O4'-C1'-N19 110.468 3.335 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.823 0 O4'-C4'-C3' 108.656 3.056 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.191 0 O5'-C5'-C4' 115.138 3.527 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.094 0 O4'-C1'-N19 110.918 3.898 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.836 0 P-O3'-C3' 123.251 2.959 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.22 0 O4'-C4'-C3' 108.51 2.91 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.035 0 O5'-C5'-C4' 114.144 2.817 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.669 0 P-O3'-C3' 123.991 3.576 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.277 2 C5'-C4'-C3' 107.819 -4.587 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.311 0 O4'-C4'-C3' 107.904 2.304 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.749 1 O4'-C1'-N19 111.435 4.543 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.663 0 O4'-C4'-C3' 109.271 3.671 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.225 1 O4'-C1'-N19 111.24 4.299 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 120.336 0.112 . . . . 1.0 111.03 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 44.8 mmt-85 -67.47 61.51 0.06 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 126.392 1.877 . . . . 1.0 112.806 174.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -55.21 132.72 48.33 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 128.739 2.816 . . . . 1.0 111.207 178.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 84.3 t -74.02 134.12 30.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 113.411 -1.722 . . . . 1.0 111.78 173.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -108.0 123.13 48.19 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 106.379 -1.711 . . . . 1.0 106.379 167.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.4 145.24 28.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 104.38 -2.452 . . . . 1.0 104.38 168.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -127.5 141.83 51.55 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.027 -1.101 . . . . 1.0 108.027 172.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -133.04 139.1 47.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.629 1.172 . . . . 1.0 109.27 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.8 t-20 -106.08 110.51 64.07 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 112.372 0.508 . . . . 1.0 112.372 -173.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -52.96 -28.27 39.04 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 124.469 3.446 . . . . 1.0 115.793 175.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -86.34 -17.88 33.35 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.32 1.23 . . . . 1.0 114.32 -174.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.1 p -129.27 -22.8 3.06 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 114.0 1.111 . . . . 1.0 114.0 -173.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.37 8.31 83.56 Favored Glycine 0 CA--C 1.538 1.531 0 C-N-CA 124.265 0.936 . . . . 1.0 114.175 -172.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -79.18 157.12 27.93 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 123.137 1.446 . . . . 1.0 110.683 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.1 t -136.65 154.6 32.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 C-N-CA 127.149 2.18 . . . . 1.0 109.496 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.14 167.72 11.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 127.335 2.254 . . . . 1.0 109.301 177.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -146.99 120.58 9.12 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 127.674 2.389 . . . . 1.0 109.206 174.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.58 153.07 39.93 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.707 0.803 . . . . 1.0 109.93 -179.122 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -95.36 7.33 46.53 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.332 1.053 . . . . 1.0 111.609 176.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 130.82 -166.76 22.46 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 127.006 2.241 . . . . 1.0 113.444 -172.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.41 170.2 23.4 Favored Glycine 0 CA--C 1.536 1.398 0 N-CA-C 117.505 1.762 . . . . 1.0 117.505 170.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -57.6 100.91 0.06 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.728 2.411 . . . . 1.0 108.984 169.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -130.51 131.79 45.28 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.378 1.471 . . . . 1.0 109.875 177.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -48.72 -67.68 0.25 Allowed 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.767 1.766 . . . . 1.0 115.767 -168.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 36.9 m -59.72 -41.29 90.53 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-N 119.194 0.907 . . . . 1.0 112.084 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.9 tp -58.45 -39.12 79.0 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.939 0.896 . . . . 1.0 111.736 177.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -68.34 -35.81 78.32 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.35 0.66 . . . . 1.0 112.293 175.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -67.15 -42.02 85.05 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.366 0.984 . . . . 1.0 110.779 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -62.52 -37.82 87.53 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.606 0.595 . . . . 1.0 112.606 177.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -65.44 -34.3 77.96 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.701 -0.624 . . . . 1.0 112.528 172.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.14 -48.99 60.92 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.505 0.669 . . . . 1.0 111.17 176.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -74.53 -34.69 63.06 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.087 1.755 . . . . 1.0 114.587 -169.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.0 m-90 -132.89 -46.11 0.86 Allowed 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.847 1.054 . . . . 1.0 113.847 -176.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.46 153.9 6.33 Favored Glycine 0 N--CA 1.479 1.505 0 CA-C-N 118.94 0.791 . . . . 1.0 115.024 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -61.75 -33.35 85.71 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.947 2.431 . . . . 1.0 113.949 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -61.18 -45.98 92.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.836 0.826 . . . . 1.0 111.316 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.87 -54.94 40.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.107 1.363 . . . . 1.0 109.967 175.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.9 t -57.98 -47.91 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 125.577 1.551 . . . . 1.0 111.889 -174.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -67.09 -34.89 78.62 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.918 -0.489 . . . . 1.0 112.098 176.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.2 m -67.39 -30.3 70.04 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.667 -0.645 . . . . 1.0 112.572 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.3 m0 -74.41 -10.77 59.9 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.04 1.126 . . . . 1.0 114.04 173.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.65 168.39 17.79 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 124.213 1.959 . . . . 1.0 114.809 -171.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 93.4 m -144.21 142.44 30.51 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 130.083 3.353 . . . . 1.0 107.91 -175.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -107.24 124.13 49.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.925 0.89 . . . . 1.0 109.624 -176.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.6 mt -120.97 127.98 52.3 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.524 1.93 . . . . 1.0 110.962 -173.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -81.73 -14.88 76.91 Favored Glycine 0 CA--C 1.536 1.358 0 N-CA-C 115.377 0.911 . . . . 1.0 115.377 -174.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.217 0 C-N-CA 125.979 1.711 . . . . 1.0 112.075 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.027 0 O4'-C4'-C3' 109.119 3.519 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.015 0 O5'-C5'-C4' 114.308 2.934 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.338 0 O4'-C4'-C3' 109.322 3.722 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.486 0 O4'-C4'-C3' 108.447 2.847 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.261 0 O4'-C4'-C3' 108.928 3.328 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.947 0 O5'-C5'-C4' 114.838 3.313 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.676 0 O4'-C1'-N19 110.615 3.519 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.942 0 O5'-C5'-C4' 115.192 3.565 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.993 1 O4'-C4'-C3' 109.822 4.222 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.708 0 O4'-C1'-N19 110.308 3.135 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.312 0 O4'-C4'-C3' 109.026 3.426 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.019 0 O4'-C1'-N19 109.897 2.621 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.866 0 O4'-C4'-C3' 108.518 2.918 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.997 0 O5'-C5'-C4' 114.917 3.369 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.06 0 O4'-C1'-N19 110.932 3.914 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.921 0 P-O3'-C3' 123.4 3.083 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.179 0 O4'-C1'-N19 110.248 3.061 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.737 0 O5'-C5'-C4' 114.136 2.812 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.753 0 P-O3'-C3' 123.891 3.493 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.226 1 C5'-C4'-C3' 107.417 -4.855 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.664 0 O4'-C4'-C3' 107.665 2.065 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.373 1 O4'-C1'-N19 111.543 4.679 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.452 0 O4'-C4'-C3' 109.192 3.592 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.222 1 O4'-C1'-N19 111.176 4.22 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.386 0.136 . . . . 1.0 111.253 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.5 mmt-85 -69.03 56.25 0.09 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 126.667 1.987 . . . . 1.0 113.168 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -56.05 128.92 37.72 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 128.594 2.757 . . . . 1.0 110.715 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 91.2 t -71.98 135.21 28.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 113.618 -1.628 . . . . 1.0 110.801 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -109.31 121.72 45.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 106.691 -1.596 . . . . 1.0 106.691 167.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.01 144.11 29.33 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 103.887 -2.634 . . . . 1.0 103.887 167.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -127.38 140.03 52.45 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.87 -1.159 . . . . 1.0 107.87 174.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -131.75 134.78 46.23 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.738 1.215 . . . . 1.0 109.616 178.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -99.82 110.41 59.03 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 123.209 0.604 . . . . 1.0 111.651 -173.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -66.37 -14.83 45.85 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.181 2.588 . . . . 1.0 114.3 -179.179 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -89.17 -20.77 23.8 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.599 1.16 . . . . 1.0 114.084 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.6 p -129.99 -20.98 3.05 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.24 1.57 . . . . 1.0 115.24 -171.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.33 10.71 82.14 Favored Glycine 0 CA--C 1.541 1.696 0 C-N-CA 123.857 0.742 . . . . 1.0 114.302 -173.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -74.06 148.76 41.61 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.181 1.392 . . . . 1.0 109.273 170.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.8 t -132.19 154.74 40.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 C-N-CA 126.362 1.865 . . . . 1.0 108.974 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.43 168.08 10.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 127.53 2.332 . . . . 1.0 109.417 177.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -147.21 120.26 8.81 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.808 2.443 . . . . 1.0 109.174 173.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.98 157.79 43.87 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.16 0.984 . . . . 1.0 109.98 -178.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -99.07 11.59 38.57 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 120.792 -1.192 . . . . 1.0 111.855 176.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 123.71 -167.01 16.03 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 127.165 2.317 . . . . 1.0 112.971 -171.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.23 169.5 32.03 Favored Glycine 0 CA--C 1.536 1.393 0 N-CA-C 117.329 1.692 . . . . 1.0 117.329 169.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -57.7 99.3 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 128.057 2.543 . . . . 1.0 109.14 169.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -130.55 132.87 45.8 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.345 1.458 . . . . 1.0 110.583 178.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.7 tppt? -44.83 -71.24 0.08 Allowed 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 125.747 1.619 . . . . 1.0 114.995 -169.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.8 m -61.45 -40.06 93.11 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 118.532 0.605 . . . . 1.0 111.947 -173.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.7 tp -58.25 -40.4 81.68 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.259 1.024 . . . . 1.0 111.488 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -69.65 -32.2 70.72 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.681 0.792 . . . . 1.0 112.982 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.95 -42.59 76.45 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.619 1.1 . . . . 1.0 111.225 176.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.0 m0 -61.14 -36.69 80.44 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.627 0.603 . . . . 1.0 112.627 177.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -65.11 -36.47 84.39 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.424 -0.798 . . . . 1.0 112.611 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.24 -48.01 71.91 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.472 0.653 . . . . 1.0 110.989 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -76.27 -34.05 59.13 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.304 1.442 . . . . 1.0 114.64 -169.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.6 m-90 -134.02 -48.26 0.79 Allowed 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.942 1.089 . . . . 1.0 113.942 -176.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.7 153.73 6.06 Favored Glycine 0 N--CA 1.48 1.627 0 CA-C-N 119.34 0.973 . . . . 1.0 115.265 169.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.57 -33.34 78.42 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 123.212 2.608 . . . . 1.0 114.214 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -62.85 -46.79 86.25 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 122.168 0.985 . . . . 1.0 111.042 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.78 -53.66 55.91 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.313 1.445 . . . . 1.0 109.935 176.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 28.1 t -57.29 -47.79 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 125.774 1.629 . . . . 1.0 111.778 -175.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.89 -36.0 82.2 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.3 0.64 . . . . 1.0 112.562 174.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.2 m -66.84 -30.75 71.02 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.585 0.587 . . . . 1.0 112.585 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 16.2 m0 -75.83 -8.78 57.7 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.947 1.091 . . . . 1.0 113.947 173.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.7 168.9 16.78 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 124.032 1.872 . . . . 1.0 114.831 -172.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 94.9 m -142.53 141.74 32.12 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 130.521 3.529 . . . . 1.0 107.632 -176.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.08 123.32 47.83 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.779 0.832 . . . . 1.0 109.64 -175.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.4 mt -121.44 129.13 52.8 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.525 1.93 . . . . 1.0 110.927 -173.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -76.88 -17.45 79.82 Favored Glycine 0 CA--C 1.538 1.508 0 CA-C-N 115.219 -0.901 . . . . 1.0 115.277 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.251 1.142 0 C-N-CA 126.306 1.842 . . . . 1.0 111.004 179.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.006 0 O4'-C4'-C3' 109.239 3.639 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.205 0 O5'-C5'-C4' 114.478 3.055 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.366 0 O4'-C4'-C3' 109.217 3.617 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.737 0 O5'-C5'-C4' 114.072 2.766 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.243 0 O4'-C4'-C3' 108.777 3.177 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.005 0 O4'-C4'-C3' 109.158 3.558 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.619 2.601 0 O4'-C1'-N19 110.524 3.404 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.204 0 O5'-C5'-C4' 114.596 3.14 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.049 0 O4'-C4'-C3' 109.467 3.867 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.337 0 O4'-C4'-C3' 108.914 3.314 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.821 0 O4'-C4'-C3' 109.179 3.579 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.371 0 O4'-C1'-N19 110.192 2.99 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.793 0 O5'-C5'-C4' 114.125 2.804 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.013 0 O5'-C5'-C4' 114.957 3.398 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.435 0 O4'-C1'-N19 110.784 3.731 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.726 0 P-O3'-C3' 123.291 2.992 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.2 0 O4'-C1'-N19 110.072 2.84 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.986 0 O5'-C5'-C4' 113.71 2.507 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.565 -2.826 0 P-O3'-C3' 123.872 3.476 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.183 2 C5'-C4'-C3' 106.68 -5.346 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.494 0 O4'-C4'-C3' 107.87 2.27 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.513 1 O4'-C1'-N19 111.292 4.365 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.62 0 O4'-C4'-C3' 109.347 3.747 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.24 1 O4'-C1'-N19 111.172 4.215 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.462 0 CA-C-O 120.491 0.186 . . . . 1.0 111.337 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 29.9 mmt-85 -69.46 58.27 0.12 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 126.483 1.913 . . . . 1.0 112.637 175.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -55.89 130.96 45.74 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 128.634 2.774 . . . . 1.0 110.995 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.5 t -73.62 134.1 30.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 113.584 -1.643 . . . . 1.0 110.95 172.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 40.2 mttt -108.45 122.32 46.78 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 106.777 -1.564 . . . . 1.0 106.777 167.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.53 144.1 28.9 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 103.932 -2.618 . . . . 1.0 103.932 167.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.4 ' CD1' ' HB2' ' A' ' 120' ' ' ALA . 76.4 m-85 -127.46 138.58 52.99 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 107.84 -1.17 . . . . 1.0 107.84 173.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -131.73 125.97 33.33 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.61 1.164 . . . . 1.0 109.847 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -92.41 110.79 47.11 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 123.163 0.585 . . . . 1.0 111.767 -172.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -65.87 -14.56 45.16 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.371 2.714 . . . . 1.0 114.659 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -88.94 -18.08 28.21 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.169 1.174 . . . . 1.0 114.169 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.2 p -129.51 -22.9 2.97 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.382 1.252 . . . . 1.0 114.382 -174.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 76.86 7.55 86.32 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 124.361 0.982 . . . . 1.0 114.486 -172.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -78.05 156.33 30.12 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 119.243 1.521 . . . . 1.0 110.877 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 20.9 t -136.44 153.66 31.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 C-N-CA 126.691 1.997 . . . . 1.0 109.814 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.58 168.07 12.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 127.658 2.383 . . . . 1.0 109.405 177.129 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -146.74 120.89 9.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.736 2.414 . . . . 1.0 109.136 173.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.92 155.89 43.16 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.898 0.879 . . . . 1.0 109.897 -178.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -97.81 10.15 40.85 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.113 -0.992 . . . . 1.0 111.693 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 126.12 -165.31 19.36 Favored Glycine 0 CA--C 1.532 1.143 0 C-N-CA 127.227 2.346 . . . . 1.0 113.085 -171.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.07 168.44 26.14 Favored Glycine 0 CA--C 1.535 1.32 0 N-CA-C 117.157 1.623 . . . . 1.0 117.157 169.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -57.59 100.49 0.05 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 127.421 2.288 . . . . 1.0 109.035 169.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -130.38 126.34 36.83 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.692 1.597 . . . . 1.0 109.534 178.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -44.84 -66.6 0.37 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 115.774 1.768 . . . . 1.0 115.774 -168.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.8 m -60.46 -40.98 93.17 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.403 1.001 . . . . 1.0 112.132 -175.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.6 tp -59.5 -39.07 82.61 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.053 0.941 . . . . 1.0 111.545 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -68.56 -32.56 72.57 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.628 0.771 . . . . 1.0 113.036 175.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -68.87 -42.64 76.74 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.426 1.012 . . . . 1.0 110.909 176.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.8 m0 -62.06 -36.01 80.35 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.426 0.528 . . . . 1.0 112.426 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.9 -36.11 82.48 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.5 -0.75 . . . . 1.0 112.464 172.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.07 -48.89 66.87 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.859 0.837 . . . . 1.0 111.004 176.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.2 -33.02 61.37 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.706 1.602 . . . . 1.0 114.546 -169.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -134.5 -48.43 0.77 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.832 1.049 . . . . 1.0 113.832 -176.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.62 153.91 6.11 Favored Glycine 0 N--CA 1.479 1.529 0 CA-C-N 119.35 0.977 . . . . 1.0 115.148 169.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.49 -32.87 80.18 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 123.043 2.496 . . . . 1.0 114.187 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -62.64 -46.61 87.41 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.0 0.905 . . . . 1.0 111.027 176.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.85 -53.81 54.19 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.202 1.401 . . . . 1.0 109.648 176.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.8 t -57.53 -47.09 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 C-N-CA 125.872 1.669 . . . . 1.0 111.788 -175.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.81 -37.99 89.48 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.362 0.665 . . . . 1.0 112.373 173.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 56.7 m -66.51 -29.88 70.08 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.051 0.54 . . . . 1.0 112.435 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 26.8 m0 -74.83 -10.3 59.37 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.184 1.179 . . . . 1.0 114.184 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.4 ' HB2' ' CD1' ' A' ' 85' ' ' TYR . . . -71.83 168.73 17.26 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 124.09 1.9 . . . . 1.0 115.075 -171.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 63.7 m -144.18 139.59 28.84 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 129.857 3.263 . . . . 1.0 108.369 -176.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.6 tp -97.86 126.44 43.24 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.4 1.08 . . . . 1.0 109.763 -177.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.6 mt -124.49 120.25 31.46 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.776 1.631 . . . . 1.0 111.12 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -88.4 -8.57 70.88 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.426 1.012 . . . . 1.0 115.457 -175.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.255 1.375 0 C-N-CA 126.038 1.735 . . . . 1.0 112.204 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.925 0 O4'-C4'-C3' 109.115 3.515 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.866 0 O4'-C1'-N19 110.307 3.134 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C4'-C3' 109.16 3.56 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.598 0 O4'-C4'-C3' 108.396 2.796 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.044 0 O4'-C4'-C3' 108.562 2.962 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.916 0 O4'-C4'-C3' 108.905 3.305 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.772 0 O4'-C1'-N19 110.747 3.683 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.397 0 O5'-C5'-C4' 114.401 3.001 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.978 1 O4'-C4'-C3' 109.721 4.121 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.617 0 O4'-C1'-N19 110.399 3.248 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.663 0 O4'-C4'-C3' 109.027 3.427 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C1'-N19 110.168 2.96 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.948 0 O4'-C4'-C3' 108.74 3.14 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.958 0 O5'-C5'-C4' 114.957 3.398 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.073 0 O4'-C1'-N19 110.841 3.802 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.843 0 P-O3'-C3' 123.302 3.002 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.308 0 O4'-C1'-N19 110.235 3.044 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.991 0 O5'-C5'-C4' 113.908 2.649 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.563 -3.02 0 P-O3'-C3' 123.772 3.394 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.087 1 C5'-C4'-C3' 106.657 -5.362 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.777 0 O5'-C5'-C4' 113.309 2.221 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.42 1 O4'-C1'-N19 111.514 4.643 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.658 0 O4'-C4'-C3' 109.15 3.55 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.542 1 O4'-C1'-N19 111.295 4.369 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.613 0.244 . . . . 1.0 111.631 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 50.8 mmt-85 -69.68 61.24 0.16 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 126.124 1.769 . . . . 1.0 112.915 175.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.8 mttt -58.12 131.67 51.21 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 128.413 2.685 . . . . 1.0 110.577 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.3 t -70.66 134.53 29.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 113.572 -1.649 . . . . 1.0 110.996 171.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.4 mttt -107.99 120.1 41.34 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 106.833 -1.543 . . . . 1.0 106.833 167.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.91 143.69 31.48 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 103.21 -2.885 . . . . 1.0 103.21 167.488 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -127.2 142.5 51.47 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.841 -1.17 . . . . 1.0 107.841 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.68 142.32 49.79 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.869 1.268 . . . . 1.0 109.546 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -109.26 109.6 60.45 Favored Pre-proline 0 CA--C 1.548 0.892 0 N-CA-C 112.846 0.684 . . . . 1.0 112.846 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_exo -53.13 -27.58 37.7 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 124.345 3.363 . . . . 1.0 115.743 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -89.35 -21.62 23.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.774 1.229 . . . . 1.0 114.087 -173.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.5 p -127.04 -17.97 4.72 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 114.286 1.217 . . . . 1.0 114.286 -171.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.71 11.16 72.89 Favored Glycine 0 CA--C 1.541 1.699 0 C-N-CA 123.843 0.735 . . . . 1.0 114.218 -174.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -78.18 150.92 33.45 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.716 1.606 . . . . 1.0 109.696 174.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 t -132.97 154.7 40.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 126.614 1.966 . . . . 1.0 108.913 172.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.28 168.35 10.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 127.372 2.269 . . . . 1.0 109.575 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -146.95 119.77 8.66 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 127.669 2.388 . . . . 1.0 109.605 172.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.97 149.87 34.03 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.894 0.878 . . . . 1.0 109.748 -178.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -92.41 9.9 32.26 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 120.851 -1.155 . . . . 1.0 111.907 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.89 -166.1 20.66 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 127.105 2.288 . . . . 1.0 113.363 -170.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.51 168.2 27.21 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 125.466 1.508 . . . . 1.0 116.818 170.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -56.95 102.57 0.09 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 127.234 2.214 . . . . 1.0 109.077 169.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -130.8 135.13 47.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.031 1.332 . . . . 1.0 111.061 177.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -49.46 -69.17 0.12 Allowed 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 126.2 1.8 . . . . 1.0 114.811 -169.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 38.2 m -62.09 -39.51 92.72 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.35 -0.844 . . . . 1.0 111.942 -175.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.4 tp -58.6 -39.42 80.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.464 1.106 . . . . 1.0 111.557 176.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -67.52 -36.23 80.62 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.656 0.783 . . . . 1.0 112.273 175.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -67.32 -42.03 84.31 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.106 0.866 . . . . 1.0 111.313 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 34.9 m0 -61.78 -37.23 83.56 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.69 0.626 . . . . 1.0 112.69 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -64.85 -36.0 82.95 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 121.343 -0.848 . . . . 1.0 112.139 172.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.07 -49.01 66.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.667 0.746 . . . . 1.0 110.816 176.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -69.82 -37.37 76.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.531 1.533 . . . . 1.0 113.726 -170.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 11.6 m-90 -133.84 -54.55 0.87 Allowed 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.62 0.97 . . . . 1.0 113.62 -175.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 147.75 157.24 7.37 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-N 118.974 0.806 . . . . 1.0 114.934 172.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.78 -30.29 68.69 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.954 2.436 . . . . 1.0 113.842 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -62.43 -46.86 86.63 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.083 0.953 . . . . 1.0 111.086 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.84 -52.68 64.68 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.048 1.339 . . . . 1.0 109.979 176.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 38.0 t -57.42 -47.88 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 C-N-CA 125.843 1.657 . . . . 1.0 111.842 -176.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.63 -37.84 88.95 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.838 0.855 . . . . 1.0 112.587 173.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.5 m -65.31 -29.06 69.78 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.771 -0.581 . . . . 1.0 112.535 -178.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -80.74 -5.71 57.47 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.374 1.249 . . . . 1.0 114.374 174.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.27 168.65 16.86 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 124.026 1.87 . . . . 1.0 115.1 -172.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 67.7 m -142.12 135.64 29.27 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 130.083 3.353 . . . . 1.0 108.696 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 26.6 tp -87.86 126.87 35.27 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.641 1.176 . . . . 1.0 110.163 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.7 mt -131.56 145.1 51.55 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.936 2.095 . . . . 1.0 110.361 176.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -56.52 157.21 10.77 Favored Glycine 0 CA--C 1.545 1.909 0 CA-C-N 115.117 -0.947 . . . . 1.0 114.226 171.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 . . . . . 0 C--O 1.255 1.343 0 C-N-CA 125.212 1.405 . . . . 1.0 112.971 179.745 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.075 0 O4'-C4'-C3' 109.222 3.622 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.03 0 O5'-C5'-C4' 114.445 3.032 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.434 0 O4'-C4'-C3' 109.334 3.734 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.307 0 O4'-C4'-C3' 108.523 2.923 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.142 0 O4'-C4'-C3' 108.713 3.113 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.071 0 O5'-C5'-C4' 114.93 3.379 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.585 0 P-O3'-C3' 123.66 3.3 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.19 0 O5'-C5'-C4' 114.614 3.153 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.801 0 O4'-C4'-C3' 109.485 3.885 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.621 0 O4'-C4'-C3' 108.946 3.346 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.652 0 O4'-C4'-C3' 108.998 3.398 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.17 0 O4'-C1'-N19 110.236 3.045 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.704 0 O5'-C5'-C4' 114.291 2.922 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.373 0 O5'-C5'-C4' 114.834 3.31 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.179 0 O4'-C1'-N19 110.919 3.899 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.745 0 O5'-C5'-C4' 114.388 2.991 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.125 0 O4'-C1'-N19 110.074 2.843 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.97 0 O5'-C5'-C4' 113.832 2.594 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.657 0 P-O3'-C3' 123.877 3.481 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.01 1 C5'-C4'-C3' 106.675 -5.35 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.646 0 O5'-C5'-C4' 113.368 2.263 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.418 1 O4'-C1'-N19 111.552 4.69 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.559 0 O4'-C4'-C3' 109.204 3.604 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.148 1 O4'-C1'-N19 111.031 4.039 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.282 0.087 . . . . 1.0 111.15 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.9 mmt-85 -67.56 59.16 0.06 Allowed 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 126.611 1.964 . . . . 1.0 112.996 175.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.4 mttt -54.91 132.75 47.32 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 128.869 2.867 . . . . 1.0 111.074 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.1 t -74.77 134.73 28.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 113.464 -1.698 . . . . 1.0 111.692 174.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.5 mttp -108.68 122.51 47.27 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 106.598 -1.63 . . . . 1.0 106.598 167.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.19 145.68 28.23 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 104.607 -2.368 . . . . 1.0 104.607 168.233 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -128.03 142.12 51.32 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.907 -1.146 . . . . 1.0 107.907 172.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -133.83 138.03 45.41 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.989 1.316 . . . . 1.0 109.137 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -105.51 110.31 64.14 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 112.348 0.499 . . . . 1.0 112.348 -173.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -53.29 -27.76 39.99 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 124.405 3.404 . . . . 1.0 115.694 176.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -86.58 -17.47 33.89 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.771 1.228 . . . . 1.0 114.216 -174.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.5 p -129.45 -22.32 3.06 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.267 1.21 . . . . 1.0 114.267 -174.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.95 8.13 82.32 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.369 0.985 . . . . 1.0 114.169 -172.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.15 156.67 29.76 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 119.141 1.47 . . . . 1.0 110.745 173.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -136.62 154.97 33.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 126.799 2.04 . . . . 1.0 109.194 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.71 168.02 10.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 127.513 2.325 . . . . 1.0 109.28 178.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -147.49 121.83 9.64 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 127.735 2.414 . . . . 1.0 109.148 174.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.31 153.6 41.44 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.731 0.812 . . . . 1.0 109.663 -179.081 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -94.51 8.13 43.22 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.964 -1.085 . . . . 1.0 111.807 174.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.51 -166.66 20.97 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 126.919 2.2 . . . . 1.0 113.4 -172.04 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.47 169.82 26.83 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-O 123.603 1.668 . . . . 1.0 116.886 169.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -57.69 102.97 0.11 Allowed 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 127.644 2.378 . . . . 1.0 108.818 169.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.4 t60 -130.51 131.87 45.32 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 1.0 109.767 178.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.4 tttt -49.75 -66.02 0.46 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 115.903 1.816 . . . . 1.0 115.903 -168.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 41.2 m -60.49 -41.23 93.84 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 119.488 1.04 . . . . 1.0 111.891 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.1 tp -59.05 -38.52 79.57 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.103 0.961 . . . . 1.0 111.482 177.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.31 -36.11 78.83 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.681 0.792 . . . . 1.0 112.399 175.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -66.8 -42.14 86.43 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.331 0.969 . . . . 1.0 110.75 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -61.71 -38.45 87.9 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.695 0.628 . . . . 1.0 112.695 177.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -65.34 -34.28 77.95 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.53 -0.732 . . . . 1.0 112.38 172.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.02 58.87 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.567 0.699 . . . . 1.0 111.24 176.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -74.58 -34.09 62.81 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.906 1.682 . . . . 1.0 114.669 -169.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -132.89 -47.16 0.86 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.588 0.958 . . . . 1.0 113.588 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.34 154.21 6.3 Favored Glycine 0 N--CA 1.477 1.368 0 CA-C-N 118.952 0.796 . . . . 1.0 115.084 169.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.65 -33.89 85.38 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.088 2.526 . . . . 1.0 113.864 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -61.23 -45.98 92.32 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 122.038 0.923 . . . . 1.0 111.286 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.66 -54.84 41.75 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 114.211 -1.358 . . . . 1.0 109.827 175.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 36.4 t -58.07 -47.37 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 125.462 1.505 . . . . 1.0 112.043 -174.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.32 -35.76 80.08 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.778 -0.576 . . . . 1.0 111.979 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.2 t -65.4 -33.62 76.38 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.476 0.58 . . . . 1.0 112.195 178.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 28.1 m0 -71.55 -11.84 61.06 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.093 1.146 . . . . 1.0 114.093 174.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.15 168.52 17.02 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 124.041 1.877 . . . . 1.0 114.98 -171.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 91.2 m -144.29 143.45 31.01 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 130.213 3.405 . . . . 1.0 107.958 -175.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -108.41 124.25 50.1 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.899 0.88 . . . . 1.0 109.587 -176.159 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.6 mt -121.89 128.83 52.03 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.817 2.047 . . . . 1.0 110.819 -172.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -91.61 -13.09 58.71 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.377 0.989 . . . . 1.0 115.548 -173.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 . . . . . 0 C--O 1.255 1.366 0 C-N-CA 125.806 1.642 . . . . 1.0 110.992 -179.893 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.845 0 O4'-C4'-C3' 109.075 3.475 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.025 0 O4'-C4'-C3' 108.532 2.932 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.453 0 O4'-C4'-C3' 109.364 3.764 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.694 0 O4'-C4'-C3' 108.377 2.777 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.261 0 O4'-C4'-C3' 108.631 3.031 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.084 0 O4'-C4'-C3' 109.185 3.585 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.879 0 O4'-C1'-N19 110.936 3.92 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.128 0 O5'-C5'-C4' 114.421 3.015 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.938 1 O4'-C4'-C3' 109.689 4.089 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.412 0 O4'-C4'-C3' 108.815 3.215 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.86 0 O4'-C4'-C3' 109.035 3.435 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.17 0 O4'-C1'-N19 110.297 3.121 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.829 0 O5'-C5'-C4' 114.16 2.829 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.057 0 O5'-C5'-C4' 114.999 3.428 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.196 1 O4'-C1'-N19 111.241 4.301 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.123 0 P-O3'-C3' 123.346 3.038 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.193 0 O4'-C1'-N19 110.222 3.027 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.947 0 C2'-C3'-O3' 117.399 2.518 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.567 -2.642 0 P-O3'-C3' 123.993 3.577 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.292 1 C5'-C4'-C3' 107.588 -4.741 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.555 0 O4'-C4'-C3' 107.894 2.294 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.445 1 O4'-C1'-N19 111.475 4.594 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.808 0 O4'-C4'-C3' 109.244 3.644 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.204 1 O4'-C1'-N19 111.347 4.434 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.425 0.155 . . . . 1.0 111.349 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.2 mmt-85 -69.65 56.22 0.12 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 126.602 1.961 . . . . 1.0 113.049 176.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -55.07 130.87 43.5 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 129.056 2.943 . . . . 1.0 111.123 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 74.2 t -73.39 132.84 32.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 113.729 -1.578 . . . . 1.0 111.973 173.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.9 mttt -106.43 121.92 45.24 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.753 -1.573 . . . . 1.0 106.753 167.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -83.83 144.66 29.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 103.714 -2.698 . . . . 1.0 103.714 167.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.401 ' CD1' ' HB2' ' A' ' 120' ' ' ALA . 71.2 m-85 -126.78 142.84 51.43 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.918 -1.141 . . . . 1.0 107.918 172.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -132.72 138.51 47.26 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.934 1.294 . . . . 1.0 109.088 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -105.02 110.66 64.8 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 112.317 0.488 . . . . 1.0 112.317 -174.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -53.05 -27.53 36.74 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.33 3.353 . . . . 1.0 115.998 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -87.41 -17.16 32.91 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.83 1.252 . . . . 1.0 114.086 -174.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 42.6 p -129.78 -22.46 2.94 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.362 1.245 . . . . 1.0 114.362 -174.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.76 7.24 83.36 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 124.369 0.985 . . . . 1.0 114.251 -172.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -77.79 156.79 30.29 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 123.14 1.448 . . . . 1.0 110.738 173.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -137.37 155.12 31.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 126.795 2.038 . . . . 1.0 109.461 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.25 169.64 9.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 127.266 2.226 . . . . 1.0 109.79 177.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -146.15 123.17 11.4 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 128.017 2.527 . . . . 1.0 109.641 170.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.06 155.42 43.34 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.897 0.879 . . . . 1.0 109.735 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.4 mttp -95.2 8.67 42.34 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.121 0.968 . . . . 1.0 111.872 173.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 125.94 -165.82 18.96 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 126.907 2.194 . . . . 1.0 113.232 -170.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.6 168.75 25.14 Favored Glycine 0 CA--C 1.535 1.3 0 N-CA-C 117.021 1.568 . . . . 1.0 117.021 170.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -57.68 102.05 0.09 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.322 2.249 . . . . 1.0 108.796 169.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -130.42 127.78 39.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.349 1.46 . . . . 1.0 109.6 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.1 tttt -45.39 -66.69 0.36 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 116.036 1.865 . . . . 1.0 116.036 -168.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.8 m -60.12 -41.25 92.24 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.23 0.923 . . . . 1.0 112.28 -177.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.5 tp -59.95 -38.7 83.19 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.897 0.879 . . . . 1.0 111.576 178.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -68.74 -32.78 72.79 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.679 0.792 . . . . 1.0 112.707 174.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -68.33 -42.9 78.66 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.563 1.074 . . . . 1.0 110.947 176.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.0 m0 -61.61 -36.37 80.52 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.555 0.576 . . . . 1.0 112.555 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.82 -36.05 82.39 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.45 -0.781 . . . . 1.0 112.432 172.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.2 -48.68 67.17 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.701 0.763 . . . . 1.0 111.024 176.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -75.38 -33.56 61.03 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.782 1.633 . . . . 1.0 114.336 -169.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.3 m-90 -134.46 -48.16 0.77 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.987 1.106 . . . . 1.0 113.987 -175.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.82 153.22 5.93 Favored Glycine 0 N--CA 1.479 1.518 0 CA-C-N 119.142 0.883 . . . . 1.0 115.225 169.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.3 -32.51 81.8 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.093 2.529 . . . . 1.0 114.356 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -62.43 -46.63 87.66 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 122.136 0.97 . . . . 1.0 111.03 176.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.39 -53.22 60.63 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 114.15 -1.386 . . . . 1.0 110.179 176.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 34.4 t -57.71 -47.49 85.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 C-N-CA 125.644 1.578 . . . . 1.0 111.88 -175.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.6 -38.08 89.77 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.451 0.7 . . . . 1.0 112.322 173.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.4 m -66.35 -29.66 69.89 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.414 0.524 . . . . 1.0 112.414 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -76.52 -8.85 58.03 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.953 1.094 . . . . 1.0 113.953 173.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.401 ' HB2' ' CD1' ' A' ' 85' ' ' TYR . . . -72.42 168.8 17.71 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 124.032 1.872 . . . . 1.0 114.866 -171.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 95.8 m -144.21 136.29 26.35 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 129.63 3.172 . . . . 1.0 108.444 -175.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 27.6 tp -92.76 128.16 38.53 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 124.663 1.185 . . . . 1.0 109.657 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.6 mt -127.91 131.42 49.39 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.866 1.666 . . . . 1.0 111.246 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -78.81 12.75 21.52 Favored Glycine 0 CA--C 1.541 1.67 0 C-N-CA 125.316 1.436 . . . . 1.0 114.85 175.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 55.6 m170 . . . . . 0 C--O 1.254 1.317 0 C-N-CA 125.321 1.448 . . . . 1.0 113.293 176.197 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.919 0 O4'-C4'-C3' 109.123 3.523 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.996 0 O5'-C5'-C4' 114.504 3.074 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.227 0 O4'-C4'-C3' 109.27 3.67 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.519 0 O4'-C4'-C3' 108.398 2.798 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.137 0 O4'-C4'-C3' 108.697 3.097 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.623 2.984 0 O4'-C4'-C3' 109.0 3.4 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.703 0 O4'-C1'-N19 110.979 3.974 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.247 0 O5'-C5'-C4' 114.409 3.006 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.196 1 O4'-C4'-C3' 109.859 4.259 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.438 0 O4'-C1'-N19 110.364 3.205 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.762 0 O4'-C4'-C3' 108.998 3.398 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.282 0 O4'-C1'-N19 110.079 2.849 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.747 0 O5'-C5'-C4' 114.489 3.063 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.201 0 O5'-C5'-C4' 115.012 3.437 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.336 0 O4'-C1'-N19 110.825 3.781 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.76 0 P-O3'-C3' 123.473 3.145 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.439 0 O4'-C4'-C3' 108.57 2.97 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.766 0 O5'-C5'-C4' 113.984 2.703 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.566 -2.743 0 P-O3'-C3' 123.821 3.434 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.944 1 C5'-C4'-C3' 106.824 -5.251 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.571 0 O4'-C4'-C3' 108.004 2.404 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.501 1 O4'-C1'-N19 111.589 4.737 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.488 0 O4'-C4'-C3' 109.156 3.556 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.114 1 O4'-C1'-N19 111.154 4.192 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 120.348 0.118 . . . . 1.0 111.202 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.2 mmt-85 -68.84 56.51 0.09 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.741 2.016 . . . . 1.0 113.048 175.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 66.3 mttt -56.66 129.12 39.71 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 128.404 2.682 . . . . 1.0 110.538 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.6 t -72.57 132.36 33.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 113.488 -1.687 . . . . 1.0 110.763 173.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -106.39 122.22 45.83 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 106.649 -1.612 . . . . 1.0 106.649 167.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.08 144.9 28.75 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 103.706 -2.702 . . . . 1.0 103.706 167.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -128.28 141.03 51.56 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.745 -1.205 . . . . 1.0 107.745 174.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -131.77 140.57 49.25 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.688 1.195 . . . . 1.0 109.318 177.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -106.35 109.64 63.29 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 123.266 0.627 . . . . 1.0 112.283 -174.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -52.79 -27.33 33.91 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 124.129 3.22 . . . . 1.0 115.847 175.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -88.72 -19.12 26.51 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.558 1.143 . . . . 1.0 113.926 -173.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.0 p -129.84 -20.32 3.18 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 114.561 1.319 . . . . 1.0 114.561 -172.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.79 10.68 77.19 Favored Glycine 0 CA--C 1.537 1.456 0 CA-C-N 118.73 0.696 . . . . 1.0 114.145 -173.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -74.14 149.12 41.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.194 1.397 . . . . 1.0 109.426 170.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -133.13 154.23 39.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 C-N-CA 126.776 2.03 . . . . 1.0 109.0 173.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.15 168.65 10.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 127.456 2.303 . . . . 1.0 109.331 178.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -147.62 120.87 8.94 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 127.843 2.457 . . . . 1.0 109.27 173.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.27 155.21 42.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.086 0.954 . . . . 1.0 109.968 -178.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -96.04 10.57 37.06 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 120.88 -1.137 . . . . 1.0 112.023 176.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 124.77 -167.68 17.06 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 127.106 2.288 . . . . 1.0 112.969 -171.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.67 170.14 31.43 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 116.999 1.559 . . . . 1.0 116.999 170.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -57.03 103.15 0.1 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.452 2.301 . . . . 1.0 109.218 169.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -130.47 134.89 47.44 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.344 1.458 . . . . 1.0 110.243 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -52.44 -66.77 0.33 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 115.918 1.822 . . . . 1.0 115.918 -168.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 34.4 m -60.1 -40.93 91.36 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 119.41 1.004 . . . . 1.0 111.963 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.5 tp -57.55 -39.12 75.96 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.269 1.027 . . . . 1.0 111.765 176.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -68.6 -35.78 77.8 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.829 0.851 . . . . 1.0 112.502 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -67.0 -41.31 86.93 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.278 0.945 . . . . 1.0 110.838 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 34.6 m0 -61.71 -37.31 83.69 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.67 0.618 . . . . 1.0 112.67 175.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -65.16 -36.23 83.59 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.444 -0.785 . . . . 1.0 112.107 172.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.92 -48.27 69.17 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.724 0.774 . . . . 1.0 110.971 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -76.43 -34.12 58.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.384 1.474 . . . . 1.0 114.538 -169.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 13.4 m-90 -133.5 -47.84 0.82 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.053 1.131 . . . . 1.0 114.053 -175.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.08 153.47 6.05 Favored Glycine 0 N--CA 1.479 1.543 0 CA-C-N 119.226 0.921 . . . . 1.0 115.354 169.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.15 -33.08 82.88 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.281 2.654 . . . . 1.0 114.359 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -63.35 -46.54 86.11 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.716 0.807 . . . . 1.0 110.875 177.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.9 -53.31 59.87 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.331 1.452 . . . . 1.0 109.812 176.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 29.3 t -57.52 -47.7 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 C-N-CA 125.904 1.682 . . . . 1.0 111.981 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -66.15 -36.17 82.42 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.29 0.636 . . . . 1.0 112.563 173.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 64.4 m -66.63 -30.66 70.99 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.544 0.572 . . . . 1.0 112.544 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -75.89 -8.84 57.86 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.057 1.132 . . . . 1.0 114.057 173.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.52 168.98 16.41 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 124.218 1.961 . . . . 1.0 114.613 -173.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 89.8 m -142.98 139.63 30.71 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 129.851 3.26 . . . . 1.0 108.215 -176.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -97.43 126.75 42.87 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.376 1.071 . . . . 1.0 109.972 -177.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 85.9 mt -125.63 121.33 33.22 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.92 1.688 . . . . 1.0 110.944 -177.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -87.79 -7.98 73.87 Favored Glycine 0 CA--C 1.536 1.367 0 CA-C-N 114.927 -1.033 . . . . 1.0 115.516 -174.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 126.066 1.746 . . . . 1.0 111.477 -178.608 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.881 0 O4'-C4'-C3' 109.235 3.635 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.948 0 O5'-C5'-C4' 114.376 2.983 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.262 0 O4'-C4'-C3' 109.374 3.774 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.586 0 O4'-C4'-C3' 108.33 2.73 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.514 0 O4'-C4'-C3' 108.895 3.295 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.623 3.042 0 O4'-C4'-C3' 109.255 3.655 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.697 0 O4'-C1'-N19 110.764 3.705 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.061 0 O5'-C5'-C4' 114.534 3.096 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.407 1 O4'-C4'-C3' 109.627 4.027 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.8 0 O4'-C4'-C3' 108.708 3.108 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.616 0 O4'-C4'-C3' 108.854 3.254 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.4 0 O4'-C1'-N19 110.042 2.803 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.954 0 O5'-C5'-C4' 114.329 2.949 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.036 0 O5'-C5'-C4' 114.887 3.348 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.445 0 O4'-C1'-N19 110.952 3.939 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.757 0 P-O3'-C3' 123.365 3.054 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.195 0 O4'-C4'-C3' 108.674 3.074 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.852 0 O5'-C5'-C4' 113.864 2.617 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.696 0 P-O3'-C3' 124.012 3.593 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.949 1 C5'-C4'-C3' 106.982 -5.145 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.551 0 O4'-C4'-C3' 107.974 2.374 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.28 1 O4'-C1'-N19 111.386 4.483 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.586 0 O4'-C4'-C3' 109.234 3.634 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.143 1 O4'-C1'-N19 111.249 4.311 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.121 0.01 . . . . 1.0 111.024 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -66.28 60.77 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.458 1.903 . . . . 1.0 113.737 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.0 mttt -55.32 137.2 48.22 Favored 'General case' 0 CA--C 1.523 -0.091 0 C-N-CA 128.854 2.862 . . . . 1.0 110.464 175.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 97.1 t -77.06 135.82 25.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 113.56 -1.654 . . . . 1.0 110.843 171.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.522 ' HG2' ' HB1' ' A' ' 120' ' ' ALA . 3.5 ttpt -116.32 121.8 43.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.627 -1.249 . . . . 1.0 107.627 167.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.01 147.07 35.0 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 105.239 -2.134 . . . . 1.0 105.239 168.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.459 ' CE1' ' HB2' ' A' ' 120' ' ' ALA . 68.3 m-85 -129.06 140.03 51.77 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.795 -1.187 . . . . 1.0 107.795 172.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -132.81 129.52 38.63 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.711 1.205 . . . . 1.0 109.659 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -95.03 110.91 52.62 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 123.074 0.55 . . . . 1.0 111.597 -172.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.97 -15.25 48.06 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.324 2.682 . . . . 1.0 114.36 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -89.24 -20.52 24.05 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.281 1.215 . . . . 1.0 114.281 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.1 p -130.03 -21.24 3.01 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 114.894 1.442 . . . . 1.0 114.894 -172.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.19 9.42 84.13 Favored Glycine 0 CA--C 1.54 1.596 0 CA-C-N 118.808 0.731 . . . . 1.0 114.373 -173.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -72.95 148.82 43.92 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.684 1.242 . . . . 1.0 109.524 170.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 t -133.03 153.4 37.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 C-N-CA 126.605 1.962 . . . . 1.0 109.501 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.08 168.7 10.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 127.458 2.303 . . . . 1.0 109.198 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -147.78 121.42 9.2 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 128.205 2.602 . . . . 1.0 108.996 173.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.32 155.66 42.79 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.773 0.829 . . . . 1.0 109.653 -178.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -96.79 6.13 49.27 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.225 1.01 . . . . 1.0 111.789 173.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 132.11 -165.05 23.66 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.855 2.169 . . . . 1.0 113.609 -175.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.84 170.74 26.43 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 123.461 1.589 . . . . 1.0 117.042 169.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -57.82 101.36 0.07 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.466 2.306 . . . . 1.0 109.014 169.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -130.4 126.36 36.86 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.719 1.608 . . . . 1.0 109.592 178.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -44.84 -67.17 0.31 Allowed 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 116.07 1.878 . . . . 1.0 116.07 -169.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.2 m -60.11 -40.98 91.56 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 119.212 0.914 . . . . 1.0 112.214 -175.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 41.1 tp -59.44 -39.04 82.29 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.23 1.012 . . . . 1.0 111.611 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -68.58 -32.62 72.66 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.753 0.821 . . . . 1.0 113.151 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -69.12 -42.68 75.74 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 119.593 1.088 . . . . 1.0 110.777 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -60.57 -36.91 79.64 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.668 0.618 . . . . 1.0 112.668 177.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.28 -36.53 84.39 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 121.475 -0.765 . . . . 1.0 112.526 172.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.35 -48.37 70.44 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.854 0.835 . . . . 1.0 111.087 176.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -76.31 -33.57 59.05 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.342 1.457 . . . . 1.0 114.58 -169.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.3 m-90 -133.47 -48.83 0.83 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.923 1.083 . . . . 1.0 113.923 -176.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 141.19 153.44 5.96 Favored Glycine 0 N--CA 1.477 1.421 0 CA-C-N 119.046 0.839 . . . . 1.0 115.041 169.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -62.6 -32.94 79.23 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.075 2.517 . . . . 1.0 114.378 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -61.94 -46.64 88.42 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.89 0.852 . . . . 1.0 111.15 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.61 -53.96 51.97 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.996 1.318 . . . . 1.0 109.836 176.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 34.4 t -57.74 -46.69 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 125.425 1.49 . . . . 1.0 112.077 -175.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -64.98 -37.66 88.39 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.354 0.662 . . . . 1.0 112.388 173.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 55.6 m -66.46 -30.14 70.42 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.163 0.585 . . . . 1.0 112.365 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -74.95 -10.02 59.08 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.979 1.103 . . . . 1.0 113.979 173.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.522 ' HB1' ' HG2' ' A' ' 83' ' ' LYS . . . -71.14 167.23 19.77 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 124.032 1.872 . . . . 1.0 114.501 -173.185 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 95.8 m -146.37 133.11 19.98 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 129.305 3.042 . . . . 1.0 108.466 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.8 tt -100.37 124.83 46.35 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.685 0.794 . . . . 1.0 110.016 -171.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.8 mt -121.73 124.32 43.96 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.657 1.983 . . . . 1.0 111.056 -170.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -74.78 -19.21 80.01 Favored Glycine 0 CA--C 1.538 1.522 0 CA-C-N 115.289 -0.869 . . . . 1.0 115.137 -174.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.257 1.471 0 C-N-CA 125.822 1.649 . . . . 1.0 111.962 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.948 0 O4'-C4'-C3' 109.054 3.454 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.8 0 O5'-C5'-C4' 114.583 3.131 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.397 0 O4'-C4'-C3' 109.192 3.592 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.571 0 O4'-C4'-C3' 108.596 2.996 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.87 0 O4'-C4'-C3' 108.528 2.928 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.135 0 O5'-C5'-C4' 114.859 3.328 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.687 0 O4'-C1'-N19 110.837 3.796 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.832 0 O5'-C5'-C4' 114.665 3.189 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.728 1 O4'-C4'-C3' 109.772 4.172 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.704 0 O4'-C1'-N19 110.242 3.052 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.719 0 O4'-C4'-C3' 109.116 3.516 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.421 0 O4'-C1'-N19 110.229 3.036 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.993 0 O4'-C4'-C3' 108.632 3.032 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.177 0 O5'-C5'-C4' 114.816 3.297 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.197 0 O4'-C1'-N19 110.963 3.954 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.024 0 P-O3'-C3' 123.416 3.097 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.045 0 O4'-C1'-N19 110.24 3.05 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.815 0 O5'-C5'-C4' 113.832 2.594 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.563 -2.953 0 P-O3'-C3' 123.631 3.276 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.997 1 C5'-C4'-C3' 107.731 -4.646 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.502 0 O5'-C5'-C4' 114.387 2.991 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.484 1 O4'-C1'-N19 111.247 4.309 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.482 0 O4'-C4'-C3' 109.237 3.637 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.793 1 O4'-C1'-N19 111.364 4.455 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 111.137 0.051 . . . . 1.0 111.137 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 61.2 mmt-85 -65.41 61.58 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 126.658 1.983 . . . . 1.0 113.482 176.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -54.51 132.8 45.53 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 128.45 2.7 . . . . 1.0 111.04 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 74.5 t -70.88 135.22 28.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 113.088 -1.869 . . . . 1.0 111.264 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.3 mttp -107.44 120.62 42.67 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.304 -1.739 . . . . 1.0 106.304 167.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.85 144.66 29.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 104.108 -2.553 . . . . 1.0 104.108 168.228 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -127.24 140.17 52.41 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.994 -1.113 . . . . 1.0 107.994 173.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -132.08 130.95 41.91 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.7 1.2 . . . . 1.0 109.704 178.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -97.63 110.95 57.31 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 122.777 0.431 . . . . 1.0 111.31 -173.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -66.32 -14.63 45.05 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.45 2.767 . . . . 1.0 114.666 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -88.63 -17.63 29.67 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.726 1.21 . . . . 1.0 114.219 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 40.0 p -129.75 -23.56 2.82 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 114.534 1.309 . . . . 1.0 114.534 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.87 7.48 87.43 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.294 0.949 . . . . 1.0 114.234 -172.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.44 156.44 29.39 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.098 1.449 . . . . 1.0 110.976 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -136.37 154.11 32.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 126.681 1.992 . . . . 1.0 109.632 179.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.88 168.01 11.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 127.672 2.389 . . . . 1.0 109.525 177.453 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -147.03 120.76 9.21 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.585 2.354 . . . . 1.0 109.481 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.32 151.33 37.33 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.753 0.821 . . . . 1.0 109.685 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -95.17 10.13 37.07 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.1 -1.0 . . . . 1.0 111.826 176.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 129.33 -166.09 21.77 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 126.982 2.229 . . . . 1.0 113.093 -172.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.68 169.16 22.39 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 117.195 1.638 . . . . 1.0 117.195 170.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -57.66 100.99 0.06 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.717 2.407 . . . . 1.0 109.2 169.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.8 t60 -130.5 130.74 44.56 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.623 1.569 . . . . 1.0 109.939 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -49.52 -66.96 0.31 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.647 1.721 . . . . 1.0 115.647 -168.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.5 m -60.01 -40.94 90.96 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 119.323 0.965 . . . . 1.0 111.911 -175.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.9 tp -58.89 -38.39 78.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.014 0.926 . . . . 1.0 111.756 177.147 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.05 -36.33 79.7 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.574 0.75 . . . . 1.0 112.281 175.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.92 -42.14 85.87 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.102 0.865 . . . . 1.0 110.839 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.3 m0 -62.17 -38.03 87.52 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.587 0.588 . . . . 1.0 112.587 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.7 -33.87 76.87 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.535 -0.728 . . . . 1.0 112.181 172.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.48 -49.27 56.36 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.435 0.636 . . . . 1.0 111.451 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -74.24 -34.13 63.56 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.204 1.802 . . . . 1.0 114.67 -169.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.7 m-90 -133.05 -46.5 0.85 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.574 0.953 . . . . 1.0 113.574 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.42 153.84 6.32 Favored Glycine 0 N--CA 1.48 1.613 0 C-N-CA 123.849 0.738 . . . . 1.0 114.871 170.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.32 -33.59 89.02 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 122.98 2.453 . . . . 1.0 113.67 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -61.26 -45.88 92.65 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.987 0.899 . . . . 1.0 111.387 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.86 -55.16 37.58 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.218 -1.355 . . . . 1.0 109.923 175.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.6 t -57.3 -47.78 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 C-N-CA 125.59 1.556 . . . . 1.0 111.997 -175.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -67.28 -34.61 77.77 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.936 -0.477 . . . . 1.0 112.263 176.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.2 t -65.96 -33.99 77.09 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.73 -0.606 . . . . 1.0 112.234 177.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -71.5 -11.93 61.12 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.031 1.123 . . . . 1.0 114.031 174.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.82 168.71 16.18 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 124.117 1.913 . . . . 1.0 115.116 -170.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 79.5 m -142.26 141.83 32.51 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 130.107 3.363 . . . . 1.0 108.323 -177.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.3 tt -104.44 120.54 41.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.374 1.07 . . . . 1.0 110.206 -176.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 74.9 mt -124.37 154.05 40.95 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.3 2.24 . . . . 1.0 110.92 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -66.64 -179.91 11.57 Favored Glycine 0 CA--C 1.543 1.814 0 C-N-CA 125.632 1.586 . . . . 1.0 115.342 176.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.281 0 C-N-CA 126.154 1.782 . . . . 1.0 110.781 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.818 0 O4'-C4'-C3' 109.093 3.493 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.035 0 O5'-C5'-C4' 114.551 3.108 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.222 0 O4'-C4'-C3' 109.285 3.685 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.433 0 O4'-C4'-C3' 108.642 3.042 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.884 0 O4'-C4'-C3' 108.638 3.038 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.107 0 O5'-C5'-C4' 115.027 3.448 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.766 1 O4'-C1'-N19 111.376 4.47 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.202 0 O5'-C5'-C4' 114.36 2.971 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.869 1 O4'-C4'-C3' 109.874 4.274 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.61 0 O4'-C1'-N19 110.576 3.47 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.718 0 O4'-C4'-C3' 109.091 3.491 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.267 0 O4'-C1'-N19 110.177 2.972 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.887 0 O4'-C4'-C3' 108.544 2.944 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.093 0 O5'-C5'-C4' 114.935 3.382 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.41 0 O4'-C1'-N19 110.975 3.969 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.01 0 P-O3'-C3' 123.375 3.062 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.21 0 O4'-C1'-N19 110.421 3.276 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.041 0 O5'-C5'-C4' 113.765 2.546 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.811 0 P-O3'-C3' 123.982 3.569 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.481 1 C5'-C4'-C3' 107.018 -5.121 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.682 0 O4'-C4'-C3' 107.772 2.172 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.5 1 O4'-C1'-N19 111.617 4.772 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.584 0 O4'-C4'-C3' 109.271 3.671 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.205 1 O4'-C1'-N19 111.237 4.296 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.386 0.136 . . . . 1.0 111.264 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 31.4 mmt-85 -67.81 58.73 0.07 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 126.813 2.045 . . . . 1.0 113.077 175.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.8 mttt -55.54 131.26 45.73 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 128.769 2.828 . . . . 1.0 111.08 178.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 85.7 t -73.77 134.48 29.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 113.629 -1.623 . . . . 1.0 111.433 173.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.8 mttp -108.54 122.92 48.07 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 106.577 -1.638 . . . . 1.0 106.577 167.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.27 145.59 28.22 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 104.442 -2.429 . . . . 1.0 104.442 168.079 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -128.39 142.29 51.15 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.199 -1.037 . . . . 1.0 108.199 173.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -132.74 139.74 47.75 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.938 1.295 . . . . 1.0 109.485 177.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -106.82 109.75 63.28 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 123.234 0.614 . . . . 1.0 112.483 -173.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -53.36 -26.67 36.07 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.269 3.312 . . . . 1.0 115.957 176.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -88.99 -18.79 26.68 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.52 1.128 . . . . 1.0 113.996 -174.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.9 p -129.54 -19.76 3.36 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.49 1.292 . . . . 1.0 114.49 -172.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.61 11.44 72.74 Favored Glycine 0 CA--C 1.54 1.647 0 CA-C-N 118.741 0.7 . . . . 1.0 114.159 -173.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -75.32 149.61 38.69 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.39 1.476 . . . . 1.0 109.4 171.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.5 t -132.47 154.75 40.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 126.754 2.022 . . . . 1.0 109.035 172.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.89 167.69 12.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 127.318 2.247 . . . . 1.0 109.384 177.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -146.84 120.31 9.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 127.483 2.313 . . . . 1.0 108.888 173.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.22 153.58 41.49 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.75 0.82 . . . . 1.0 109.588 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.4 mttp -95.72 9.05 41.71 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.1 -1.0 . . . . 1.0 111.573 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.84 -166.68 20.4 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 127.238 2.352 . . . . 1.0 113.202 -171.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.92 169.16 27.1 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 117.272 1.669 . . . . 1.0 117.272 169.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -57.64 101.42 0.07 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 127.708 2.403 . . . . 1.0 108.944 169.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -130.66 130.2 43.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.478 1.511 . . . . 1.0 109.625 178.015 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -48.68 -65.52 0.55 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 115.971 1.841 . . . . 1.0 115.971 -169.042 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 44.3 m -62.22 -39.22 92.08 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 119.266 0.939 . . . . 1.0 111.925 -175.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.5 tp -59.67 -39.44 84.51 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.773 0.829 . . . . 1.0 111.72 176.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -67.41 -35.83 80.06 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.664 0.786 . . . . 1.0 112.485 175.014 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -67.2 -43.87 81.05 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.06 0.846 . . . . 1.0 110.271 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.8 m0 -60.22 -38.54 83.7 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.73 -0.668 . . . . 1.0 112.487 176.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -65.18 -34.54 78.62 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.512 -0.742 . . . . 1.0 112.53 172.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.86 -49.85 59.81 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.804 0.812 . . . . 1.0 111.191 176.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -75.58 -34.13 60.64 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.859 1.664 . . . . 1.0 114.822 -169.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.6 m-90 -132.75 -47.01 0.87 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 113.651 0.982 . . . . 1.0 113.651 -176.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.01 154.01 6.28 Favored Glycine 0 N--CA 1.479 1.507 0 CA-C-N 118.944 0.793 . . . . 1.0 114.967 169.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -61.76 -33.83 84.46 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.075 2.517 . . . . 1.0 113.928 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -60.9 -45.96 92.55 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 122.07 0.938 . . . . 1.0 111.376 177.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.69 -54.97 40.23 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.182 -1.372 . . . . 1.0 109.916 175.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.2 t -58.11 -47.82 86.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 125.694 1.598 . . . . 1.0 111.786 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.14 -35.29 79.41 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.127 0.571 . . . . 1.0 112.157 176.34 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.3 t -65.43 -34.01 77.29 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.079 0.552 . . . . 1.0 112.189 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 24.3 m0 -72.28 -10.06 59.29 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.963 1.097 . . . . 1.0 113.963 174.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.45 168.46 17.45 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 124.172 1.939 . . . . 1.0 115.045 -172.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 92.8 m -144.14 142.81 30.79 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 130.133 3.373 . . . . 1.0 107.812 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -107.92 123.55 48.78 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.893 0.877 . . . . 1.0 109.767 -176.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.7 mt -121.22 129.8 53.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.758 2.023 . . . . 1.0 110.69 -172.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -77.48 -15.38 81.48 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.582 0.993 . . . . 1.0 115.582 -173.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 . . . . . 0 C--O 1.252 1.233 0 C-N-CA 126.49 1.916 . . . . 1.0 111.072 179.786 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.098 0 O4'-C4'-C3' 109.184 3.584 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.025 0 O5'-C5'-C4' 114.49 3.064 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.565 0 O4'-C4'-C3' 109.377 3.777 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.708 0 O4'-C4'-C3' 108.495 2.895 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.227 0 O4'-C4'-C3' 108.699 3.099 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.072 0 O4'-C4'-C3' 108.994 3.394 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.651 0 O4'-C1'-N19 110.645 3.557 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.265 0 O5'-C5'-C4' 114.456 3.04 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.162 1 O4'-C4'-C3' 109.641 4.041 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.496 0 O4'-C1'-N19 110.486 3.357 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.925 0 O4'-C4'-C3' 108.913 3.313 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.402 0 O4'-C1'-N19 110.248 3.06 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.65 0 O4'-C4'-C3' 108.645 3.045 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.149 0 O5'-C5'-C4' 114.89 3.35 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.214 1 O4'-C1'-N19 111.122 4.153 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.916 0 P-O3'-C3' 123.203 2.919 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.293 0 O4'-C1'-N19 110.253 3.067 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.859 0 O5'-C5'-C4' 113.865 2.618 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.776 0 P-O3'-C3' 124.166 3.721 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.213 1 C5'-C4'-C3' 107.116 -5.056 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.693 0 O4'-C4'-C3' 107.783 2.183 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.56 1 O4'-C1'-N19 111.564 4.705 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.559 0 O4'-C4'-C3' 109.228 3.628 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.315 1 O4'-C1'-N19 111.282 4.352 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 111.13 0.048 . . . . 1.0 111.13 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.6 mmp_? -65.59 57.37 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 127.268 2.227 . . . . 1.0 114.191 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -56.59 127.97 33.94 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 128.795 2.838 . . . . 1.0 110.221 175.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.6 t -70.65 133.86 31.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 113.62 -1.627 . . . . 1.0 110.646 174.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -108.09 121.87 45.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.529 -1.656 . . . . 1.0 106.529 168.016 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.63 144.46 28.58 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 103.694 -2.706 . . . . 1.0 103.694 167.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -127.66 140.36 52.13 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 107.691 -1.226 . . . . 1.0 107.691 174.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -131.83 139.25 48.79 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.848 1.259 . . . . 1.0 109.462 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -105.63 110.38 64.17 Favored Pre-proline 0 CA--C 1.544 0.713 0 N-CA-C 112.413 0.523 . . . . 1.0 112.413 -173.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo -52.73 -27.5 34.14 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 124.338 3.359 . . . . 1.0 115.87 176.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -87.97 -17.24 31.71 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.833 1.253 . . . . 1.0 114.273 -174.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.4 p -129.9 -22.1 2.95 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.114 1.153 . . . . 1.0 114.114 -174.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.01 7.52 81.75 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 124.09 0.852 . . . . 1.0 114.443 -172.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -77.45 156.49 31.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.011 1.406 . . . . 1.0 110.681 173.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.0 t -136.11 155.29 34.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 C-N-CA 126.986 2.115 . . . . 1.0 109.536 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.47 168.42 10.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 127.85 2.46 . . . . 1.0 109.404 177.322 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -147.48 121.84 9.65 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.757 2.423 . . . . 1.0 109.023 173.258 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.64 156.68 43.38 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.931 0.892 . . . . 1.0 109.972 -178.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -96.37 9.51 41.01 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.893 -1.129 . . . . 1.0 112.101 175.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 125.24 -167.56 17.57 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 127.186 2.327 . . . . 1.0 112.969 -171.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.1 170.07 32.68 Favored Glycine 0 CA--C 1.537 1.467 0 N-CA-C 117.082 1.593 . . . . 1.0 117.082 169.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -57.33 101.38 0.07 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.703 2.401 . . . . 1.0 108.945 169.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -130.68 133.95 46.52 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.121 1.369 . . . . 1.0 110.638 178.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -45.33 -70.55 0.1 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 125.895 1.678 . . . . 1.0 115.408 -169.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.4 m -61.04 -41.21 96.15 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.571 0.748 . . . . 1.0 111.949 -175.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 40.0 tp -58.44 -39.54 80.12 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.099 0.96 . . . . 1.0 111.69 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -69.72 -32.52 71.13 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.778 0.831 . . . . 1.0 112.965 175.224 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -68.44 -43.17 77.68 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.798 1.181 . . . . 1.0 111.221 175.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -61.56 -35.43 77.75 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.678 0.622 . . . . 1.0 112.678 178.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.76 -36.53 83.83 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 121.515 -0.741 . . . . 1.0 112.514 171.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.7 -48.45 69.24 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.826 0.822 . . . . 1.0 110.818 176.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.94 -32.84 59.74 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.657 1.583 . . . . 1.0 114.448 -169.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -134.87 -50.17 0.76 Allowed 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.008 1.114 . . . . 1.0 114.008 -176.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.2 153.87 6.02 Favored Glycine 0 N--CA 1.477 1.385 0 CA-C-N 119.315 0.962 . . . . 1.0 115.458 169.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.47 -33.24 79.65 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.264 2.643 . . . . 1.0 114.262 -178.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -63.76 -46.71 84.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.927 0.87 . . . . 1.0 110.887 177.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.08 -53.45 58.06 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.223 1.409 . . . . 1.0 110.197 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 25.7 t -57.43 -48.07 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 125.769 1.628 . . . . 1.0 111.804 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.7 -35.79 80.97 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.574 0.583 . . . . 1.0 112.574 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 21.9 t -65.73 -33.44 75.88 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.228 0.611 . . . . 1.0 112.067 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -72.75 -10.97 60.41 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.012 1.116 . . . . 1.0 114.012 174.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.88 169.25 15.12 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 124.321 2.01 . . . . 1.0 114.86 -172.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.0 m -143.67 142.26 30.92 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 130.148 3.379 . . . . 1.0 107.711 -176.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.1 tt -106.98 123.04 47.61 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.067 0.947 . . . . 1.0 109.586 -175.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.4 mt -120.85 126.44 50.07 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.424 1.89 . . . . 1.0 110.888 -172.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -84.37 -15.64 68.47 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 115.337 0.895 . . . . 1.0 115.337 -173.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 125.864 1.665 . . . . 1.0 111.061 -179.903 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.703 0 O4'-C4'-C3' 109.055 3.455 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.973 0 O5'-C5'-C4' 114.477 3.055 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.387 0 O4'-C4'-C3' 109.096 3.496 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.4 0 O4'-C4'-C3' 108.533 2.933 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.209 0 O4'-C4'-C3' 108.606 3.006 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.469 0 O4'-C4'-C3' 108.84 3.24 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.786 0 P-O3'-C3' 124.094 3.662 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.333 0 O5'-C5'-C4' 114.357 2.969 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.003 0 O4'-C4'-C3' 109.444 3.844 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.585 0 O4'-C4'-C3' 108.898 3.298 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.649 0 O4'-C4'-C3' 109.129 3.529 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.35 0 O4'-C1'-N19 110.137 2.921 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.839 0 O4'-C4'-C3' 108.571 2.971 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.035 0 O5'-C5'-C4' 115.104 3.503 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.276 0 O4'-C1'-N19 110.788 3.735 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.065 0 P-O3'-C3' 123.173 2.895 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.329 0 O4'-C4'-C3' 108.43 2.83 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.993 0 O5'-C5'-C4' 114.0 2.714 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.562 -3.127 0 P-O3'-C3' 123.395 3.079 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.127 2 C5'-C4'-C3' 106.801 -5.266 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.049 0 O4'-C4'-C3' 108.085 2.485 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.462 1 O4'-C1'-N19 111.394 4.492 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.515 0 O4'-C4'-C3' 109.334 3.734 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.009 1 O4'-C1'-N19 111.507 4.634 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 111.326 0.121 . . . . 1.0 111.326 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 51.9 mmt-85 -65.41 66.77 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 126.277 1.831 . . . . 1.0 112.637 175.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 44.8 mttt -62.94 137.33 58.24 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 128.934 2.894 . . . . 1.0 110.575 178.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 87.8 t -76.37 136.14 25.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 C-N-CA 125.723 1.609 . . . . 1.0 111.309 172.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -109.63 122.56 47.74 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 106.179 -1.786 . . . . 1.0 106.179 167.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.21 145.27 28.43 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 104.269 -2.493 . . . . 1.0 104.269 168.265 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -127.36 141.76 51.61 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.028 -1.101 . . . . 1.0 108.028 172.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -133.28 137.43 46.02 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.884 1.274 . . . . 1.0 109.041 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -107.45 110.89 63.13 Favored Pre-proline 0 CA--C 1.548 0.888 0 N-CA-C 112.417 0.525 . . . . 1.0 112.417 -172.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -53.19 -27.22 36.74 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 124.636 3.557 . . . . 1.0 115.593 175.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -89.05 -15.08 34.9 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.119 1.368 . . . . 1.0 114.575 -174.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.6 p -128.93 -21.83 3.28 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.351 1.061 . . . . 1.0 113.831 -176.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.77 9.75 79.39 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.577 1.084 . . . . 1.0 114.023 -172.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -83.47 158.89 21.87 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.03 1.415 . . . . 1.0 110.853 175.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -136.74 155.51 33.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 C-N-CA 126.96 2.104 . . . . 1.0 109.577 178.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.99 168.53 9.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 127.468 2.307 . . . . 1.0 109.29 178.206 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -147.22 121.66 9.69 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.685 2.394 . . . . 1.0 109.287 173.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.25 153.61 40.78 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.851 0.861 . . . . 1.0 109.727 -179.392 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 33.7 mttp -97.06 10.75 38.44 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.875 -1.141 . . . . 1.0 111.5 174.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.98 -165.53 21.73 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 127.253 2.358 . . . . 1.0 113.133 -173.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.12 168.9 23.81 Favored Glycine 0 CA--C 1.537 1.433 0 CA-C-O 123.5 1.611 . . . . 1.0 117.054 170.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -57.72 101.9 0.08 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 127.498 2.319 . . . . 1.0 109.093 169.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -130.51 123.7 30.24 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.497 1.519 . . . . 1.0 109.711 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -43.94 -65.37 0.51 Allowed 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 115.486 1.662 . . . . 1.0 115.486 -169.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.7 m -58.69 -41.59 86.59 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 119.379 0.99 . . . . 1.0 112.454 -176.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.2 tp -60.97 -37.9 84.06 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.058 0.943 . . . . 1.0 111.457 177.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -69.5 -32.79 71.87 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.533 0.733 . . . . 1.0 112.773 174.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.03 -42.1 76.82 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.823 1.192 . . . . 1.0 110.973 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -62.39 -37.65 86.57 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.554 0.576 . . . . 1.0 112.554 177.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -65.67 -32.06 73.42 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.668 -0.645 . . . . 1.0 112.332 172.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.36 -51.4 24.35 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.434 0.635 . . . . 1.0 110.968 176.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HE3' ' CH2' ' A' ' 111' ' ' TRP . 47.1 mtmt -74.68 -29.06 61.09 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 115.309 1.596 . . . . 1.0 115.309 -169.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.432 ' CH2' ' HE3' ' A' ' 110' ' ' LYS . 16.5 m-90 -134.76 -47.51 0.74 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.176 1.176 . . . . 1.0 114.176 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.1 154.18 6.31 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 119.09 0.859 . . . . 1.0 114.942 170.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -61.03 -33.95 91.18 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.268 2.645 . . . . 1.0 113.759 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -61.41 -45.82 92.73 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.877 0.846 . . . . 1.0 111.238 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.74 -55.11 38.36 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 114.326 -1.306 . . . . 1.0 110.073 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 32.9 t -57.42 -48.24 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 125.819 1.648 . . . . 1.0 111.923 -174.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -66.94 -34.7 78.35 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.085 0.554 . . . . 1.0 112.147 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.6 m -67.58 -30.45 70.06 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 112.641 0.608 . . . . 1.0 112.641 178.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 17.9 m0 -74.55 -10.97 60.07 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.212 1.19 . . . . 1.0 114.212 173.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.7 168.46 16.51 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 124.091 1.901 . . . . 1.0 114.823 -170.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 99.6 m -142.95 143.19 31.87 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 130.133 3.373 . . . . 1.0 107.909 -176.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.69 122.91 47.31 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.082 0.953 . . . . 1.0 109.818 -176.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt -122.86 137.43 54.94 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.651 1.98 . . . . 1.0 110.52 -174.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -63.64 159.18 39.0 Favored Glycine 0 CA--C 1.54 1.63 0 CA-C-N 115.016 -0.993 . . . . 1.0 114.596 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.326 1.851 . . . . 1.0 110.674 178.235 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.035 0 O4'-C4'-C3' 109.044 3.444 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.236 0 O5'-C5'-C4' 114.513 3.081 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.289 0 O4'-C4'-C3' 109.41 3.81 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.446 0 O4'-C4'-C3' 108.474 2.874 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.077 0 O4'-C4'-C3' 108.856 3.256 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.046 0 O5'-C5'-C4' 114.849 3.321 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.601 1 O4'-C1'-N19 111.031 4.038 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.074 0 O5'-C5'-C4' 114.406 3.004 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.949 0 O4'-C4'-C3' 109.532 3.932 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.28 0 O4'-C1'-N19 110.524 3.405 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.573 0 O4'-C4'-C3' 108.889 3.289 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.117 0 O4'-C1'-N19 110.048 2.81 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.875 0 O4'-C4'-C3' 108.605 3.005 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.073 0 O5'-C5'-C4' 114.901 3.358 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.339 0 O4'-C1'-N19 110.777 3.721 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.685 0 P-O3'-C3' 123.185 2.904 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.252 0 O4'-C1'-N19 110.226 3.033 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.92 0 O5'-C5'-C4' 114.214 2.867 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.564 -2.873 0 P-O3'-C3' 123.755 3.379 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.384 1 C5'-C4'-C3' 107.162 -5.026 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.585 0 O4'-C4'-C3' 107.988 2.388 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.255 1 O4'-C1'-N19 111.879 5.099 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.845 0 O4'-C4'-C3' 109.087 3.487 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.131 1 O4'-C1'-N19 111.148 4.185 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 111.275 0.102 . . . . 1.0 111.275 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 36.7 mmt-85 -66.74 59.57 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 126.627 1.971 . . . . 1.0 113.053 174.477 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.7 mttt -54.05 133.01 43.67 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 128.744 2.817 . . . . 1.0 111.152 178.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.1 t -75.6 135.05 27.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 113.45 -1.704 . . . . 1.0 111.607 172.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.0 mttp -110.18 123.55 49.97 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 106.928 -1.508 . . . . 1.0 106.928 167.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -83.94 145.4 28.58 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 104.414 -2.439 . . . . 1.0 104.414 168.115 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -128.48 142.65 51.02 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.04 -1.096 . . . . 1.0 108.04 173.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -132.71 140.85 48.29 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.711 1.204 . . . . 1.0 109.467 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -107.81 109.57 62.26 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 123.077 0.551 . . . . 1.0 112.271 -173.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -53.28 -26.89 36.2 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 124.57 3.513 . . . . 1.0 115.785 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -88.68 -18.82 27.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.506 1.122 . . . . 1.0 113.928 -174.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 47.0 p -129.64 -19.85 3.31 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 114.543 1.312 . . . . 1.0 114.543 -172.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.88 11.53 73.99 Favored Glycine 0 CA--C 1.538 1.473 0 C-N-CA 123.879 0.752 . . . . 1.0 114.276 -173.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -75.72 149.82 37.98 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.176 1.39 . . . . 1.0 109.454 171.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -132.94 154.73 40.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 126.802 2.041 . . . . 1.0 108.962 172.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.84 168.15 11.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 127.45 2.3 . . . . 1.0 109.448 178.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -147.0 121.1 9.44 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 127.844 2.458 . . . . 1.0 109.097 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.71 152.58 39.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.73 0.812 . . . . 1.0 109.826 -178.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -93.06 7.57 43.61 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 120.921 -1.112 . . . . 1.0 111.988 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.77 -166.44 21.26 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 126.989 2.233 . . . . 1.0 113.133 -171.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.66 169.66 27.16 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-O 123.366 1.537 . . . . 1.0 116.807 169.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -57.26 103.0 0.1 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.533 2.333 . . . . 1.0 108.92 169.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -130.64 131.87 45.14 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.275 1.43 . . . . 1.0 110.161 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -48.96 -67.46 0.26 Allowed 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 115.909 1.818 . . . . 1.0 115.909 -168.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 34.1 m -59.95 -41.02 90.97 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 119.008 0.822 . . . . 1.0 111.893 -176.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.1 tp -58.53 -38.94 78.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.085 0.954 . . . . 1.0 111.571 177.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -68.54 -35.81 77.95 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.686 0.794 . . . . 1.0 112.352 175.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -66.79 -42.11 86.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.368 0.986 . . . . 1.0 110.744 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -61.47 -38.79 88.53 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.5 0.555 . . . . 1.0 112.5 176.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -65.06 -34.48 78.52 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.424 -0.797 . . . . 1.0 112.081 173.129 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.65 -48.74 63.25 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.737 0.779 . . . . 1.0 111.388 176.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.62 -33.89 60.53 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.773 1.629 . . . . 1.0 114.822 -169.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.4 m-90 -133.23 -45.89 0.84 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.814 1.042 . . . . 1.0 113.814 -176.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.64 154.23 6.39 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-N 119.073 0.851 . . . . 1.0 115.223 169.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.62 -34.47 84.41 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.063 2.509 . . . . 1.0 113.795 178.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -60.57 -45.87 92.34 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 122.072 0.939 . . . . 1.0 111.357 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.85 -54.84 41.52 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.017 -1.447 . . . . 1.0 110.067 175.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.9 t -57.91 -47.67 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 125.528 1.531 . . . . 1.0 112.201 -175.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -67.04 -35.21 79.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.95 0.5 . . . . 1.0 112.232 175.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.6 t -65.38 -33.99 77.26 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.688 -0.633 . . . . 1.0 112.331 177.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.6 m0 -72.63 -9.6 58.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.994 1.109 . . . . 1.0 113.994 174.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.51 168.29 16.56 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 124.041 1.877 . . . . 1.0 114.893 -173.272 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 89.7 m -143.89 138.92 28.91 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 129.79 3.236 . . . . 1.0 108.157 -176.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 30.8 tp -98.63 127.64 44.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.335 1.054 . . . . 1.0 109.718 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.5 mt -125.58 122.13 35.59 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.999 1.72 . . . . 1.0 110.878 -176.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -72.49 -20.13 79.3 Favored Glycine 0 CA--C 1.537 1.444 0 CA-C-N 115.259 -0.882 . . . . 1.0 115.113 -175.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.178 0 C-N-CA 126.031 1.733 . . . . 1.0 112.145 178.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.844 0 O4'-C4'-C3' 109.22 3.62 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.823 0 O4'-C1'-N19 110.213 3.017 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.039 0 O4'-C4'-C3' 109.267 3.667 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.369 0 O4'-C4'-C3' 108.385 2.785 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.325 0 O4'-C4'-C3' 108.602 3.002 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.045 0 O4'-C4'-C3' 108.963 3.363 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.663 0 O4'-C1'-N19 110.991 3.989 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.998 0 O5'-C5'-C4' 114.494 3.067 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.054 1 O4'-C4'-C3' 109.768 4.168 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.519 0 P-O3'-C3' 123.391 3.076 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.667 0 O4'-C4'-C3' 109.19 3.59 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.957 0 O4'-C1'-N19 110.164 2.956 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.659 0 O4'-C4'-C3' 108.488 2.888 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.032 0 O5'-C5'-C4' 115.091 3.493 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.464 0 O4'-C1'-N19 110.943 3.929 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.695 0 P-O3'-C3' 123.324 3.02 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.433 0 O4'-C4'-C3' 108.569 2.969 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.048 0 O5'-C5'-C4' 113.826 2.59 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.568 -2.515 0 P-O3'-C3' 124.029 3.608 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.066 1 C5'-C4'-C3' 107.297 -4.936 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.759 0 O4'-C4'-C3' 107.799 2.199 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.437 1 O4'-C1'-N19 111.4 4.501 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.402 0 O4'-C4'-C3' 109.07 3.47 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.054 1 O4'-C1'-N19 111.166 4.207 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 111.689 0.255 . . . . 1.0 111.689 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.1 mmp_? -69.31 58.32 0.11 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.731 2.013 . . . . 1.0 113.518 174.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -53.42 128.19 27.74 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 128.22 2.608 . . . . 1.0 110.179 174.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.8 t -72.3 134.39 29.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 113.633 -1.621 . . . . 1.0 110.521 171.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -108.33 121.57 45.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.516 -1.661 . . . . 1.0 106.516 167.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.81 143.82 28.85 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 103.896 -2.631 . . . . 1.0 103.896 167.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -127.66 139.96 52.39 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.761 -1.199 . . . . 1.0 107.761 175.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.48 140.0 49.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.546 1.139 . . . . 1.0 108.986 177.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -105.57 109.89 63.68 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 112.542 0.571 . . . . 1.0 112.542 -174.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -52.96 -26.77 32.9 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.18 3.253 . . . . 1.0 115.878 176.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -87.65 -17.44 31.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.883 1.273 . . . . 1.0 114.232 -174.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.3 p -129.79 -22.59 2.92 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 114.028 1.122 . . . . 1.0 114.028 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.42 8.78 80.94 Favored Glycine 0 CA--C 1.539 1.554 0 C-N-CA 124.048 0.832 . . . . 1.0 114.352 -172.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.32 156.0 29.83 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 119.061 1.43 . . . . 1.0 110.506 172.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -135.83 155.52 36.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 C-N-CA 126.917 2.087 . . . . 1.0 109.563 178.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.69 168.1 10.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 127.689 2.396 . . . . 1.0 109.261 177.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -146.92 122.01 10.11 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 127.772 2.429 . . . . 1.0 109.288 172.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.08 156.4 42.98 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.919 0.888 . . . . 1.0 109.861 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.0 mttp -97.13 10.34 39.64 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.038 -1.039 . . . . 1.0 111.986 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 124.98 -166.65 17.6 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 127.253 2.359 . . . . 1.0 112.858 -171.375 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.5 169.52 29.72 Favored Glycine 0 CA--C 1.537 1.408 0 N-CA-C 117.405 1.722 . . . . 1.0 117.405 169.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -57.74 100.37 0.05 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.607 2.363 . . . . 1.0 109.265 169.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -130.43 130.96 44.96 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.446 1.498 . . . . 1.0 109.75 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -47.17 -67.09 0.31 Allowed 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 115.501 1.667 . . . . 1.0 115.501 -168.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.7 m -60.15 -41.02 91.87 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 119.29 0.95 . . . . 1.0 112.083 -174.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 46.4 tp -59.28 -39.52 83.19 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.243 1.017 . . . . 1.0 111.522 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -68.84 -32.44 72.12 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 113.193 0.812 . . . . 1.0 113.193 175.09 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.33 -42.99 74.6 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 119.422 1.01 . . . . 1.0 110.858 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -61.53 -35.66 78.36 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.761 0.652 . . . . 1.0 112.761 177.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -65.13 -36.91 85.76 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 121.39 -0.819 . . . . 1.0 112.696 171.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.92 -48.26 69.18 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.703 0.763 . . . . 1.0 110.863 176.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -76.07 -32.89 59.48 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.568 1.547 . . . . 1.0 114.415 -169.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -135.0 -49.76 0.75 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.019 1.118 . . . . 1.0 114.019 -176.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.44 153.62 5.95 Favored Glycine 0 N--CA 1.48 1.577 0 CA-C-N 119.416 1.007 . . . . 1.0 115.353 169.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.1 -33.24 82.91 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.26 2.64 . . . . 1.0 114.328 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -63.11 -46.76 85.82 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 122.009 0.909 . . . . 1.0 110.966 177.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.64 -53.56 57.02 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.065 1.346 . . . . 1.0 110.032 176.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 27.7 t -57.15 -48.24 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.991 1.717 . . . . 1.0 111.81 -176.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -66.24 -36.01 81.9 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.076 0.551 . . . . 1.0 112.442 174.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.7 m -67.12 -30.58 70.62 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.644 0.609 . . . . 1.0 112.644 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 23.0 m0 -75.05 -10.04 59.1 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.805 1.039 . . . . 1.0 113.805 173.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.98 168.77 16.29 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 124.375 2.036 . . . . 1.0 114.689 -172.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.5 m -141.99 141.07 32.86 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 130.156 3.382 . . . . 1.0 107.736 -177.396 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.3 tt -104.98 121.72 44.33 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.928 0.891 . . . . 1.0 109.787 -175.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt -120.01 123.66 44.01 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.395 1.878 . . . . 1.0 110.917 -174.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -74.47 -19.38 79.87 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-N 115.223 -0.899 . . . . 1.0 115.201 -174.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.225 0 C-N-CA 126.056 1.742 . . . . 1.0 112.166 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.795 0 O4'-C4'-C3' 109.004 3.404 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.086 0 O5'-C5'-C4' 114.558 3.113 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.403 0 O4'-C4'-C3' 109.147 3.547 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.444 0 O4'-C4'-C3' 108.485 2.885 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.222 0 O4'-C4'-C3' 108.708 3.108 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.624 3.118 0 O4'-C4'-C3' 108.866 3.266 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.684 0 P-O3'-C3' 124.052 3.627 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.985 0 O5'-C5'-C4' 114.51 3.079 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.381 1 O4'-C4'-C3' 109.741 4.141 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.678 0 O4'-C4'-C3' 108.789 3.189 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.504 0 O4'-C4'-C3' 109.063 3.463 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.032 0 O4'-C1'-N19 110.012 2.764 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.79 0 O5'-C5'-C4' 114.452 3.037 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.133 0 O5'-C5'-C4' 115.043 3.459 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.438 0 O4'-C1'-N19 110.989 3.987 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.819 0 P-O3'-C3' 123.208 2.923 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.358 0 O4'-C1'-N19 110.29 3.112 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.714 0 O5'-C5'-C4' 113.966 2.69 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.564 -2.914 0 P-O3'-C3' 123.533 3.194 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.231 2 C5'-C4'-C3' 106.736 -5.309 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.172 0 O4'-C4'-C3' 108.193 2.593 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.311 1 O4'-C1'-N19 111.374 4.468 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.59 0 O4'-C4'-C3' 109.152 3.552 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.139 1 O4'-C1'-N19 111.286 4.357 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 120.414 0.15 . . . . 1.0 111.34 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 28.1 mmt-85 -68.57 57.19 0.08 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 126.458 1.903 . . . . 1.0 113.001 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.2 mttt -54.39 131.08 41.48 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 128.915 2.886 . . . . 1.0 111.041 177.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.3 t -73.58 134.17 30.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 113.607 -1.633 . . . . 1.0 111.59 172.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -107.97 121.91 45.75 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.703 -1.592 . . . . 1.0 106.703 167.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.09 143.98 29.35 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 104.055 -2.572 . . . . 1.0 104.055 167.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -127.06 141.71 51.71 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.925 -1.139 . . . . 1.0 107.925 173.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.84 141.59 49.47 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.794 1.238 . . . . 1.0 109.149 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -108.32 110.14 61.75 Favored Pre-proline 0 CA--C 1.548 0.899 0 N-CA-C 112.658 0.614 . . . . 1.0 112.658 -173.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -52.69 -27.52 33.96 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.417 3.411 . . . . 1.0 116.04 174.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -88.57 -19.86 25.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.85 1.26 . . . . 1.0 114.286 -174.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.8 p -127.57 -19.93 4.08 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.726 1.009 . . . . 1.0 113.726 -173.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.95 8.22 77.6 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.062 0.839 . . . . 1.0 114.151 -172.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -80.62 157.0 26.12 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 119.055 1.428 . . . . 1.0 110.892 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.49 155.11 33.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 C-N-CA 126.746 2.018 . . . . 1.0 109.332 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.26 168.83 10.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 127.463 2.305 . . . . 1.0 109.601 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -146.65 122.63 10.71 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 127.885 2.474 . . . . 1.0 109.407 171.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.01 155.27 42.69 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.949 0.9 . . . . 1.0 110.085 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -95.64 8.75 42.52 Favored 'General case' 0 N--CA 1.48 1.075 0 O-C-N 120.94 -1.1 . . . . 1.0 111.884 174.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.07 -164.76 20.52 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 127.15 2.31 . . . . 1.0 113.112 -171.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.59 168.87 21.32 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 117.018 1.567 . . . . 1.0 117.018 170.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -57.22 101.73 0.07 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.403 2.281 . . . . 1.0 108.763 169.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -130.25 128.48 41.71 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.13 1.372 . . . . 1.0 109.783 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 31.2 tttt -46.41 -65.92 0.48 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.958 1.836 . . . . 1.0 115.958 -168.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.0 m -59.49 -41.76 90.6 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 119.175 0.898 . . . . 1.0 112.204 -177.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.3 tp -59.92 -38.83 83.45 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.109 0.964 . . . . 1.0 111.574 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -68.86 -32.07 71.48 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.7 0.8 . . . . 1.0 112.973 174.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -68.46 -43.16 77.6 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.623 1.101 . . . . 1.0 110.907 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -62.78 -36.18 82.26 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.509 0.559 . . . . 1.0 112.509 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -65.09 -36.28 83.81 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.404 -0.81 . . . . 1.0 112.413 171.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.78 -48.62 68.47 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.597 0.713 . . . . 1.0 110.914 176.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -69.78 -37.43 76.35 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.561 1.544 . . . . 1.0 113.407 -171.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 11.7 m-90 -134.12 -55.82 0.86 Allowed 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.66 0.985 . . . . 1.0 113.66 -175.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 149.78 156.71 7.36 Favored Glycine 0 CA--C 1.537 1.43 0 CA-C-N 119.062 0.846 . . . . 1.0 114.932 172.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.57 -30.98 71.1 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.054 2.503 . . . . 1.0 114.158 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -62.54 -46.2 89.47 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.037 0.922 . . . . 1.0 111.181 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.38 -52.95 63.43 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 125.051 1.34 . . . . 1.0 109.972 176.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.7 t -58.01 -47.49 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 125.848 1.659 . . . . 1.0 111.669 -175.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.77 -37.64 88.3 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.675 0.79 . . . . 1.0 112.274 173.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.3 m -66.05 -29.72 70.12 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.009 0.523 . . . . 1.0 112.288 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 13.3 m0 -78.97 -6.19 55.67 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.085 1.143 . . . . 1.0 114.085 173.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.49 169.12 16.09 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 124.133 1.921 . . . . 1.0 114.624 -173.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 83.1 m -144.6 138.51 27.48 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 129.606 3.162 . . . . 1.0 108.156 -176.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -96.95 126.22 41.94 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.369 1.067 . . . . 1.0 109.81 -177.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.4 mt . . . . . 0 CA--C 1.533 0.297 0 C-N-CA 125.947 1.699 . . . . 1.0 110.926 -177.508 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 111.265 0.098 . . . . 1.0 111.265 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 47.0 mmt-85 -65.32 62.25 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 126.783 2.033 . . . . 1.0 112.942 173.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -54.95 133.75 48.39 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 128.636 2.775 . . . . 1.0 110.91 177.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 95.1 t -75.12 135.83 26.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 113.445 -1.707 . . . . 1.0 111.019 171.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.1 mttp -111.09 124.39 52.09 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.681 -1.6 . . . . 1.0 106.681 167.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.04 145.86 28.26 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 104.599 -2.371 . . . . 1.0 104.599 167.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -128.96 141.47 51.25 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.73 -1.211 . . . . 1.0 107.73 173.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -132.82 139.63 47.59 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.897 1.279 . . . . 1.0 109.157 178.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -106.7 109.7 63.27 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.002 0.521 . . . . 1.0 112.275 -174.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -52.5 -27.97 34.3 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.325 3.35 . . . . 1.0 115.808 175.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -86.29 -17.27 35.06 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.218 1.192 . . . . 1.0 114.218 -174.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.3 p -129.85 -22.45 2.92 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.046 1.128 . . . . 1.0 114.046 -174.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.4 7.73 82.97 Favored Glycine 0 CA--C 1.538 1.527 0 C-N-CA 124.308 0.956 . . . . 1.0 114.274 -172.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.08 156.82 29.8 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.071 1.436 . . . . 1.0 110.698 173.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.94 155.01 32.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 126.912 2.085 . . . . 1.0 109.55 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.38 168.38 10.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 C-N-CA 127.621 2.369 . . . . 1.0 109.299 177.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -147.51 121.46 9.38 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 127.715 2.406 . . . . 1.0 109.139 173.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.94 151.45 37.03 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.833 0.853 . . . . 1.0 109.977 -178.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -90.32 7.71 37.08 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 120.952 -1.093 . . . . 1.0 112.443 174.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.63 -165.34 21.53 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 126.66 2.076 . . . . 1.0 113.414 -172.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.39 170.29 27.48 Favored Glycine 0 CA--C 1.537 1.414 0 N-CA-C 117.071 1.588 . . . . 1.0 117.071 169.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -57.96 102.56 0.1 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.382 2.273 . . . . 1.0 108.667 169.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -130.3 132.99 46.14 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.121 1.368 . . . . 1.0 109.747 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.5 tttt -50.39 -66.34 0.41 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.677 1.732 . . . . 1.0 115.677 -168.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 40.8 m -60.46 -41.66 94.61 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 119.301 0.955 . . . . 1.0 112.032 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 46.0 tp -58.49 -38.26 77.27 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.154 0.981 . . . . 1.0 111.62 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -69.05 -36.06 77.26 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.971 0.908 . . . . 1.0 112.358 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -66.45 -42.03 88.24 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.463 1.029 . . . . 1.0 110.444 178.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -61.92 -37.95 86.58 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.454 0.539 . . . . 1.0 112.454 177.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -65.52 -34.8 79.1 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.489 -0.757 . . . . 1.0 112.175 172.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.63 -49.04 62.35 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.537 0.684 . . . . 1.0 111.317 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -74.79 -33.74 62.29 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.909 1.683 . . . . 1.0 114.58 -169.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.1 m-90 -133.41 -47.99 0.83 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.7 1.0 . . . . 1.0 113.7 -176.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.54 154.17 6.18 Favored Glycine 0 N--CA 1.478 1.436 0 N-CA-C 115.047 0.779 . . . . 1.0 115.047 169.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -61.17 -35.06 87.76 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.111 2.541 . . . . 1.0 114.051 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.4 -45.62 93.56 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.722 0.773 . . . . 1.0 111.449 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.81 -54.92 40.66 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.138 -1.392 . . . . 1.0 109.831 175.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 32.5 t -57.7 -48.34 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.62 1.568 . . . . 1.0 112.06 -174.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -66.42 -35.25 79.84 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.11 0.564 . . . . 1.0 111.906 175.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.9 m -67.81 -30.19 69.54 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.67 -0.644 . . . . 1.0 112.608 178.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.2 m0 -74.2 -10.16 59.33 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.776 1.028 . . . . 1.0 113.776 173.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.73 168.47 16.53 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 124.048 1.88 . . . . 1.0 114.707 -172.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 87.2 m -144.0 138.7 28.59 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 129.6 3.16 . . . . 1.0 107.895 -175.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -99.03 127.03 44.87 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.373 1.069 . . . . 1.0 109.657 -176.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.4 mt . . . . . 0 CA--C 1.538 0.515 0 C-N-CA 126.039 1.736 . . . . 1.0 111.34 -175.165 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 111.173 0.064 . . . . 1.0 111.173 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.0 mmt85 -66.47 61.36 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 126.448 1.899 . . . . 1.0 113.661 176.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -54.83 130.1 39.75 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 128.855 2.862 . . . . 1.0 110.549 177.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 83.1 t -71.69 133.2 32.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 113.683 -1.599 . . . . 1.0 111.01 173.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -106.56 120.94 43.26 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.442 -1.688 . . . . 1.0 106.442 167.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.16 144.06 29.24 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 103.899 -2.63 . . . . 1.0 103.899 167.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -127.24 139.4 52.95 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.791 -1.188 . . . . 1.0 107.791 175.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -131.78 139.49 48.94 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.678 1.191 . . . . 1.0 109.256 176.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -105.79 110.52 64.23 Favored Pre-proline 0 CA--C 1.545 0.761 0 N-CA-C 112.337 0.495 . . . . 1.0 112.337 -174.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -52.81 -27.79 35.94 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 124.441 3.427 . . . . 1.0 115.728 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -87.35 -17.22 32.89 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.777 1.231 . . . . 1.0 114.185 -174.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.1 p -130.2 -21.83 2.89 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.247 1.203 . . . . 1.0 114.247 -174.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.1 8.74 79.43 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.434 1.016 . . . . 1.0 114.295 -172.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -78.42 156.48 29.4 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.072 1.436 . . . . 1.0 110.727 172.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.5 t -136.41 154.99 33.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 126.907 2.083 . . . . 1.0 109.733 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.86 168.77 8.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 127.795 2.438 . . . . 1.0 109.558 177.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -147.26 121.49 9.55 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.762 2.425 . . . . 1.0 109.273 173.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.83 153.55 39.32 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.579 0.752 . . . . 1.0 109.913 -179.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -95.52 6.24 49.48 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.515 1.126 . . . . 1.0 111.927 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 131.38 -166.41 22.88 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 127.229 2.347 . . . . 1.0 113.515 -173.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.04 170.79 27.33 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-O 123.627 1.682 . . . . 1.0 117.301 169.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -57.58 100.45 0.05 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 127.938 2.495 . . . . 1.0 109.202 169.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -130.64 133.17 45.91 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.685 1.594 . . . . 1.0 110.139 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -50.55 -67.27 0.27 Allowed 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 115.875 1.805 . . . . 1.0 115.875 -168.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 37.4 m -59.7 -41.01 89.8 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 119.254 0.933 . . . . 1.0 112.056 -175.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 47.6 tp -58.57 -39.07 79.28 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.46 1.104 . . . . 1.0 111.694 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -68.09 -36.02 79.12 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.813 0.845 . . . . 1.0 112.292 175.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.94 -41.86 86.27 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.308 0.958 . . . . 1.0 110.752 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -63.02 -36.06 82.31 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.69 0.626 . . . . 1.0 112.69 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.2 -36.37 83.99 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.428 -0.795 . . . . 1.0 112.396 171.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.87 -48.08 67.08 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.303 0.573 . . . . 1.0 111.085 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -76.54 -33.61 58.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.633 1.573 . . . . 1.0 114.254 -169.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.0 m-90 -134.11 -46.92 0.78 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.108 1.151 . . . . 1.0 114.108 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.39 154.2 6.29 Favored Glycine 0 N--CA 1.479 1.561 0 CA-C-N 119.292 0.951 . . . . 1.0 115.318 169.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -62.88 -31.91 77.37 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.218 2.612 . . . . 1.0 113.93 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -63.1 -46.63 86.43 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.906 0.882 . . . . 1.0 111.016 176.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.99 -53.67 55.78 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 125.174 1.39 . . . . 1.0 109.89 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 24.9 t -56.85 -47.82 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 126.059 1.744 . . . . 1.0 111.771 -176.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -67.99 -34.57 76.78 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.419 0.526 . . . . 1.0 112.419 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.8 m -67.09 -31.76 72.46 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.829 0.677 . . . . 1.0 112.829 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -74.63 -11.38 60.18 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.21 1.189 . . . . 1.0 114.21 174.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.43 168.99 14.96 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 124.245 1.974 . . . . 1.0 115.131 -170.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.7 m -142.24 142.73 32.64 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 130.157 3.383 . . . . 1.0 107.636 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.2 tt -108.11 122.59 47.21 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.82 0.848 . . . . 1.0 109.409 -174.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 CA--C 1.538 0.499 0 C-N-CA 126.489 1.916 . . . . 1.0 110.814 -172.417 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 111.231 0.085 . . . . 1.0 111.231 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -67.41 58.81 0.05 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 126.654 1.982 . . . . 1.0 113.077 175.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.9 mttt -54.43 132.46 44.44 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 128.814 2.846 . . . . 1.0 111.48 177.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.0 t -75.14 134.77 28.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 113.403 -1.726 . . . . 1.0 111.574 173.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -109.61 123.13 48.92 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 106.96 -1.496 . . . . 1.0 106.96 167.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.13 143.9 29.38 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 104.287 -2.486 . . . . 1.0 104.287 168.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -123.55 136.01 54.31 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.257 -1.386 . . . . 1.0 107.257 173.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -135.3 97.4 3.7 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.246 1.018 . . . . 1.0 109.886 -169.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -72.09 119.52 75.02 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.465 1.106 . . . . 1.0 112.864 -169.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.1 -20.0 22.2 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 123.678 2.918 . . . . 1.0 114.239 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -83.91 -22.07 31.69 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.575 1.15 . . . . 1.0 113.793 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 62.6 p -127.42 -22.89 3.59 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.156 1.169 . . . . 1.0 114.156 -172.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.8 4.88 77.88 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-O 118.932 -0.927 . . . . 1.0 114.144 -171.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -74.13 155.45 38.41 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.46 1.63 . . . . 1.0 110.607 171.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 5.1 t -137.74 153.04 27.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 113.358 -1.746 . . . . 1.0 109.262 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.06 169.21 12.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 126.924 2.09 . . . . 1.0 109.122 177.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -147.44 121.52 9.46 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 127.537 2.335 . . . . 1.0 109.14 173.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.93 154.14 41.6 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.911 0.884 . . . . 1.0 109.756 -179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -95.41 8.79 42.16 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.109 -0.995 . . . . 1.0 112.002 174.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.38 -165.42 21.3 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 127.126 2.298 . . . . 1.0 113.335 -172.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.78 169.6 23.82 Favored Glycine 0 CA--C 1.537 1.453 0 N-CA-C 117.445 1.738 . . . . 1.0 117.445 169.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -57.76 101.25 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.559 2.344 . . . . 1.0 109.056 169.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -130.37 131.03 45.12 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.634 1.573 . . . . 1.0 109.839 178.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -49.39 -66.85 0.33 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.577 1.695 . . . . 1.0 115.577 -168.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.0 m -60.36 -40.39 90.57 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 119.36 0.982 . . . . 1.0 112.207 -175.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.7 tp -58.86 -38.47 78.86 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.334 1.053 . . . . 1.0 111.801 176.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.01 -36.51 80.09 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.476 0.711 . . . . 1.0 112.528 174.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.82 -41.98 86.61 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.296 0.953 . . . . 1.0 110.786 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -61.94 -38.41 88.38 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.532 0.568 . . . . 1.0 112.532 177.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -64.84 -34.77 79.16 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.529 -0.732 . . . . 1.0 112.177 172.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.61 -49.07 62.11 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.623 0.725 . . . . 1.0 110.945 176.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -73.22 -35.68 66.34 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.082 1.753 . . . . 1.0 114.425 -169.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.1 m-90 -132.81 -47.5 0.87 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.695 0.998 . . . . 1.0 113.695 -175.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.3 155.21 6.57 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.995 0.816 . . . . 1.0 114.676 169.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -61.77 -34.25 83.38 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.073 2.515 . . . . 1.0 113.788 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -61.12 -45.5 94.44 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 122.07 0.938 . . . . 1.0 111.339 177.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.47 -54.92 41.03 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 114.125 -1.398 . . . . 1.0 109.975 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.3 t -58.08 -46.32 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 125.448 1.499 . . . . 1.0 112.246 -174.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.0 -34.81 78.55 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.876 -0.515 . . . . 1.0 112.295 175.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.5 t -66.03 -32.38 73.82 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.622 -0.674 . . . . 1.0 112.339 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 27.9 m0 -73.37 -5.52 40.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.904 1.282 . . . . 1.0 113.663 173.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -75.16 168.48 19.9 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 124.151 1.929 . . . . 1.0 114.706 -175.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 84.0 m -147.86 139.72 24.01 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 130.134 3.373 . . . . 1.0 107.674 -176.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 30.3 tp -99.24 127.07 45.18 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.315 1.046 . . . . 1.0 109.786 -177.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.5 mt . . . . . 0 CA--C 1.537 0.471 0 C-N-CA 126.175 1.79 . . . . 1.0 110.993 -176.487 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 120.807 0.337 . . . . 1.0 111.652 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.4 mmt-85 -60.0 63.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 127.936 2.494 . . . . 1.0 113.083 170.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.6 mtpt -51.48 135.86 26.96 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 128.956 2.903 . . . . 1.0 112.038 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.4 t -75.69 135.53 26.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 112.936 -1.938 . . . . 1.0 110.642 169.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -111.03 123.47 50.25 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.521 -1.659 . . . . 1.0 106.521 167.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -83.47 145.08 29.15 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 104.209 -2.515 . . . . 1.0 104.209 168.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -127.61 140.27 52.21 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 107.668 -1.234 . . . . 1.0 107.668 172.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -131.7 131.1 42.8 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.42 1.088 . . . . 1.0 109.736 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -96.81 110.1 51.83 Favored Pre-proline 0 CA--C 1.543 0.696 0 C-N-CA 123.043 0.537 . . . . 1.0 111.784 -173.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -65.48 -15.56 50.18 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.583 2.855 . . . . 1.0 114.312 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -88.88 -17.48 29.54 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 114.444 1.276 . . . . 1.0 114.444 178.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 38.5 p -129.72 -22.77 2.93 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 114.481 1.289 . . . . 1.0 114.481 -175.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.51 7.2 87.11 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 124.359 0.98 . . . . 1.0 114.36 -172.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.18 156.08 30.04 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.211 1.505 . . . . 1.0 110.785 173.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.12 153.66 32.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 C-N-CA 126.695 1.998 . . . . 1.0 109.635 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.68 167.74 12.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 127.626 2.371 . . . . 1.0 109.193 177.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -146.8 121.57 9.89 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.752 2.421 . . . . 1.0 109.279 173.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.84 152.01 38.02 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.683 0.793 . . . . 1.0 109.904 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -92.1 7.93 40.17 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 121.069 -1.019 . . . . 1.0 112.116 174.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 130.36 -166.01 22.43 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 126.702 2.096 . . . . 1.0 113.432 -173.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.99 170.34 26.27 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 117.196 1.638 . . . . 1.0 117.196 169.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -57.71 100.42 0.05 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.698 2.399 . . . . 1.0 109.015 169.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -130.52 128.04 40.35 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.559 1.544 . . . . 1.0 109.764 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -44.25 -68.29 0.21 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.386 1.624 . . . . 1.0 115.386 -168.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.8 m -59.83 -41.68 91.87 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 119.185 0.902 . . . . 1.0 112.17 -174.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.5 tp -59.27 -38.89 81.23 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.146 0.979 . . . . 1.0 111.545 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.0 mmmt -69.75 -32.46 71.0 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 118.527 -0.749 . . . . 1.0 112.965 175.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -69.12 -42.44 76.04 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.514 1.052 . . . . 1.0 110.922 176.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -61.49 -37.35 83.35 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.685 0.624 . . . . 1.0 112.685 178.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -66.09 -34.45 78.08 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.548 -0.72 . . . . 1.0 112.38 172.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.53 -48.73 63.56 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.824 0.821 . . . . 1.0 111.236 175.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -74.54 -34.15 62.9 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.941 1.697 . . . . 1.0 114.567 -169.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 17.1 m-90 -132.75 -48.06 0.88 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 113.78 1.03 . . . . 1.0 113.78 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.57 153.75 6.07 Favored Glycine 0 N--CA 1.476 1.333 0 CA-C-N 118.908 0.776 . . . . 1.0 114.648 169.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.61 -34.68 84.03 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.061 2.507 . . . . 1.0 113.806 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.24 -45.3 95.09 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.986 0.898 . . . . 1.0 111.124 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.18 -55.98 27.21 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.263 -1.335 . . . . 1.0 109.72 175.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 38.9 t -57.87 -46.55 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 125.466 1.506 . . . . 1.0 112.111 -174.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -67.27 -35.69 80.04 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.86 -0.525 . . . . 1.0 112.048 176.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.3 t -65.63 -34.04 77.3 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.72 -0.613 . . . . 1.0 112.217 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 25.6 m0 -70.72 -11.53 61.0 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.027 1.121 . . . . 1.0 114.027 174.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.95 168.32 17.22 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 124.141 1.924 . . . . 1.0 114.76 -171.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 88.5 m -143.58 136.55 27.62 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 129.314 3.045 . . . . 1.0 108.243 -176.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 38.6 tp -96.03 126.54 41.34 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.254 1.022 . . . . 1.0 110.115 -176.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.9 mt . . . . . 0 CA--C 1.537 0.479 0 C-N-CA 125.654 1.582 . . . . 1.0 110.812 -175.773 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 119.845 -0.121 . . . . 1.0 110.81 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.0 mmp_? -63.45 59.25 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 127.432 2.293 . . . . 1.0 114.465 175.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -55.02 131.04 43.98 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 128.8 2.84 . . . . 1.0 110.395 174.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 85.0 t -74.26 133.86 30.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 113.437 -1.71 . . . . 1.0 111.315 173.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.4 mttp -107.77 122.17 46.2 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 106.505 -1.665 . . . . 1.0 106.505 167.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.04 145.17 28.63 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 104.32 -2.474 . . . . 1.0 104.32 168.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -128.06 142.84 51.1 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.158 -1.052 . . . . 1.0 108.158 172.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -132.68 141.08 48.43 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.046 1.338 . . . . 1.0 109.576 177.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -108.13 109.12 61.82 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 123.119 0.567 . . . . 1.0 112.496 -173.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -53.28 -26.8 35.81 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.36 3.374 . . . . 1.0 115.603 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -87.91 -19.6 27.1 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.475 1.11 . . . . 1.0 113.731 -174.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 45.9 p -129.97 -19.45 3.24 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.563 1.319 . . . . 1.0 114.563 -171.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.12 11.69 75.17 Favored Glycine 0 CA--C 1.539 1.57 0 C-N-CA 124.002 0.81 . . . . 1.0 114.215 -173.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -75.89 150.74 37.51 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.429 1.492 . . . . 1.0 109.405 171.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -133.08 155.09 40.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 C-N-CA 126.506 1.923 . . . . 1.0 108.936 172.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.7 167.9 12.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 127.537 2.335 . . . . 1.0 109.267 177.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -146.96 121.14 9.5 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 127.653 2.381 . . . . 1.0 108.92 173.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.0 154.54 42.65 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.825 0.85 . . . . 1.0 109.937 -178.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -95.67 9.83 38.97 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 121.118 -0.989 . . . . 1.0 111.856 174.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 126.1 -166.38 18.89 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 127.086 2.279 . . . . 1.0 113.396 -172.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.05 170.12 29.35 Favored Glycine 0 CA--C 1.535 1.311 0 N-CA-C 117.481 1.752 . . . . 1.0 117.481 169.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -57.49 100.02 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 128.119 2.568 . . . . 1.0 109.147 169.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.3 t60 -130.4 136.9 49.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.344 1.458 . . . . 1.0 110.69 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -49.99 -70.92 0.07 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 125.525 1.53 . . . . 1.0 114.809 -169.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.0 m -60.5 -40.68 92.26 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 118.918 0.781 . . . . 1.0 111.87 -173.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.96 -39.34 77.88 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.282 1.033 . . . . 1.0 111.725 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.82 -36.05 77.73 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.493 0.717 . . . . 1.0 112.407 175.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -67.27 -42.37 83.97 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.248 0.931 . . . . 1.0 110.977 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -61.37 -38.6 87.59 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.821 0.675 . . . . 1.0 112.821 176.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -64.74 -34.9 79.42 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.694 -0.628 . . . . 1.0 112.148 173.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.27 -48.74 64.21 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.645 0.736 . . . . 1.0 110.978 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.58 -34.63 60.66 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.658 1.583 . . . . 1.0 114.79 -169.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.7 m-90 -132.01 -48.15 0.94 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.832 1.049 . . . . 1.0 113.832 -176.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.96 153.94 6.17 Favored Glycine 0 N--CA 1.479 1.557 0 CA-C-N 118.908 0.776 . . . . 1.0 114.856 169.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -61.51 -34.5 85.47 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.945 2.43 . . . . 1.0 113.959 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -60.96 -45.94 92.73 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 122.032 0.92 . . . . 1.0 111.248 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.91 -54.74 42.65 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.296 -1.32 . . . . 1.0 109.922 176.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.4 t -57.87 -47.34 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 125.594 1.557 . . . . 1.0 112.074 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -66.92 -35.59 80.33 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.273 0.629 . . . . 1.0 112.163 175.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.5 m -66.47 -30.07 70.33 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 118.537 0.608 . . . . 1.0 112.514 178.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 19.2 m0 -75.6 -8.89 57.92 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.057 1.132 . . . . 1.0 114.057 173.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.1 168.81 16.34 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 124.118 1.913 . . . . 1.0 114.939 -172.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 91.4 m -144.54 142.92 30.56 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 130.177 3.391 . . . . 1.0 108.161 -176.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.96 123.6 48.41 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.025 0.93 . . . . 1.0 109.703 -176.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 CA--C 1.539 0.545 0 C-N-CA 126.744 2.018 . . . . 1.0 110.77 -173.563 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 120.336 0.112 . . . . 1.0 111.03 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 44.8 mmt-85 -67.47 61.51 0.06 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 126.392 1.877 . . . . 1.0 112.806 174.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -55.21 132.72 48.33 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 128.739 2.816 . . . . 1.0 111.207 178.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 84.3 t -74.02 134.12 30.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 113.411 -1.722 . . . . 1.0 111.78 173.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -108.0 123.13 48.19 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 106.379 -1.711 . . . . 1.0 106.379 167.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.4 145.24 28.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 104.38 -2.452 . . . . 1.0 104.38 168.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -127.5 141.83 51.55 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.027 -1.101 . . . . 1.0 108.027 172.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -133.04 139.1 47.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.629 1.172 . . . . 1.0 109.27 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.8 t-20 -106.08 110.51 64.07 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 112.372 0.508 . . . . 1.0 112.372 -173.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -52.96 -28.27 39.04 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 124.469 3.446 . . . . 1.0 115.793 175.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -86.34 -17.88 33.35 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.32 1.23 . . . . 1.0 114.32 -174.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.1 p -129.27 -22.8 3.06 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 114.0 1.111 . . . . 1.0 114.0 -173.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.37 8.31 83.56 Favored Glycine 0 CA--C 1.538 1.531 0 C-N-CA 124.265 0.936 . . . . 1.0 114.175 -172.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -79.18 157.12 27.93 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 123.137 1.446 . . . . 1.0 110.683 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.1 t -136.65 154.6 32.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 C-N-CA 127.149 2.18 . . . . 1.0 109.496 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.14 167.72 11.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 127.335 2.254 . . . . 1.0 109.301 177.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -146.99 120.58 9.12 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 127.674 2.389 . . . . 1.0 109.206 174.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.58 153.07 39.93 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.707 0.803 . . . . 1.0 109.93 -179.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -95.36 7.33 46.53 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.332 1.053 . . . . 1.0 111.609 176.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 130.82 -166.76 22.46 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 127.006 2.241 . . . . 1.0 113.444 -172.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.41 170.2 23.4 Favored Glycine 0 CA--C 1.536 1.398 0 N-CA-C 117.505 1.762 . . . . 1.0 117.505 170.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -57.6 100.91 0.06 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.728 2.411 . . . . 1.0 108.984 169.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -130.51 131.79 45.28 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.378 1.471 . . . . 1.0 109.875 177.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -48.72 -67.68 0.25 Allowed 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.767 1.766 . . . . 1.0 115.767 -168.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 36.9 m -59.72 -41.29 90.53 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-N 119.194 0.907 . . . . 1.0 112.084 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.9 tp -58.45 -39.12 79.0 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.939 0.896 . . . . 1.0 111.736 177.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -68.34 -35.81 78.32 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.35 0.66 . . . . 1.0 112.293 175.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -67.15 -42.02 85.05 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.366 0.984 . . . . 1.0 110.779 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -62.52 -37.82 87.53 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.606 0.595 . . . . 1.0 112.606 177.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -65.44 -34.3 77.96 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.701 -0.624 . . . . 1.0 112.528 172.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.14 -48.99 60.92 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.505 0.669 . . . . 1.0 111.17 176.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -74.53 -34.69 63.06 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.087 1.755 . . . . 1.0 114.587 -169.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.0 m-90 -132.89 -46.11 0.86 Allowed 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.847 1.054 . . . . 1.0 113.847 -176.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.46 153.9 6.33 Favored Glycine 0 N--CA 1.479 1.505 0 CA-C-N 118.94 0.791 . . . . 1.0 115.024 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -61.75 -33.35 85.71 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.947 2.431 . . . . 1.0 113.949 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -61.18 -45.98 92.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.836 0.826 . . . . 1.0 111.316 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.87 -54.94 40.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.107 1.363 . . . . 1.0 109.967 175.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.9 t -57.98 -47.91 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 125.577 1.551 . . . . 1.0 111.889 -174.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -67.09 -34.89 78.62 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.918 -0.489 . . . . 1.0 112.098 176.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.2 m -67.39 -30.3 70.04 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.667 -0.645 . . . . 1.0 112.572 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.3 m0 -74.41 -10.77 59.9 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.04 1.126 . . . . 1.0 114.04 173.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.65 168.39 17.79 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 124.213 1.959 . . . . 1.0 114.809 -171.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 93.4 m -144.21 142.44 30.51 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 130.083 3.353 . . . . 1.0 107.91 -175.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -107.24 124.13 49.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.925 0.89 . . . . 1.0 109.624 -176.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.6 mt . . . . . 0 CA--C 1.538 0.494 0 C-N-CA 126.524 1.93 . . . . 1.0 110.962 -173.218 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.386 0.136 . . . . 1.0 111.253 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.5 mmt-85 -69.03 56.25 0.09 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 126.667 1.987 . . . . 1.0 113.168 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -56.05 128.92 37.72 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 128.594 2.757 . . . . 1.0 110.715 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 91.2 t -71.98 135.21 28.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 113.618 -1.628 . . . . 1.0 110.801 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -109.31 121.72 45.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 106.691 -1.596 . . . . 1.0 106.691 167.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.01 144.11 29.33 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 103.887 -2.634 . . . . 1.0 103.887 167.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -127.38 140.03 52.45 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.87 -1.159 . . . . 1.0 107.87 174.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -131.75 134.78 46.23 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.738 1.215 . . . . 1.0 109.616 178.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -99.82 110.41 59.03 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 123.209 0.604 . . . . 1.0 111.651 -173.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -66.37 -14.83 45.85 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.181 2.588 . . . . 1.0 114.3 -179.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -89.17 -20.77 23.8 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.599 1.16 . . . . 1.0 114.084 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.6 p -129.99 -20.98 3.05 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.24 1.57 . . . . 1.0 115.24 -171.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.33 10.71 82.14 Favored Glycine 0 CA--C 1.541 1.696 0 C-N-CA 123.857 0.742 . . . . 1.0 114.302 -173.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -74.06 148.76 41.61 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.181 1.392 . . . . 1.0 109.273 170.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.8 t -132.19 154.74 40.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 C-N-CA 126.362 1.865 . . . . 1.0 108.974 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.43 168.08 10.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 127.53 2.332 . . . . 1.0 109.417 177.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -147.21 120.26 8.81 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.808 2.443 . . . . 1.0 109.174 173.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.98 157.79 43.87 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.16 0.984 . . . . 1.0 109.98 -178.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -99.07 11.59 38.57 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 120.792 -1.192 . . . . 1.0 111.855 176.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 123.71 -167.01 16.03 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 127.165 2.317 . . . . 1.0 112.971 -171.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.23 169.5 32.03 Favored Glycine 0 CA--C 1.536 1.393 0 N-CA-C 117.329 1.692 . . . . 1.0 117.329 169.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -57.7 99.3 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 128.057 2.543 . . . . 1.0 109.14 169.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -130.55 132.87 45.8 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.345 1.458 . . . . 1.0 110.583 178.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.7 tppt? -44.83 -71.24 0.08 Allowed 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 125.747 1.619 . . . . 1.0 114.995 -169.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.8 m -61.45 -40.06 93.11 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 118.532 0.605 . . . . 1.0 111.947 -173.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.7 tp -58.25 -40.4 81.68 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.259 1.024 . . . . 1.0 111.488 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -69.65 -32.2 70.72 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.681 0.792 . . . . 1.0 112.982 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.95 -42.59 76.45 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.619 1.1 . . . . 1.0 111.225 176.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.0 m0 -61.14 -36.69 80.44 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.627 0.603 . . . . 1.0 112.627 177.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -65.11 -36.47 84.39 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.424 -0.798 . . . . 1.0 112.611 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.24 -48.01 71.91 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.472 0.653 . . . . 1.0 110.989 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -76.27 -34.05 59.13 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.304 1.442 . . . . 1.0 114.64 -169.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.6 m-90 -134.02 -48.26 0.79 Allowed 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.942 1.089 . . . . 1.0 113.942 -176.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.7 153.73 6.06 Favored Glycine 0 N--CA 1.48 1.627 0 CA-C-N 119.34 0.973 . . . . 1.0 115.265 169.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.57 -33.34 78.42 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 123.212 2.608 . . . . 1.0 114.214 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -62.85 -46.79 86.25 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 122.168 0.985 . . . . 1.0 111.042 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.78 -53.66 55.91 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.313 1.445 . . . . 1.0 109.935 176.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 28.1 t -57.29 -47.79 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 125.774 1.629 . . . . 1.0 111.778 -175.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.89 -36.0 82.2 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.3 0.64 . . . . 1.0 112.562 174.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.2 m -66.84 -30.75 71.02 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.585 0.587 . . . . 1.0 112.585 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 16.2 m0 -75.83 -8.78 57.7 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.947 1.091 . . . . 1.0 113.947 173.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.7 168.9 16.78 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 124.032 1.872 . . . . 1.0 114.831 -172.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 94.9 m -142.53 141.74 32.12 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 130.521 3.529 . . . . 1.0 107.632 -176.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.08 123.32 47.83 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.779 0.832 . . . . 1.0 109.64 -175.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.4 mt . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 126.525 1.93 . . . . 1.0 110.927 -173.496 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.462 0 CA-C-O 120.491 0.186 . . . . 1.0 111.337 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 29.9 mmt-85 -69.46 58.27 0.12 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 126.483 1.913 . . . . 1.0 112.637 175.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -55.89 130.96 45.74 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 128.634 2.774 . . . . 1.0 110.995 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.5 t -73.62 134.1 30.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 113.584 -1.643 . . . . 1.0 110.95 172.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 40.2 mttt -108.45 122.32 46.78 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 106.777 -1.564 . . . . 1.0 106.777 167.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.53 144.1 28.9 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 103.932 -2.618 . . . . 1.0 103.932 167.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.4 ' CD1' ' HB2' ' A' ' 120' ' ' ALA . 76.4 m-85 -127.46 138.58 52.99 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 107.84 -1.17 . . . . 1.0 107.84 173.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -131.73 125.97 33.33 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.61 1.164 . . . . 1.0 109.847 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -92.41 110.79 47.11 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 123.163 0.585 . . . . 1.0 111.767 -172.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -65.87 -14.56 45.16 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.371 2.714 . . . . 1.0 114.659 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -88.94 -18.08 28.21 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.169 1.174 . . . . 1.0 114.169 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.2 p -129.51 -22.9 2.97 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.382 1.252 . . . . 1.0 114.382 -174.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 76.86 7.55 86.32 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 124.361 0.982 . . . . 1.0 114.486 -172.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -78.05 156.33 30.12 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 119.243 1.521 . . . . 1.0 110.877 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 20.9 t -136.44 153.66 31.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 C-N-CA 126.691 1.997 . . . . 1.0 109.814 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.58 168.07 12.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 127.658 2.383 . . . . 1.0 109.405 177.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -146.74 120.89 9.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.736 2.414 . . . . 1.0 109.136 173.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.92 155.89 43.16 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.898 0.879 . . . . 1.0 109.897 -178.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -97.81 10.15 40.85 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.113 -0.992 . . . . 1.0 111.693 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 126.12 -165.31 19.36 Favored Glycine 0 CA--C 1.532 1.143 0 C-N-CA 127.227 2.346 . . . . 1.0 113.085 -171.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.07 168.44 26.14 Favored Glycine 0 CA--C 1.535 1.32 0 N-CA-C 117.157 1.623 . . . . 1.0 117.157 169.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -57.59 100.49 0.05 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 127.421 2.288 . . . . 1.0 109.035 169.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -130.38 126.34 36.83 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.692 1.597 . . . . 1.0 109.534 178.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -44.84 -66.6 0.37 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 115.774 1.768 . . . . 1.0 115.774 -168.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.8 m -60.46 -40.98 93.17 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.403 1.001 . . . . 1.0 112.132 -175.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.6 tp -59.5 -39.07 82.61 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.053 0.941 . . . . 1.0 111.545 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -68.56 -32.56 72.57 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.628 0.771 . . . . 1.0 113.036 175.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -68.87 -42.64 76.74 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.426 1.012 . . . . 1.0 110.909 176.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.8 m0 -62.06 -36.01 80.35 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.426 0.528 . . . . 1.0 112.426 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.9 -36.11 82.48 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.5 -0.75 . . . . 1.0 112.464 172.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.07 -48.89 66.87 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.859 0.837 . . . . 1.0 111.004 176.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.2 -33.02 61.37 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.706 1.602 . . . . 1.0 114.546 -169.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -134.5 -48.43 0.77 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.832 1.049 . . . . 1.0 113.832 -176.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.62 153.91 6.11 Favored Glycine 0 N--CA 1.479 1.529 0 CA-C-N 119.35 0.977 . . . . 1.0 115.148 169.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.49 -32.87 80.18 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 123.043 2.496 . . . . 1.0 114.187 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -62.64 -46.61 87.41 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.0 0.905 . . . . 1.0 111.027 176.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.85 -53.81 54.19 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.202 1.401 . . . . 1.0 109.648 176.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.8 t -57.53 -47.09 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 C-N-CA 125.872 1.669 . . . . 1.0 111.788 -175.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.81 -37.99 89.48 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.362 0.665 . . . . 1.0 112.373 173.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 56.7 m -66.51 -29.88 70.08 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.051 0.54 . . . . 1.0 112.435 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 26.8 m0 -74.83 -10.3 59.37 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.184 1.179 . . . . 1.0 114.184 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.4 ' HB2' ' CD1' ' A' ' 85' ' ' TYR . . . -71.83 168.73 17.26 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 124.09 1.9 . . . . 1.0 115.075 -171.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 63.7 m -144.18 139.59 28.84 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 129.857 3.263 . . . . 1.0 108.369 -176.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.6 tp -97.86 126.44 43.24 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.4 1.08 . . . . 1.0 109.763 -177.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.6 mt . . . . . 0 CA--C 1.537 0.446 0 C-N-CA 125.776 1.631 . . . . 1.0 111.12 -177.293 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.613 0.244 . . . . 1.0 111.631 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 50.8 mmt-85 -69.68 61.24 0.16 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 126.124 1.769 . . . . 1.0 112.915 175.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.8 mttt -58.12 131.67 51.21 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 128.413 2.685 . . . . 1.0 110.577 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.3 t -70.66 134.53 29.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 113.572 -1.649 . . . . 1.0 110.996 171.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.4 mttt -107.99 120.1 41.34 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 106.833 -1.543 . . . . 1.0 106.833 167.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.91 143.69 31.48 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 103.21 -2.885 . . . . 1.0 103.21 167.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -127.2 142.5 51.47 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.841 -1.17 . . . . 1.0 107.841 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.68 142.32 49.79 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.869 1.268 . . . . 1.0 109.546 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -109.26 109.6 60.45 Favored Pre-proline 0 CA--C 1.548 0.892 0 N-CA-C 112.846 0.684 . . . . 1.0 112.846 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_exo -53.13 -27.58 37.7 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 124.345 3.363 . . . . 1.0 115.743 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -89.35 -21.62 23.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.774 1.229 . . . . 1.0 114.087 -173.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.5 p -127.04 -17.97 4.72 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 114.286 1.217 . . . . 1.0 114.286 -171.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.71 11.16 72.89 Favored Glycine 0 CA--C 1.541 1.699 0 C-N-CA 123.843 0.735 . . . . 1.0 114.218 -174.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -78.18 150.92 33.45 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.716 1.606 . . . . 1.0 109.696 174.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 t -132.97 154.7 40.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 126.614 1.966 . . . . 1.0 108.913 172.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.28 168.35 10.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 127.372 2.269 . . . . 1.0 109.575 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -146.95 119.77 8.66 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 127.669 2.388 . . . . 1.0 109.605 172.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.97 149.87 34.03 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.894 0.878 . . . . 1.0 109.748 -178.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -92.41 9.9 32.26 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 120.851 -1.155 . . . . 1.0 111.907 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.89 -166.1 20.66 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 127.105 2.288 . . . . 1.0 113.363 -170.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.51 168.2 27.21 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 125.466 1.508 . . . . 1.0 116.818 170.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -56.95 102.57 0.09 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 127.234 2.214 . . . . 1.0 109.077 169.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -130.8 135.13 47.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.031 1.332 . . . . 1.0 111.061 177.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -49.46 -69.17 0.12 Allowed 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 126.2 1.8 . . . . 1.0 114.811 -169.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 38.2 m -62.09 -39.51 92.72 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.35 -0.844 . . . . 1.0 111.942 -175.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.4 tp -58.6 -39.42 80.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.464 1.106 . . . . 1.0 111.557 176.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -67.52 -36.23 80.62 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.656 0.783 . . . . 1.0 112.273 175.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -67.32 -42.03 84.31 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.106 0.866 . . . . 1.0 111.313 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 34.9 m0 -61.78 -37.23 83.56 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.69 0.626 . . . . 1.0 112.69 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -64.85 -36.0 82.95 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 121.343 -0.848 . . . . 1.0 112.139 172.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.07 -49.01 66.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.667 0.746 . . . . 1.0 110.816 176.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -69.82 -37.37 76.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.531 1.533 . . . . 1.0 113.726 -170.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 11.6 m-90 -133.84 -54.55 0.87 Allowed 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.62 0.97 . . . . 1.0 113.62 -175.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 147.75 157.24 7.37 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-N 118.974 0.806 . . . . 1.0 114.934 172.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.78 -30.29 68.69 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.954 2.436 . . . . 1.0 113.842 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -62.43 -46.86 86.63 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.083 0.953 . . . . 1.0 111.086 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.84 -52.68 64.68 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.048 1.339 . . . . 1.0 109.979 176.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 38.0 t -57.42 -47.88 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 C-N-CA 125.843 1.657 . . . . 1.0 111.842 -176.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.63 -37.84 88.95 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.838 0.855 . . . . 1.0 112.587 173.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.5 m -65.31 -29.06 69.78 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.771 -0.581 . . . . 1.0 112.535 -178.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -80.74 -5.71 57.47 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.374 1.249 . . . . 1.0 114.374 174.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.27 168.65 16.86 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 124.026 1.87 . . . . 1.0 115.1 -172.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 67.7 m -142.12 135.64 29.27 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 130.083 3.353 . . . . 1.0 108.696 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 26.6 tp -87.86 126.87 35.27 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.641 1.176 . . . . 1.0 110.163 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 CA--C 1.543 0.688 0 C-N-CA 126.936 2.095 . . . . 1.0 110.361 176.905 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.282 0.087 . . . . 1.0 111.15 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.9 mmt-85 -67.56 59.16 0.06 Allowed 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 126.611 1.964 . . . . 1.0 112.996 175.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.4 mttt -54.91 132.75 47.32 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 128.869 2.867 . . . . 1.0 111.074 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.1 t -74.77 134.73 28.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 113.464 -1.698 . . . . 1.0 111.692 174.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.5 mttp -108.68 122.51 47.27 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 106.598 -1.63 . . . . 1.0 106.598 167.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.19 145.68 28.23 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 104.607 -2.368 . . . . 1.0 104.607 168.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -128.03 142.12 51.32 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.907 -1.146 . . . . 1.0 107.907 172.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -133.83 138.03 45.41 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.989 1.316 . . . . 1.0 109.137 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -105.51 110.31 64.14 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 112.348 0.499 . . . . 1.0 112.348 -173.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -53.29 -27.76 39.99 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 124.405 3.404 . . . . 1.0 115.694 176.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -86.58 -17.47 33.89 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.771 1.228 . . . . 1.0 114.216 -174.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.5 p -129.45 -22.32 3.06 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.267 1.21 . . . . 1.0 114.267 -174.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.95 8.13 82.32 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.369 0.985 . . . . 1.0 114.169 -172.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.15 156.67 29.76 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 119.141 1.47 . . . . 1.0 110.745 173.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -136.62 154.97 33.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 126.799 2.04 . . . . 1.0 109.194 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.71 168.02 10.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 127.513 2.325 . . . . 1.0 109.28 178.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -147.49 121.83 9.64 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 127.735 2.414 . . . . 1.0 109.148 174.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.31 153.6 41.44 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.731 0.812 . . . . 1.0 109.663 -179.081 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -94.51 8.13 43.22 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.964 -1.085 . . . . 1.0 111.807 174.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.51 -166.66 20.97 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 126.919 2.2 . . . . 1.0 113.4 -172.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.47 169.82 26.83 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-O 123.603 1.668 . . . . 1.0 116.886 169.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -57.69 102.97 0.11 Allowed 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 127.644 2.378 . . . . 1.0 108.818 169.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.4 t60 -130.51 131.87 45.32 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 1.0 109.767 178.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.4 tttt -49.75 -66.02 0.46 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 115.903 1.816 . . . . 1.0 115.903 -168.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 41.2 m -60.49 -41.23 93.84 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 119.488 1.04 . . . . 1.0 111.891 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.1 tp -59.05 -38.52 79.57 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.103 0.961 . . . . 1.0 111.482 177.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.31 -36.11 78.83 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.681 0.792 . . . . 1.0 112.399 175.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -66.8 -42.14 86.43 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.331 0.969 . . . . 1.0 110.75 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -61.71 -38.45 87.9 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.695 0.628 . . . . 1.0 112.695 177.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -65.34 -34.28 77.95 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.53 -0.732 . . . . 1.0 112.38 172.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.02 58.87 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.567 0.699 . . . . 1.0 111.24 176.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -74.58 -34.09 62.81 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.906 1.682 . . . . 1.0 114.669 -169.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -132.89 -47.16 0.86 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.588 0.958 . . . . 1.0 113.588 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.34 154.21 6.3 Favored Glycine 0 N--CA 1.477 1.368 0 CA-C-N 118.952 0.796 . . . . 1.0 115.084 169.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.65 -33.89 85.38 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.088 2.526 . . . . 1.0 113.864 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -61.23 -45.98 92.32 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 122.038 0.923 . . . . 1.0 111.286 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.66 -54.84 41.75 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 114.211 -1.358 . . . . 1.0 109.827 175.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 36.4 t -58.07 -47.37 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 125.462 1.505 . . . . 1.0 112.043 -174.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.32 -35.76 80.08 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.778 -0.576 . . . . 1.0 111.979 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.2 t -65.4 -33.62 76.38 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.476 0.58 . . . . 1.0 112.195 178.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 28.1 m0 -71.55 -11.84 61.06 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.093 1.146 . . . . 1.0 114.093 174.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.15 168.52 17.02 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 124.041 1.877 . . . . 1.0 114.98 -171.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 91.2 m -144.29 143.45 31.01 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 130.213 3.405 . . . . 1.0 107.958 -175.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -108.41 124.25 50.1 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.899 0.88 . . . . 1.0 109.587 -176.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.6 mt . . . . . 0 CA--C 1.538 0.49 0 C-N-CA 126.817 2.047 . . . . 1.0 110.819 -172.671 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.425 0.155 . . . . 1.0 111.349 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.2 mmt-85 -69.65 56.22 0.12 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 126.602 1.961 . . . . 1.0 113.049 176.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -55.07 130.87 43.5 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 129.056 2.943 . . . . 1.0 111.123 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 74.2 t -73.39 132.84 32.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 113.729 -1.578 . . . . 1.0 111.973 173.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.9 mttt -106.43 121.92 45.24 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.753 -1.573 . . . . 1.0 106.753 167.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -83.83 144.66 29.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 103.714 -2.698 . . . . 1.0 103.714 167.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.401 ' CD1' ' HB2' ' A' ' 120' ' ' ALA . 71.2 m-85 -126.78 142.84 51.43 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.918 -1.141 . . . . 1.0 107.918 172.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -132.72 138.51 47.26 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.934 1.294 . . . . 1.0 109.088 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -105.02 110.66 64.8 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 112.317 0.488 . . . . 1.0 112.317 -174.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -53.05 -27.53 36.74 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.33 3.353 . . . . 1.0 115.998 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -87.41 -17.16 32.91 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.83 1.252 . . . . 1.0 114.086 -174.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 42.6 p -129.78 -22.46 2.94 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.362 1.245 . . . . 1.0 114.362 -174.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.76 7.24 83.36 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 124.369 0.985 . . . . 1.0 114.251 -172.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -77.79 156.79 30.29 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 123.14 1.448 . . . . 1.0 110.738 173.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -137.37 155.12 31.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 126.795 2.038 . . . . 1.0 109.461 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.25 169.64 9.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 127.266 2.226 . . . . 1.0 109.79 177.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -146.15 123.17 11.4 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 128.017 2.527 . . . . 1.0 109.641 170.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.06 155.42 43.34 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.897 0.879 . . . . 1.0 109.735 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.4 mttp -95.2 8.67 42.34 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.121 0.968 . . . . 1.0 111.872 173.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 125.94 -165.82 18.96 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 126.907 2.194 . . . . 1.0 113.232 -170.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.6 168.75 25.14 Favored Glycine 0 CA--C 1.535 1.3 0 N-CA-C 117.021 1.568 . . . . 1.0 117.021 170.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -57.68 102.05 0.09 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.322 2.249 . . . . 1.0 108.796 169.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -130.42 127.78 39.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.349 1.46 . . . . 1.0 109.6 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.1 tttt -45.39 -66.69 0.36 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 116.036 1.865 . . . . 1.0 116.036 -168.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.8 m -60.12 -41.25 92.24 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.23 0.923 . . . . 1.0 112.28 -177.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.5 tp -59.95 -38.7 83.19 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.897 0.879 . . . . 1.0 111.576 178.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -68.74 -32.78 72.79 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.679 0.792 . . . . 1.0 112.707 174.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -68.33 -42.9 78.66 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.563 1.074 . . . . 1.0 110.947 176.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.0 m0 -61.61 -36.37 80.52 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.555 0.576 . . . . 1.0 112.555 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.82 -36.05 82.39 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.45 -0.781 . . . . 1.0 112.432 172.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.2 -48.68 67.17 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.701 0.763 . . . . 1.0 111.024 176.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -75.38 -33.56 61.03 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.782 1.633 . . . . 1.0 114.336 -169.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.3 m-90 -134.46 -48.16 0.77 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.987 1.106 . . . . 1.0 113.987 -175.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.82 153.22 5.93 Favored Glycine 0 N--CA 1.479 1.518 0 CA-C-N 119.142 0.883 . . . . 1.0 115.225 169.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.3 -32.51 81.8 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.093 2.529 . . . . 1.0 114.356 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -62.43 -46.63 87.66 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 122.136 0.97 . . . . 1.0 111.03 176.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.39 -53.22 60.63 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 114.15 -1.386 . . . . 1.0 110.179 176.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 34.4 t -57.71 -47.49 85.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 C-N-CA 125.644 1.578 . . . . 1.0 111.88 -175.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.6 -38.08 89.77 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.451 0.7 . . . . 1.0 112.322 173.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.4 m -66.35 -29.66 69.89 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.414 0.524 . . . . 1.0 112.414 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -76.52 -8.85 58.03 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.953 1.094 . . . . 1.0 113.953 173.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.401 ' HB2' ' CD1' ' A' ' 85' ' ' TYR . . . -72.42 168.8 17.71 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 124.032 1.872 . . . . 1.0 114.866 -171.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 95.8 m -144.21 136.29 26.35 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 129.63 3.172 . . . . 1.0 108.444 -175.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 27.6 tp -92.76 128.16 38.53 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 124.663 1.185 . . . . 1.0 109.657 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.6 mt . . . . . 0 CA--C 1.535 0.4 0 C-N-CA 125.866 1.666 . . . . 1.0 111.246 -179.058 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 120.348 0.118 . . . . 1.0 111.202 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.2 mmt-85 -68.84 56.51 0.09 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.741 2.016 . . . . 1.0 113.048 175.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 66.3 mttt -56.66 129.12 39.71 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 128.404 2.682 . . . . 1.0 110.538 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.6 t -72.57 132.36 33.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 113.488 -1.687 . . . . 1.0 110.763 173.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -106.39 122.22 45.83 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 106.649 -1.612 . . . . 1.0 106.649 167.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.08 144.9 28.75 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 103.706 -2.702 . . . . 1.0 103.706 167.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -128.28 141.03 51.56 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.745 -1.205 . . . . 1.0 107.745 174.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -131.77 140.57 49.25 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.688 1.195 . . . . 1.0 109.318 177.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -106.35 109.64 63.29 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 123.266 0.627 . . . . 1.0 112.283 -174.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -52.79 -27.33 33.91 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 124.129 3.22 . . . . 1.0 115.847 175.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -88.72 -19.12 26.51 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.558 1.143 . . . . 1.0 113.926 -173.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.0 p -129.84 -20.32 3.18 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 114.561 1.319 . . . . 1.0 114.561 -172.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.79 10.68 77.19 Favored Glycine 0 CA--C 1.537 1.456 0 CA-C-N 118.73 0.696 . . . . 1.0 114.145 -173.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -74.14 149.12 41.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.194 1.397 . . . . 1.0 109.426 170.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -133.13 154.23 39.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 C-N-CA 126.776 2.03 . . . . 1.0 109.0 173.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.15 168.65 10.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 127.456 2.303 . . . . 1.0 109.331 178.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -147.62 120.87 8.94 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 127.843 2.457 . . . . 1.0 109.27 173.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.27 155.21 42.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.086 0.954 . . . . 1.0 109.968 -178.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -96.04 10.57 37.06 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 120.88 -1.137 . . . . 1.0 112.023 176.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 124.77 -167.68 17.06 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 127.106 2.288 . . . . 1.0 112.969 -171.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.67 170.14 31.43 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 116.999 1.559 . . . . 1.0 116.999 170.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -57.03 103.15 0.1 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.452 2.301 . . . . 1.0 109.218 169.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -130.47 134.89 47.44 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.344 1.458 . . . . 1.0 110.243 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -52.44 -66.77 0.33 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 115.918 1.822 . . . . 1.0 115.918 -168.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 34.4 m -60.1 -40.93 91.36 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 119.41 1.004 . . . . 1.0 111.963 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.5 tp -57.55 -39.12 75.96 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.269 1.027 . . . . 1.0 111.765 176.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -68.6 -35.78 77.8 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.829 0.851 . . . . 1.0 112.502 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -67.0 -41.31 86.93 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.278 0.945 . . . . 1.0 110.838 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 34.6 m0 -61.71 -37.31 83.69 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.67 0.618 . . . . 1.0 112.67 175.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -65.16 -36.23 83.59 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.444 -0.785 . . . . 1.0 112.107 172.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.92 -48.27 69.17 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.724 0.774 . . . . 1.0 110.971 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -76.43 -34.12 58.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.384 1.474 . . . . 1.0 114.538 -169.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 13.4 m-90 -133.5 -47.84 0.82 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.053 1.131 . . . . 1.0 114.053 -175.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.08 153.47 6.05 Favored Glycine 0 N--CA 1.479 1.543 0 CA-C-N 119.226 0.921 . . . . 1.0 115.354 169.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.15 -33.08 82.88 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.281 2.654 . . . . 1.0 114.359 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -63.35 -46.54 86.11 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.716 0.807 . . . . 1.0 110.875 177.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.9 -53.31 59.87 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.331 1.452 . . . . 1.0 109.812 176.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 29.3 t -57.52 -47.7 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 C-N-CA 125.904 1.682 . . . . 1.0 111.981 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -66.15 -36.17 82.42 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.29 0.636 . . . . 1.0 112.563 173.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 64.4 m -66.63 -30.66 70.99 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.544 0.572 . . . . 1.0 112.544 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -75.89 -8.84 57.86 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.057 1.132 . . . . 1.0 114.057 173.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.52 168.98 16.41 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 124.218 1.961 . . . . 1.0 114.613 -173.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 89.8 m -142.98 139.63 30.71 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 129.851 3.26 . . . . 1.0 108.215 -176.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -97.43 126.75 42.87 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.376 1.071 . . . . 1.0 109.972 -177.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 85.9 mt . . . . . 0 CA--C 1.538 0.508 0 C-N-CA 125.92 1.688 . . . . 1.0 110.944 -177.109 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.121 0.01 . . . . 1.0 111.024 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -66.28 60.77 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.458 1.903 . . . . 1.0 113.737 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.0 mttt -55.32 137.2 48.22 Favored 'General case' 0 CA--C 1.523 -0.091 0 C-N-CA 128.854 2.862 . . . . 1.0 110.464 175.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 97.1 t -77.06 135.82 25.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 113.56 -1.654 . . . . 1.0 110.843 171.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.522 ' HG2' ' HB1' ' A' ' 120' ' ' ALA . 3.5 ttpt -116.32 121.8 43.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.627 -1.249 . . . . 1.0 107.627 167.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.01 147.07 35.0 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 105.239 -2.134 . . . . 1.0 105.239 168.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.459 ' CE1' ' HB2' ' A' ' 120' ' ' ALA . 68.3 m-85 -129.06 140.03 51.77 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.795 -1.187 . . . . 1.0 107.795 172.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -132.81 129.52 38.63 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.711 1.205 . . . . 1.0 109.659 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -95.03 110.91 52.62 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 123.074 0.55 . . . . 1.0 111.597 -172.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.97 -15.25 48.06 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.324 2.682 . . . . 1.0 114.36 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -89.24 -20.52 24.05 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.281 1.215 . . . . 1.0 114.281 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.1 p -130.03 -21.24 3.01 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 114.894 1.442 . . . . 1.0 114.894 -172.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.19 9.42 84.13 Favored Glycine 0 CA--C 1.54 1.596 0 CA-C-N 118.808 0.731 . . . . 1.0 114.373 -173.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -72.95 148.82 43.92 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.684 1.242 . . . . 1.0 109.524 170.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 t -133.03 153.4 37.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 C-N-CA 126.605 1.962 . . . . 1.0 109.501 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.08 168.7 10.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 127.458 2.303 . . . . 1.0 109.198 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -147.78 121.42 9.2 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 128.205 2.602 . . . . 1.0 108.996 173.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.32 155.66 42.79 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.773 0.829 . . . . 1.0 109.653 -178.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -96.79 6.13 49.27 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.225 1.01 . . . . 1.0 111.789 173.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 132.11 -165.05 23.66 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.855 2.169 . . . . 1.0 113.609 -175.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.84 170.74 26.43 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 123.461 1.589 . . . . 1.0 117.042 169.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -57.82 101.36 0.07 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.466 2.306 . . . . 1.0 109.014 169.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -130.4 126.36 36.86 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.719 1.608 . . . . 1.0 109.592 178.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -44.84 -67.17 0.31 Allowed 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 116.07 1.878 . . . . 1.0 116.07 -169.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.2 m -60.11 -40.98 91.56 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 119.212 0.914 . . . . 1.0 112.214 -175.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 41.1 tp -59.44 -39.04 82.29 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.23 1.012 . . . . 1.0 111.611 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -68.58 -32.62 72.66 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.753 0.821 . . . . 1.0 113.151 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -69.12 -42.68 75.74 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 119.593 1.088 . . . . 1.0 110.777 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -60.57 -36.91 79.64 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.668 0.618 . . . . 1.0 112.668 177.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.28 -36.53 84.39 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 121.475 -0.765 . . . . 1.0 112.526 172.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.35 -48.37 70.44 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.854 0.835 . . . . 1.0 111.087 176.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -76.31 -33.57 59.05 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.342 1.457 . . . . 1.0 114.58 -169.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.3 m-90 -133.47 -48.83 0.83 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.923 1.083 . . . . 1.0 113.923 -176.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 141.19 153.44 5.96 Favored Glycine 0 N--CA 1.477 1.421 0 CA-C-N 119.046 0.839 . . . . 1.0 115.041 169.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -62.6 -32.94 79.23 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.075 2.517 . . . . 1.0 114.378 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -61.94 -46.64 88.42 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.89 0.852 . . . . 1.0 111.15 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.61 -53.96 51.97 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.996 1.318 . . . . 1.0 109.836 176.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 34.4 t -57.74 -46.69 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 125.425 1.49 . . . . 1.0 112.077 -175.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -64.98 -37.66 88.39 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.354 0.662 . . . . 1.0 112.388 173.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 55.6 m -66.46 -30.14 70.42 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.163 0.585 . . . . 1.0 112.365 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -74.95 -10.02 59.08 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.979 1.103 . . . . 1.0 113.979 173.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.522 ' HB1' ' HG2' ' A' ' 83' ' ' LYS . . . -71.14 167.23 19.77 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 124.032 1.872 . . . . 1.0 114.501 -173.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 95.8 m -146.37 133.11 19.98 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 129.305 3.042 . . . . 1.0 108.466 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.8 tt -100.37 124.83 46.35 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.685 0.794 . . . . 1.0 110.016 -171.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 CA--C 1.533 0.31 0 C-N-CA 126.657 1.983 . . . . 1.0 111.056 -170.868 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 111.137 0.051 . . . . 1.0 111.137 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 61.2 mmt-85 -65.41 61.58 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 126.658 1.983 . . . . 1.0 113.482 176.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -54.51 132.8 45.53 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 128.45 2.7 . . . . 1.0 111.04 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 74.5 t -70.88 135.22 28.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 113.088 -1.869 . . . . 1.0 111.264 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.3 mttp -107.44 120.62 42.67 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.304 -1.739 . . . . 1.0 106.304 167.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.85 144.66 29.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 104.108 -2.553 . . . . 1.0 104.108 168.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -127.24 140.17 52.41 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.994 -1.113 . . . . 1.0 107.994 173.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -132.08 130.95 41.91 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.7 1.2 . . . . 1.0 109.704 178.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -97.63 110.95 57.31 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 122.777 0.431 . . . . 1.0 111.31 -173.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -66.32 -14.63 45.05 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.45 2.767 . . . . 1.0 114.666 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -88.63 -17.63 29.67 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.726 1.21 . . . . 1.0 114.219 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 40.0 p -129.75 -23.56 2.82 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 114.534 1.309 . . . . 1.0 114.534 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.87 7.48 87.43 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.294 0.949 . . . . 1.0 114.234 -172.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.44 156.44 29.39 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.098 1.449 . . . . 1.0 110.976 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -136.37 154.11 32.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 126.681 1.992 . . . . 1.0 109.632 179.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.88 168.01 11.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 127.672 2.389 . . . . 1.0 109.525 177.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -147.03 120.76 9.21 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.585 2.354 . . . . 1.0 109.481 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.32 151.33 37.33 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.753 0.821 . . . . 1.0 109.685 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -95.17 10.13 37.07 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.1 -1.0 . . . . 1.0 111.826 176.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 129.33 -166.09 21.77 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 126.982 2.229 . . . . 1.0 113.093 -172.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.68 169.16 22.39 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 117.195 1.638 . . . . 1.0 117.195 170.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -57.66 100.99 0.06 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.717 2.407 . . . . 1.0 109.2 169.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.8 t60 -130.5 130.74 44.56 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.623 1.569 . . . . 1.0 109.939 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -49.52 -66.96 0.31 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.647 1.721 . . . . 1.0 115.647 -168.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.5 m -60.01 -40.94 90.96 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 119.323 0.965 . . . . 1.0 111.911 -175.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.9 tp -58.89 -38.39 78.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.014 0.926 . . . . 1.0 111.756 177.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.05 -36.33 79.7 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.574 0.75 . . . . 1.0 112.281 175.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.92 -42.14 85.87 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.102 0.865 . . . . 1.0 110.839 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.3 m0 -62.17 -38.03 87.52 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.587 0.588 . . . . 1.0 112.587 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.7 -33.87 76.87 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.535 -0.728 . . . . 1.0 112.181 172.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.48 -49.27 56.36 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.435 0.636 . . . . 1.0 111.451 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -74.24 -34.13 63.56 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.204 1.802 . . . . 1.0 114.67 -169.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.7 m-90 -133.05 -46.5 0.85 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.574 0.953 . . . . 1.0 113.574 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.42 153.84 6.32 Favored Glycine 0 N--CA 1.48 1.613 0 C-N-CA 123.849 0.738 . . . . 1.0 114.871 170.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.32 -33.59 89.02 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 122.98 2.453 . . . . 1.0 113.67 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -61.26 -45.88 92.65 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.987 0.899 . . . . 1.0 111.387 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.86 -55.16 37.58 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.218 -1.355 . . . . 1.0 109.923 175.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.6 t -57.3 -47.78 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 C-N-CA 125.59 1.556 . . . . 1.0 111.997 -175.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -67.28 -34.61 77.77 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.936 -0.477 . . . . 1.0 112.263 176.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.2 t -65.96 -33.99 77.09 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.73 -0.606 . . . . 1.0 112.234 177.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -71.5 -11.93 61.12 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.031 1.123 . . . . 1.0 114.031 174.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.82 168.71 16.18 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 124.117 1.913 . . . . 1.0 115.116 -170.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 79.5 m -142.26 141.83 32.51 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 130.107 3.363 . . . . 1.0 108.323 -177.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.3 tt -104.44 120.54 41.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.374 1.07 . . . . 1.0 110.206 -176.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 74.9 mt . . . . . 0 CA--C 1.54 0.579 0 C-N-CA 127.3 2.24 . . . . 1.0 110.92 -175.752 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.386 0.136 . . . . 1.0 111.264 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 31.4 mmt-85 -67.81 58.73 0.07 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 126.813 2.045 . . . . 1.0 113.077 175.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.8 mttt -55.54 131.26 45.73 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 128.769 2.828 . . . . 1.0 111.08 178.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 85.7 t -73.77 134.48 29.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 113.629 -1.623 . . . . 1.0 111.433 173.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.8 mttp -108.54 122.92 48.07 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 106.577 -1.638 . . . . 1.0 106.577 167.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.27 145.59 28.22 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 104.442 -2.429 . . . . 1.0 104.442 168.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -128.39 142.29 51.15 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.199 -1.037 . . . . 1.0 108.199 173.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -132.74 139.74 47.75 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.938 1.295 . . . . 1.0 109.485 177.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -106.82 109.75 63.28 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 123.234 0.614 . . . . 1.0 112.483 -173.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -53.36 -26.67 36.07 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.269 3.312 . . . . 1.0 115.957 176.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -88.99 -18.79 26.68 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.52 1.128 . . . . 1.0 113.996 -174.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.9 p -129.54 -19.76 3.36 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.49 1.292 . . . . 1.0 114.49 -172.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.61 11.44 72.74 Favored Glycine 0 CA--C 1.54 1.647 0 CA-C-N 118.741 0.7 . . . . 1.0 114.159 -173.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -75.32 149.61 38.69 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.39 1.476 . . . . 1.0 109.4 171.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.5 t -132.47 154.75 40.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 126.754 2.022 . . . . 1.0 109.035 172.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.89 167.69 12.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 127.318 2.247 . . . . 1.0 109.384 177.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -146.84 120.31 9.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 127.483 2.313 . . . . 1.0 108.888 173.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.22 153.58 41.49 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.75 0.82 . . . . 1.0 109.588 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.4 mttp -95.72 9.05 41.71 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.1 -1.0 . . . . 1.0 111.573 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.84 -166.68 20.4 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 127.238 2.352 . . . . 1.0 113.202 -171.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.92 169.16 27.1 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 117.272 1.669 . . . . 1.0 117.272 169.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -57.64 101.42 0.07 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 127.708 2.403 . . . . 1.0 108.944 169.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -130.66 130.2 43.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.478 1.511 . . . . 1.0 109.625 178.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -48.68 -65.52 0.55 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 115.971 1.841 . . . . 1.0 115.971 -169.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 44.3 m -62.22 -39.22 92.08 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 119.266 0.939 . . . . 1.0 111.925 -175.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.5 tp -59.67 -39.44 84.51 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.773 0.829 . . . . 1.0 111.72 176.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -67.41 -35.83 80.06 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.664 0.786 . . . . 1.0 112.485 175.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -67.2 -43.87 81.05 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.06 0.846 . . . . 1.0 110.271 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.8 m0 -60.22 -38.54 83.7 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.73 -0.668 . . . . 1.0 112.487 176.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -65.18 -34.54 78.62 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.512 -0.742 . . . . 1.0 112.53 172.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.86 -49.85 59.81 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.804 0.812 . . . . 1.0 111.191 176.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -75.58 -34.13 60.64 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.859 1.664 . . . . 1.0 114.822 -169.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.6 m-90 -132.75 -47.01 0.87 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 113.651 0.982 . . . . 1.0 113.651 -176.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.01 154.01 6.28 Favored Glycine 0 N--CA 1.479 1.507 0 CA-C-N 118.944 0.793 . . . . 1.0 114.967 169.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -61.76 -33.83 84.46 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.075 2.517 . . . . 1.0 113.928 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -60.9 -45.96 92.55 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 122.07 0.938 . . . . 1.0 111.376 177.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.69 -54.97 40.23 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.182 -1.372 . . . . 1.0 109.916 175.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.2 t -58.11 -47.82 86.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 125.694 1.598 . . . . 1.0 111.786 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.14 -35.29 79.41 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.127 0.571 . . . . 1.0 112.157 176.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.3 t -65.43 -34.01 77.29 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.079 0.552 . . . . 1.0 112.189 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 24.3 m0 -72.28 -10.06 59.29 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.963 1.097 . . . . 1.0 113.963 174.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.45 168.46 17.45 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 124.172 1.939 . . . . 1.0 115.045 -172.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 92.8 m -144.14 142.81 30.79 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 130.133 3.373 . . . . 1.0 107.812 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -107.92 123.55 48.78 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.893 0.877 . . . . 1.0 109.767 -176.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.7 mt . . . . . 0 CA--C 1.54 0.572 0 C-N-CA 126.758 2.023 . . . . 1.0 110.69 -172.869 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 111.13 0.048 . . . . 1.0 111.13 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.6 mmp_? -65.59 57.37 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 127.268 2.227 . . . . 1.0 114.191 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -56.59 127.97 33.94 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 128.795 2.838 . . . . 1.0 110.221 175.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.6 t -70.65 133.86 31.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 113.62 -1.627 . . . . 1.0 110.646 174.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -108.09 121.87 45.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.529 -1.656 . . . . 1.0 106.529 168.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.63 144.46 28.58 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 103.694 -2.706 . . . . 1.0 103.694 167.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -127.66 140.36 52.13 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 107.691 -1.226 . . . . 1.0 107.691 174.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -131.83 139.25 48.79 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.848 1.259 . . . . 1.0 109.462 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -105.63 110.38 64.17 Favored Pre-proline 0 CA--C 1.544 0.713 0 N-CA-C 112.413 0.523 . . . . 1.0 112.413 -173.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo -52.73 -27.5 34.14 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 124.338 3.359 . . . . 1.0 115.87 176.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -87.97 -17.24 31.71 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.833 1.253 . . . . 1.0 114.273 -174.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.4 p -129.9 -22.1 2.95 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.114 1.153 . . . . 1.0 114.114 -174.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.01 7.52 81.75 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 124.09 0.852 . . . . 1.0 114.443 -172.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -77.45 156.49 31.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.011 1.406 . . . . 1.0 110.681 173.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.0 t -136.11 155.29 34.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 C-N-CA 126.986 2.115 . . . . 1.0 109.536 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.47 168.42 10.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 127.85 2.46 . . . . 1.0 109.404 177.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -147.48 121.84 9.65 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.757 2.423 . . . . 1.0 109.023 173.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.64 156.68 43.38 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.931 0.892 . . . . 1.0 109.972 -178.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -96.37 9.51 41.01 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.893 -1.129 . . . . 1.0 112.101 175.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 125.24 -167.56 17.57 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 127.186 2.327 . . . . 1.0 112.969 -171.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.1 170.07 32.68 Favored Glycine 0 CA--C 1.537 1.467 0 N-CA-C 117.082 1.593 . . . . 1.0 117.082 169.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -57.33 101.38 0.07 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.703 2.401 . . . . 1.0 108.945 169.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -130.68 133.95 46.52 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.121 1.369 . . . . 1.0 110.638 178.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -45.33 -70.55 0.1 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 125.895 1.678 . . . . 1.0 115.408 -169.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.4 m -61.04 -41.21 96.15 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.571 0.748 . . . . 1.0 111.949 -175.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 40.0 tp -58.44 -39.54 80.12 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.099 0.96 . . . . 1.0 111.69 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -69.72 -32.52 71.13 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.778 0.831 . . . . 1.0 112.965 175.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -68.44 -43.17 77.68 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.798 1.181 . . . . 1.0 111.221 175.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -61.56 -35.43 77.75 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.678 0.622 . . . . 1.0 112.678 178.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.76 -36.53 83.83 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 121.515 -0.741 . . . . 1.0 112.514 171.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.7 -48.45 69.24 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.826 0.822 . . . . 1.0 110.818 176.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.94 -32.84 59.74 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.657 1.583 . . . . 1.0 114.448 -169.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -134.87 -50.17 0.76 Allowed 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.008 1.114 . . . . 1.0 114.008 -176.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.2 153.87 6.02 Favored Glycine 0 N--CA 1.477 1.385 0 CA-C-N 119.315 0.962 . . . . 1.0 115.458 169.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.47 -33.24 79.65 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.264 2.643 . . . . 1.0 114.262 -178.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -63.76 -46.71 84.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.927 0.87 . . . . 1.0 110.887 177.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.08 -53.45 58.06 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.223 1.409 . . . . 1.0 110.197 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 25.7 t -57.43 -48.07 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 125.769 1.628 . . . . 1.0 111.804 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.7 -35.79 80.97 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.574 0.583 . . . . 1.0 112.574 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 21.9 t -65.73 -33.44 75.88 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.228 0.611 . . . . 1.0 112.067 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -72.75 -10.97 60.41 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.012 1.116 . . . . 1.0 114.012 174.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.88 169.25 15.12 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 124.321 2.01 . . . . 1.0 114.86 -172.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.0 m -143.67 142.26 30.92 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 130.148 3.379 . . . . 1.0 107.711 -176.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.1 tt -106.98 123.04 47.61 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.067 0.947 . . . . 1.0 109.586 -175.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.4 mt . . . . . 0 CA--C 1.537 0.479 0 C-N-CA 126.424 1.89 . . . . 1.0 110.888 -172.981 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 111.326 0.121 . . . . 1.0 111.326 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 51.9 mmt-85 -65.41 66.77 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 126.277 1.831 . . . . 1.0 112.637 175.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 44.8 mttt -62.94 137.33 58.24 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 128.934 2.894 . . . . 1.0 110.575 178.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 87.8 t -76.37 136.14 25.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 C-N-CA 125.723 1.609 . . . . 1.0 111.309 172.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -109.63 122.56 47.74 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 106.179 -1.786 . . . . 1.0 106.179 167.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.21 145.27 28.43 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 104.269 -2.493 . . . . 1.0 104.269 168.265 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -127.36 141.76 51.61 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.028 -1.101 . . . . 1.0 108.028 172.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -133.28 137.43 46.02 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.884 1.274 . . . . 1.0 109.041 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -107.45 110.89 63.13 Favored Pre-proline 0 CA--C 1.548 0.888 0 N-CA-C 112.417 0.525 . . . . 1.0 112.417 -172.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -53.19 -27.22 36.74 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 124.636 3.557 . . . . 1.0 115.593 175.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -89.05 -15.08 34.9 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.119 1.368 . . . . 1.0 114.575 -174.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.6 p -128.93 -21.83 3.28 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.351 1.061 . . . . 1.0 113.831 -176.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.77 9.75 79.39 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.577 1.084 . . . . 1.0 114.023 -172.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -83.47 158.89 21.87 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.03 1.415 . . . . 1.0 110.853 175.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -136.74 155.51 33.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 C-N-CA 126.96 2.104 . . . . 1.0 109.577 178.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.99 168.53 9.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 127.468 2.307 . . . . 1.0 109.29 178.206 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -147.22 121.66 9.69 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.685 2.394 . . . . 1.0 109.287 173.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.25 153.61 40.78 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.851 0.861 . . . . 1.0 109.727 -179.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 33.7 mttp -97.06 10.75 38.44 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.875 -1.141 . . . . 1.0 111.5 174.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.98 -165.53 21.73 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 127.253 2.358 . . . . 1.0 113.133 -173.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.12 168.9 23.81 Favored Glycine 0 CA--C 1.537 1.433 0 CA-C-O 123.5 1.611 . . . . 1.0 117.054 170.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -57.72 101.9 0.08 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 127.498 2.319 . . . . 1.0 109.093 169.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -130.51 123.7 30.24 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.497 1.519 . . . . 1.0 109.711 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -43.94 -65.37 0.51 Allowed 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 115.486 1.662 . . . . 1.0 115.486 -169.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.7 m -58.69 -41.59 86.59 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 119.379 0.99 . . . . 1.0 112.454 -176.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.2 tp -60.97 -37.9 84.06 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.058 0.943 . . . . 1.0 111.457 177.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -69.5 -32.79 71.87 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.533 0.733 . . . . 1.0 112.773 174.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.03 -42.1 76.82 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.823 1.192 . . . . 1.0 110.973 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -62.39 -37.65 86.57 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.554 0.576 . . . . 1.0 112.554 177.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -65.67 -32.06 73.42 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.668 -0.645 . . . . 1.0 112.332 172.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.36 -51.4 24.35 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.434 0.635 . . . . 1.0 110.968 176.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HE3' ' CH2' ' A' ' 111' ' ' TRP . 47.1 mtmt -74.68 -29.06 61.09 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 115.309 1.596 . . . . 1.0 115.309 -169.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.432 ' CH2' ' HE3' ' A' ' 110' ' ' LYS . 16.5 m-90 -134.76 -47.51 0.74 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.176 1.176 . . . . 1.0 114.176 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.1 154.18 6.31 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 119.09 0.859 . . . . 1.0 114.942 170.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -61.03 -33.95 91.18 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.268 2.645 . . . . 1.0 113.759 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -61.41 -45.82 92.73 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.877 0.846 . . . . 1.0 111.238 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.74 -55.11 38.36 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 114.326 -1.306 . . . . 1.0 110.073 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 32.9 t -57.42 -48.24 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 125.819 1.648 . . . . 1.0 111.923 -174.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -66.94 -34.7 78.35 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.085 0.554 . . . . 1.0 112.147 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.6 m -67.58 -30.45 70.06 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 112.641 0.608 . . . . 1.0 112.641 178.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 17.9 m0 -74.55 -10.97 60.07 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.212 1.19 . . . . 1.0 114.212 173.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.7 168.46 16.51 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 124.091 1.901 . . . . 1.0 114.823 -170.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 99.6 m -142.95 143.19 31.87 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 130.133 3.373 . . . . 1.0 107.909 -176.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.69 122.91 47.31 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.082 0.953 . . . . 1.0 109.818 -176.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 CA--C 1.539 0.542 0 C-N-CA 126.651 1.98 . . . . 1.0 110.52 -174.413 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 111.275 0.102 . . . . 1.0 111.275 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 36.7 mmt-85 -66.74 59.57 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 126.627 1.971 . . . . 1.0 113.053 174.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.7 mttt -54.05 133.01 43.67 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 128.744 2.817 . . . . 1.0 111.152 178.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.1 t -75.6 135.05 27.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 113.45 -1.704 . . . . 1.0 111.607 172.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.0 mttp -110.18 123.55 49.97 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 106.928 -1.508 . . . . 1.0 106.928 167.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -83.94 145.4 28.58 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 104.414 -2.439 . . . . 1.0 104.414 168.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -128.48 142.65 51.02 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.04 -1.096 . . . . 1.0 108.04 173.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -132.71 140.85 48.29 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.711 1.204 . . . . 1.0 109.467 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -107.81 109.57 62.26 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 123.077 0.551 . . . . 1.0 112.271 -173.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -53.28 -26.89 36.2 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 124.57 3.513 . . . . 1.0 115.785 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -88.68 -18.82 27.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.506 1.122 . . . . 1.0 113.928 -174.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 47.0 p -129.64 -19.85 3.31 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 114.543 1.312 . . . . 1.0 114.543 -172.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.88 11.53 73.99 Favored Glycine 0 CA--C 1.538 1.473 0 C-N-CA 123.879 0.752 . . . . 1.0 114.276 -173.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -75.72 149.82 37.98 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.176 1.39 . . . . 1.0 109.454 171.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -132.94 154.73 40.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 126.802 2.041 . . . . 1.0 108.962 172.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.84 168.15 11.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 127.45 2.3 . . . . 1.0 109.448 178.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -147.0 121.1 9.44 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 127.844 2.458 . . . . 1.0 109.097 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.71 152.58 39.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.73 0.812 . . . . 1.0 109.826 -178.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -93.06 7.57 43.61 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 120.921 -1.112 . . . . 1.0 111.988 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.77 -166.44 21.26 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 126.989 2.233 . . . . 1.0 113.133 -171.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.66 169.66 27.16 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-O 123.366 1.537 . . . . 1.0 116.807 169.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -57.26 103.0 0.1 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.533 2.333 . . . . 1.0 108.92 169.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -130.64 131.87 45.14 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.275 1.43 . . . . 1.0 110.161 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -48.96 -67.46 0.26 Allowed 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 115.909 1.818 . . . . 1.0 115.909 -168.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 34.1 m -59.95 -41.02 90.97 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 119.008 0.822 . . . . 1.0 111.893 -176.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.1 tp -58.53 -38.94 78.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.085 0.954 . . . . 1.0 111.571 177.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -68.54 -35.81 77.95 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.686 0.794 . . . . 1.0 112.352 175.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -66.79 -42.11 86.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.368 0.986 . . . . 1.0 110.744 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -61.47 -38.79 88.53 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.5 0.555 . . . . 1.0 112.5 176.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -65.06 -34.48 78.52 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.424 -0.797 . . . . 1.0 112.081 173.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.65 -48.74 63.25 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.737 0.779 . . . . 1.0 111.388 176.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.62 -33.89 60.53 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.773 1.629 . . . . 1.0 114.822 -169.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.4 m-90 -133.23 -45.89 0.84 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.814 1.042 . . . . 1.0 113.814 -176.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.64 154.23 6.39 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-N 119.073 0.851 . . . . 1.0 115.223 169.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.62 -34.47 84.41 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.063 2.509 . . . . 1.0 113.795 178.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -60.57 -45.87 92.34 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 122.072 0.939 . . . . 1.0 111.357 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.85 -54.84 41.52 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.017 -1.447 . . . . 1.0 110.067 175.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.9 t -57.91 -47.67 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 125.528 1.531 . . . . 1.0 112.201 -175.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -67.04 -35.21 79.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.95 0.5 . . . . 1.0 112.232 175.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.6 t -65.38 -33.99 77.26 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.688 -0.633 . . . . 1.0 112.331 177.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.6 m0 -72.63 -9.6 58.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.994 1.109 . . . . 1.0 113.994 174.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.51 168.29 16.56 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 124.041 1.877 . . . . 1.0 114.893 -173.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 89.7 m -143.89 138.92 28.91 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 129.79 3.236 . . . . 1.0 108.157 -176.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 30.8 tp -98.63 127.64 44.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.335 1.054 . . . . 1.0 109.718 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.5 mt . . . . . 0 CA--C 1.533 0.317 0 C-N-CA 125.999 1.72 . . . . 1.0 110.878 -176.376 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 111.689 0.255 . . . . 1.0 111.689 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.1 mmp_? -69.31 58.32 0.11 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.731 2.013 . . . . 1.0 113.518 174.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -53.42 128.19 27.74 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 128.22 2.608 . . . . 1.0 110.179 174.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.8 t -72.3 134.39 29.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 113.633 -1.621 . . . . 1.0 110.521 171.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -108.33 121.57 45.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.516 -1.661 . . . . 1.0 106.516 167.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.81 143.82 28.85 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 103.896 -2.631 . . . . 1.0 103.896 167.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -127.66 139.96 52.39 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.761 -1.199 . . . . 1.0 107.761 175.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.48 140.0 49.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.546 1.139 . . . . 1.0 108.986 177.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -105.57 109.89 63.68 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 112.542 0.571 . . . . 1.0 112.542 -174.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -52.96 -26.77 32.9 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.18 3.253 . . . . 1.0 115.878 176.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -87.65 -17.44 31.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.883 1.273 . . . . 1.0 114.232 -174.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.3 p -129.79 -22.59 2.92 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 114.028 1.122 . . . . 1.0 114.028 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.42 8.78 80.94 Favored Glycine 0 CA--C 1.539 1.554 0 C-N-CA 124.048 0.832 . . . . 1.0 114.352 -172.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.32 156.0 29.83 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 119.061 1.43 . . . . 1.0 110.506 172.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -135.83 155.52 36.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 C-N-CA 126.917 2.087 . . . . 1.0 109.563 178.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.69 168.1 10.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 127.689 2.396 . . . . 1.0 109.261 177.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -146.92 122.01 10.11 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 127.772 2.429 . . . . 1.0 109.288 172.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.08 156.4 42.98 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.919 0.888 . . . . 1.0 109.861 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.0 mttp -97.13 10.34 39.64 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.038 -1.039 . . . . 1.0 111.986 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 124.98 -166.65 17.6 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 127.253 2.359 . . . . 1.0 112.858 -171.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.5 169.52 29.72 Favored Glycine 0 CA--C 1.537 1.408 0 N-CA-C 117.405 1.722 . . . . 1.0 117.405 169.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -57.74 100.37 0.05 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.607 2.363 . . . . 1.0 109.265 169.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -130.43 130.96 44.96 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.446 1.498 . . . . 1.0 109.75 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -47.17 -67.09 0.31 Allowed 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 115.501 1.667 . . . . 1.0 115.501 -168.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.7 m -60.15 -41.02 91.87 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 119.29 0.95 . . . . 1.0 112.083 -174.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 46.4 tp -59.28 -39.52 83.19 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.243 1.017 . . . . 1.0 111.522 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -68.84 -32.44 72.12 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 113.193 0.812 . . . . 1.0 113.193 175.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.33 -42.99 74.6 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 119.422 1.01 . . . . 1.0 110.858 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -61.53 -35.66 78.36 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.761 0.652 . . . . 1.0 112.761 177.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -65.13 -36.91 85.76 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 121.39 -0.819 . . . . 1.0 112.696 171.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.92 -48.26 69.18 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.703 0.763 . . . . 1.0 110.863 176.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -76.07 -32.89 59.48 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.568 1.547 . . . . 1.0 114.415 -169.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -135.0 -49.76 0.75 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.019 1.118 . . . . 1.0 114.019 -176.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.44 153.62 5.95 Favored Glycine 0 N--CA 1.48 1.577 0 CA-C-N 119.416 1.007 . . . . 1.0 115.353 169.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.1 -33.24 82.91 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.26 2.64 . . . . 1.0 114.328 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -63.11 -46.76 85.82 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 122.009 0.909 . . . . 1.0 110.966 177.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.64 -53.56 57.02 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.065 1.346 . . . . 1.0 110.032 176.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 27.7 t -57.15 -48.24 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.991 1.717 . . . . 1.0 111.81 -176.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -66.24 -36.01 81.9 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.076 0.551 . . . . 1.0 112.442 174.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.7 m -67.12 -30.58 70.62 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.644 0.609 . . . . 1.0 112.644 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 23.0 m0 -75.05 -10.04 59.1 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.805 1.039 . . . . 1.0 113.805 173.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.98 168.77 16.29 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 124.375 2.036 . . . . 1.0 114.689 -172.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.5 m -141.99 141.07 32.86 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 130.156 3.382 . . . . 1.0 107.736 -177.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.3 tt -104.98 121.72 44.33 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.928 0.891 . . . . 1.0 109.787 -175.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt . . . . . 0 CA--C 1.537 0.468 0 C-N-CA 126.395 1.878 . . . . 1.0 110.917 -174.431 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 120.414 0.15 . . . . 1.0 111.34 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 28.1 mmt-85 -68.57 57.19 0.08 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 126.458 1.903 . . . . 1.0 113.001 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.2 mttt -54.39 131.08 41.48 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 128.915 2.886 . . . . 1.0 111.041 177.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.3 t -73.58 134.17 30.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 113.607 -1.633 . . . . 1.0 111.59 172.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -107.97 121.91 45.75 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.703 -1.592 . . . . 1.0 106.703 167.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.09 143.98 29.35 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 104.055 -2.572 . . . . 1.0 104.055 167.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -127.06 141.71 51.71 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.925 -1.139 . . . . 1.0 107.925 173.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.84 141.59 49.47 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.794 1.238 . . . . 1.0 109.149 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -108.32 110.14 61.75 Favored Pre-proline 0 CA--C 1.548 0.899 0 N-CA-C 112.658 0.614 . . . . 1.0 112.658 -173.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -52.69 -27.52 33.96 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.417 3.411 . . . . 1.0 116.04 174.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -88.57 -19.86 25.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.85 1.26 . . . . 1.0 114.286 -174.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.8 p -127.57 -19.93 4.08 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.726 1.009 . . . . 1.0 113.726 -173.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.95 8.22 77.6 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.062 0.839 . . . . 1.0 114.151 -172.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -80.62 157.0 26.12 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 119.055 1.428 . . . . 1.0 110.892 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.49 155.11 33.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 C-N-CA 126.746 2.018 . . . . 1.0 109.332 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.26 168.83 10.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 127.463 2.305 . . . . 1.0 109.601 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -146.65 122.63 10.71 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 127.885 2.474 . . . . 1.0 109.407 171.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.01 155.27 42.69 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.949 0.9 . . . . 1.0 110.085 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -95.64 8.75 42.52 Favored 'General case' 0 N--CA 1.48 1.075 0 O-C-N 120.94 -1.1 . . . . 1.0 111.884 174.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.07 -164.76 20.52 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 127.15 2.31 . . . . 1.0 113.112 -171.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.59 168.87 21.32 Favored Glycine 0 CA--C 1.536 1.371 0 N-CA-C 117.018 1.567 . . . . 1.0 117.018 170.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -57.22 101.73 0.07 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.403 2.281 . . . . 1.0 108.763 169.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -130.25 128.48 41.71 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.13 1.372 . . . . 1.0 109.783 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 31.2 tttt -46.41 -65.92 0.48 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.958 1.836 . . . . 1.0 115.958 -168.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.0 m -59.49 -41.76 90.6 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 119.175 0.898 . . . . 1.0 112.204 -177.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.3 tp -59.92 -38.83 83.45 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.109 0.964 . . . . 1.0 111.574 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -68.86 -32.07 71.48 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.7 0.8 . . . . 1.0 112.973 174.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -68.46 -43.16 77.6 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.623 1.101 . . . . 1.0 110.907 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -62.78 -36.18 82.26 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.509 0.559 . . . . 1.0 112.509 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -65.09 -36.28 83.81 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.404 -0.81 . . . . 1.0 112.413 171.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.78 -48.62 68.47 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.597 0.713 . . . . 1.0 110.914 176.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -69.78 -37.43 76.35 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.561 1.544 . . . . 1.0 113.407 -171.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 11.7 m-90 -134.12 -55.82 0.86 Allowed 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.66 0.985 . . . . 1.0 113.66 -175.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 149.78 156.71 7.36 Favored Glycine 0 CA--C 1.537 1.43 0 CA-C-N 119.062 0.846 . . . . 1.0 114.932 172.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.57 -30.98 71.1 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.054 2.503 . . . . 1.0 114.158 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -62.54 -46.2 89.47 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.037 0.922 . . . . 1.0 111.181 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.38 -52.95 63.43 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 125.051 1.34 . . . . 1.0 109.972 176.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.7 t -58.01 -47.49 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 125.848 1.659 . . . . 1.0 111.669 -175.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.77 -37.64 88.3 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.675 0.79 . . . . 1.0 112.274 173.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.3 m -66.05 -29.72 70.12 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.009 0.523 . . . . 1.0 112.288 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 13.3 m0 -78.97 -6.19 55.67 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.085 1.143 . . . . 1.0 114.085 173.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.49 169.12 16.09 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 124.133 1.921 . . . . 1.0 114.624 -173.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 83.1 m -144.6 138.51 27.48 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 129.606 3.162 . . . . 1.0 108.156 -176.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -96.95 126.22 41.94 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.369 1.067 . . . . 1.0 109.81 -177.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.4 mt -125.21 122.28 36.57 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.947 1.699 . . . . 1.0 110.926 -177.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -64.99 -30.32 77.7 Favored Glycine 0 CA--C 1.537 1.456 0 CA-C-N 115.114 -0.948 . . . . 1.0 114.283 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 . . . . . 0 C--O 1.256 1.434 0 C-N-CA 127.616 2.367 . . . . 1.0 113.735 -179.878 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.898 0 O4'-C4'-C3' 109.328 3.728 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.153 0 O4'-C4'-C3' 108.669 3.069 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.267 0 O4'-C4'-C3' 109.475 3.875 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.602 0 O5'-C5'-C4' 114.137 2.812 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.314 0 O4'-C4'-C3' 108.755 3.155 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.971 0 O4'-C4'-C3' 109.143 3.543 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.629 0 O4'-C1'-N19 110.822 3.778 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 0 O5'-C5'-C4' 114.465 3.047 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.972 1 O4'-C4'-C3' 109.735 4.135 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.734 0 P-O3'-C3' 123.444 3.12 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.811 0 O4'-C4'-C3' 109.183 3.583 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.347 0 O4'-C1'-N19 110.145 2.931 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.956 0 O4'-C4'-C3' 108.654 3.054 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.209 0 O5'-C5'-C4' 114.793 3.281 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.402 1 O4'-C1'-N19 111.157 4.197 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.789 0 P-O3'-C3' 123.416 3.096 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.298 0 O4'-C1'-N19 110.155 2.944 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.887 0 O5'-C5'-C4' 113.932 2.666 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.698 0 P-O3'-C3' 123.649 3.291 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.716 1 C5'-C4'-C3' 106.554 -5.43 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.483 0 O4'-C4'-C3' 108.035 2.435 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.416 1 O4'-C1'-N19 111.445 4.556 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.815 0 O4'-C4'-C3' 109.011 3.411 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.371 1 O4'-C1'-N19 111.246 4.308 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 111.265 0.098 . . . . 1.0 111.265 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 47.0 mmt-85 -65.32 62.25 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 126.783 2.033 . . . . 1.0 112.942 173.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -54.95 133.75 48.39 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 128.636 2.775 . . . . 1.0 110.91 177.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 95.1 t -75.12 135.83 26.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 113.445 -1.707 . . . . 1.0 111.019 171.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.1 mttp -111.09 124.39 52.09 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.681 -1.6 . . . . 1.0 106.681 167.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.04 145.86 28.26 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 104.599 -2.371 . . . . 1.0 104.599 167.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -128.96 141.47 51.25 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.73 -1.211 . . . . 1.0 107.73 173.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -132.82 139.63 47.59 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.897 1.279 . . . . 1.0 109.157 178.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -106.7 109.7 63.27 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.002 0.521 . . . . 1.0 112.275 -174.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -52.5 -27.97 34.3 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.325 3.35 . . . . 1.0 115.808 175.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -86.29 -17.27 35.06 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.218 1.192 . . . . 1.0 114.218 -174.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.3 p -129.85 -22.45 2.92 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.046 1.128 . . . . 1.0 114.046 -174.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.4 7.73 82.97 Favored Glycine 0 CA--C 1.538 1.527 0 C-N-CA 124.308 0.956 . . . . 1.0 114.274 -172.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.08 156.82 29.8 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.071 1.436 . . . . 1.0 110.698 173.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.94 155.01 32.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 126.912 2.085 . . . . 1.0 109.55 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.38 168.38 10.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 C-N-CA 127.621 2.369 . . . . 1.0 109.299 177.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -147.51 121.46 9.38 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 127.715 2.406 . . . . 1.0 109.139 173.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.94 151.45 37.03 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.833 0.853 . . . . 1.0 109.977 -178.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -90.32 7.71 37.08 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 120.952 -1.093 . . . . 1.0 112.443 174.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.63 -165.34 21.53 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 126.66 2.076 . . . . 1.0 113.414 -172.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.39 170.29 27.48 Favored Glycine 0 CA--C 1.537 1.414 0 N-CA-C 117.071 1.588 . . . . 1.0 117.071 169.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -57.96 102.56 0.1 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.382 2.273 . . . . 1.0 108.667 169.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -130.3 132.99 46.14 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.121 1.368 . . . . 1.0 109.747 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.5 tttt -50.39 -66.34 0.41 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.677 1.732 . . . . 1.0 115.677 -168.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 40.8 m -60.46 -41.66 94.61 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 119.301 0.955 . . . . 1.0 112.032 -177.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 46.0 tp -58.49 -38.26 77.27 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.154 0.981 . . . . 1.0 111.62 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -69.05 -36.06 77.26 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.971 0.908 . . . . 1.0 112.358 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -66.45 -42.03 88.24 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.463 1.029 . . . . 1.0 110.444 178.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -61.92 -37.95 86.58 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.454 0.539 . . . . 1.0 112.454 177.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -65.52 -34.8 79.1 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.489 -0.757 . . . . 1.0 112.175 172.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.63 -49.04 62.35 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.537 0.684 . . . . 1.0 111.317 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -74.79 -33.74 62.29 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.909 1.683 . . . . 1.0 114.58 -169.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.1 m-90 -133.41 -47.99 0.83 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.7 1.0 . . . . 1.0 113.7 -176.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.54 154.17 6.18 Favored Glycine 0 N--CA 1.478 1.436 0 N-CA-C 115.047 0.779 . . . . 1.0 115.047 169.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -61.17 -35.06 87.76 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.111 2.541 . . . . 1.0 114.051 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.4 -45.62 93.56 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.722 0.773 . . . . 1.0 111.449 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.81 -54.92 40.66 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.138 -1.392 . . . . 1.0 109.831 175.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 32.5 t -57.7 -48.34 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.62 1.568 . . . . 1.0 112.06 -174.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -66.42 -35.25 79.84 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.11 0.564 . . . . 1.0 111.906 175.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.9 m -67.81 -30.19 69.54 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.67 -0.644 . . . . 1.0 112.608 178.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.2 m0 -74.2 -10.16 59.33 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.776 1.028 . . . . 1.0 113.776 173.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.73 168.47 16.53 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 124.048 1.88 . . . . 1.0 114.707 -172.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 87.2 m -144.0 138.7 28.59 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 129.6 3.16 . . . . 1.0 107.895 -175.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -99.03 127.03 44.87 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.373 1.069 . . . . 1.0 109.657 -176.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.4 mt -125.18 117.53 24.07 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.039 1.736 . . . . 1.0 111.34 -175.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -83.63 -12.67 77.4 Favored Glycine 0 CA--C 1.537 1.459 0 CA-C-N 114.918 -1.037 . . . . 1.0 115.257 -176.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 77.7 t60 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 126.152 1.781 . . . . 1.0 111.082 179.154 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.852 0 O4'-C4'-C3' 109.105 3.505 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.741 0 O5'-C5'-C4' 114.436 3.026 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.377 0 O4'-C4'-C3' 109.304 3.704 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.336 0 O4'-C4'-C3' 108.493 2.893 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.068 0 O4'-C4'-C3' 108.655 3.055 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.888 0 O4'-C4'-C3' 108.973 3.373 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.476 1 O4'-C1'-N19 111.121 4.151 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.115 0 O5'-C5'-C4' 114.494 3.067 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.936 1 O4'-C4'-C3' 109.817 4.217 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.372 0 O4'-C4'-C3' 108.658 3.058 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.576 0 O4'-C4'-C3' 109.064 3.464 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.576 0 O4'-C1'-N19 110.501 3.376 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.751 0 O4'-C4'-C3' 108.497 2.897 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.172 0 O5'-C5'-C4' 114.858 3.327 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.188 0 O4'-C1'-N19 110.925 3.906 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.825 0 P-O3'-C3' 123.293 2.994 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.143 0 O4'-C4'-C3' 108.56 2.96 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.913 0 O5'-C5'-C4' 113.977 2.698 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.568 -2.544 0 P-O3'-C3' 123.836 3.447 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.356 1 C5'-C4'-C3' 107.981 -4.479 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.463 0 O5'-C5'-C4' 113.101 2.072 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.205 1 O4'-C1'-N19 111.542 4.677 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.694 0 O4'-C4'-C3' 109.166 3.566 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.292 1 O4'-C1'-N19 111.491 4.614 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 111.173 0.064 . . . . 1.0 111.173 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.0 mmt85 -66.47 61.36 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 126.448 1.899 . . . . 1.0 113.661 176.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -54.83 130.1 39.75 Favored 'General case' 0 C--O 1.232 0.141 0 C-N-CA 128.855 2.862 . . . . 1.0 110.549 177.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 83.1 t -71.69 133.2 32.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 113.683 -1.599 . . . . 1.0 111.01 173.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -106.56 120.94 43.26 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.442 -1.688 . . . . 1.0 106.442 167.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.16 144.06 29.24 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 103.899 -2.63 . . . . 1.0 103.899 167.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -127.24 139.4 52.95 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.791 -1.188 . . . . 1.0 107.791 175.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -131.78 139.49 48.94 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.678 1.191 . . . . 1.0 109.256 176.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -105.79 110.52 64.23 Favored Pre-proline 0 CA--C 1.545 0.761 0 N-CA-C 112.337 0.495 . . . . 1.0 112.337 -174.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -52.81 -27.79 35.94 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 124.441 3.427 . . . . 1.0 115.728 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -87.35 -17.22 32.89 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.777 1.231 . . . . 1.0 114.185 -174.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.1 p -130.2 -21.83 2.89 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.247 1.203 . . . . 1.0 114.247 -174.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.1 8.74 79.43 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.434 1.016 . . . . 1.0 114.295 -172.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -78.42 156.48 29.4 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.072 1.436 . . . . 1.0 110.727 172.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.5 t -136.41 154.99 33.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 126.907 2.083 . . . . 1.0 109.733 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.86 168.77 8.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 127.795 2.438 . . . . 1.0 109.558 177.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -147.26 121.49 9.55 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.762 2.425 . . . . 1.0 109.273 173.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.83 153.55 39.32 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.579 0.752 . . . . 1.0 109.913 -179.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.1 mttp -95.52 6.24 49.48 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.515 1.126 . . . . 1.0 111.927 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 131.38 -166.41 22.88 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 127.229 2.347 . . . . 1.0 113.515 -173.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.04 170.79 27.33 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-O 123.627 1.682 . . . . 1.0 117.301 169.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -57.58 100.45 0.05 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 127.938 2.495 . . . . 1.0 109.202 169.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -130.64 133.17 45.91 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.685 1.594 . . . . 1.0 110.139 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -50.55 -67.27 0.27 Allowed 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 115.875 1.805 . . . . 1.0 115.875 -168.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 37.4 m -59.7 -41.01 89.8 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 119.254 0.933 . . . . 1.0 112.056 -175.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 47.6 tp -58.57 -39.07 79.28 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.46 1.104 . . . . 1.0 111.694 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -68.09 -36.02 79.12 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.813 0.845 . . . . 1.0 112.292 175.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.94 -41.86 86.27 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.308 0.958 . . . . 1.0 110.752 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -63.02 -36.06 82.31 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.69 0.626 . . . . 1.0 112.69 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.2 -36.37 83.99 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.428 -0.795 . . . . 1.0 112.396 171.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.87 -48.08 67.08 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.303 0.573 . . . . 1.0 111.085 176.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -76.54 -33.61 58.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.633 1.573 . . . . 1.0 114.254 -169.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.0 m-90 -134.11 -46.92 0.78 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.108 1.151 . . . . 1.0 114.108 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.39 154.2 6.29 Favored Glycine 0 N--CA 1.479 1.561 0 CA-C-N 119.292 0.951 . . . . 1.0 115.318 169.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -62.88 -31.91 77.37 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.218 2.612 . . . . 1.0 113.93 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -63.1 -46.63 86.43 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.906 0.882 . . . . 1.0 111.016 176.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.99 -53.67 55.78 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 125.174 1.39 . . . . 1.0 109.89 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 24.9 t -56.85 -47.82 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 126.059 1.744 . . . . 1.0 111.771 -176.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -67.99 -34.57 76.78 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.419 0.526 . . . . 1.0 112.419 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.8 m -67.09 -31.76 72.46 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.829 0.677 . . . . 1.0 112.829 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -74.63 -11.38 60.18 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.21 1.189 . . . . 1.0 114.21 174.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.43 168.99 14.96 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 124.245 1.974 . . . . 1.0 115.131 -170.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.7 m -142.24 142.73 32.64 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 130.157 3.383 . . . . 1.0 107.636 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.2 tt -108.11 122.59 47.21 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.82 0.848 . . . . 1.0 109.409 -174.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt -120.47 125.96 49.19 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.489 1.916 . . . . 1.0 110.814 -172.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -91.37 -9.26 63.45 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 124.393 0.997 . . . . 1.0 115.2 -173.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.186 0 C-N-CA 125.728 1.611 . . . . 1.0 112.025 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.912 0 O4'-C4'-C3' 109.079 3.479 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.085 0 O5'-C5'-C4' 114.437 3.026 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.238 0 O4'-C4'-C3' 109.17 3.57 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.297 0 O4'-C4'-C3' 108.639 3.039 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.355 0 O4'-C4'-C3' 108.447 2.847 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.421 0 O5'-C5'-C4' 114.651 3.179 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.622 2.922 0 P-O3'-C3' 124.056 3.63 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.055 0 O5'-C5'-C4' 114.858 3.327 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.022 1 O4'-C4'-C3' 109.804 4.204 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.661 0 O4'-C1'-N19 110.248 3.06 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.766 0 O4'-C4'-C3' 108.818 3.218 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.145 0 O4'-C1'-N19 110.166 2.957 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.791 0 O4'-C4'-C3' 108.541 2.941 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.822 0 O5'-C5'-C4' 115.142 3.53 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.145 1 O4'-C1'-N19 111.105 4.131 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.711 0 P-O3'-C3' 123.519 3.182 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.303 0 O4'-C1'-N19 110.239 3.049 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.926 0 O5'-C5'-C4' 114.035 2.739 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.617 0 P-O3'-C3' 123.865 3.471 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.333 1 C5'-C4'-C3' 106.882 -5.212 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.043 0 O4'-C4'-C3' 108.29 2.69 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.437 1 O4'-C1'-N19 111.188 4.235 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.542 0 O4'-C4'-C3' 109.319 3.719 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.058 1 O4'-C1'-N19 111.226 4.282 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 111.231 0.085 . . . . 1.0 111.231 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -67.41 58.81 0.05 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 126.654 1.982 . . . . 1.0 113.077 175.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.9 mttt -54.43 132.46 44.44 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 128.814 2.846 . . . . 1.0 111.48 177.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.0 t -75.14 134.77 28.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 113.403 -1.726 . . . . 1.0 111.574 173.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -109.61 123.13 48.92 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 106.96 -1.496 . . . . 1.0 106.96 167.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.13 143.9 29.38 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 104.287 -2.486 . . . . 1.0 104.287 168.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -123.55 136.01 54.31 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.257 -1.386 . . . . 1.0 107.257 173.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -135.3 97.4 3.7 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.246 1.018 . . . . 1.0 109.886 -169.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -72.09 119.52 75.02 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.465 1.106 . . . . 1.0 112.864 -169.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.1 -20.0 22.2 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 123.678 2.918 . . . . 1.0 114.239 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -83.91 -22.07 31.69 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.575 1.15 . . . . 1.0 113.793 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 62.6 p -127.42 -22.89 3.59 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.156 1.169 . . . . 1.0 114.156 -172.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.8 4.88 77.88 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-O 118.932 -0.927 . . . . 1.0 114.144 -171.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -74.13 155.45 38.41 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.46 1.63 . . . . 1.0 110.607 171.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 5.1 t -137.74 153.04 27.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 113.358 -1.746 . . . . 1.0 109.262 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.06 169.21 12.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 126.924 2.09 . . . . 1.0 109.122 177.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -147.44 121.52 9.46 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 127.537 2.335 . . . . 1.0 109.14 173.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.93 154.14 41.6 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.911 0.884 . . . . 1.0 109.756 -179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -95.41 8.79 42.16 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.109 -0.995 . . . . 1.0 112.002 174.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.38 -165.42 21.3 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 127.126 2.298 . . . . 1.0 113.335 -172.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.78 169.6 23.82 Favored Glycine 0 CA--C 1.537 1.453 0 N-CA-C 117.445 1.738 . . . . 1.0 117.445 169.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -57.76 101.25 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.559 2.344 . . . . 1.0 109.056 169.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -130.37 131.03 45.12 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.634 1.573 . . . . 1.0 109.839 178.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -49.39 -66.85 0.33 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.577 1.695 . . . . 1.0 115.577 -168.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.0 m -60.36 -40.39 90.57 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 119.36 0.982 . . . . 1.0 112.207 -175.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.7 tp -58.86 -38.47 78.86 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.334 1.053 . . . . 1.0 111.801 176.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.01 -36.51 80.09 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.476 0.711 . . . . 1.0 112.528 174.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.82 -41.98 86.61 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.296 0.953 . . . . 1.0 110.786 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -61.94 -38.41 88.38 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.532 0.568 . . . . 1.0 112.532 177.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -64.84 -34.77 79.16 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.529 -0.732 . . . . 1.0 112.177 172.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.61 -49.07 62.11 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.623 0.725 . . . . 1.0 110.945 176.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -73.22 -35.68 66.34 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.082 1.753 . . . . 1.0 114.425 -169.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.1 m-90 -132.81 -47.5 0.87 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.695 0.998 . . . . 1.0 113.695 -175.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.3 155.21 6.57 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.995 0.816 . . . . 1.0 114.676 169.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -61.77 -34.25 83.38 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.073 2.515 . . . . 1.0 113.788 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -61.12 -45.5 94.44 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 122.07 0.938 . . . . 1.0 111.339 177.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.47 -54.92 41.03 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 114.125 -1.398 . . . . 1.0 109.975 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.3 t -58.08 -46.32 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 125.448 1.499 . . . . 1.0 112.246 -174.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.0 -34.81 78.55 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.876 -0.515 . . . . 1.0 112.295 175.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.5 t -66.03 -32.38 73.82 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.622 -0.674 . . . . 1.0 112.339 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 27.9 m0 -73.37 -5.52 40.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.904 1.282 . . . . 1.0 113.663 173.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -75.16 168.48 19.9 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 124.151 1.929 . . . . 1.0 114.706 -175.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 84.0 m -147.86 139.72 24.01 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 130.134 3.373 . . . . 1.0 107.674 -176.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 30.3 tp -99.24 127.07 45.18 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.315 1.046 . . . . 1.0 109.786 -177.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.5 mt -124.37 122.01 36.51 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.175 1.79 . . . . 1.0 110.993 -176.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -77.54 -15.83 80.95 Favored Glycine 0 CA--C 1.539 1.551 0 CA-C-N 115.019 -0.991 . . . . 1.0 115.391 -174.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 41.5 m80 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 126.222 1.809 . . . . 1.0 111.318 -179.851 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.795 0 O4'-C4'-C3' 109.134 3.534 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.069 0 O5'-C5'-C4' 114.61 3.15 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.562 0 O4'-C4'-C3' 109.216 3.616 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.519 0 O4'-C4'-C3' 108.542 2.942 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.131 0 O4'-C4'-C3' 108.622 3.022 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.128 0 O4'-C4'-C3' 108.958 3.358 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.789 0 O4'-C1'-N19 110.99 3.988 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.185 0 O5'-C5'-C4' 114.471 3.051 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.233 1 O4'-C4'-C3' 109.846 4.246 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.592 0 O4'-C1'-N19 110.327 3.159 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.73 0 O4'-C4'-C3' 109.062 3.462 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.282 0 O4'-C1'-N19 110.025 2.781 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.927 0 O4'-C1'-N19 110.3 3.125 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.237 0 O5'-C5'-C4' 114.98 3.415 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.314 0 O4'-C1'-N19 110.837 3.796 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.858 0 P-O3'-C3' 123.393 3.077 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.25 0 O4'-C1'-N19 110.323 3.154 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.065 0 O5'-C5'-C4' 113.774 2.553 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.713 0 P-O3'-C3' 124.042 3.618 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.15 1 C5'-C4'-C3' 107.138 -5.041 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.584 0 O4'-C4'-C3' 107.721 2.121 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.462 1 O4'-C1'-N19 111.395 4.494 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.796 0 O4'-C4'-C3' 109.283 3.683 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.049 1 O4'-C1'-N19 111.215 4.269 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 120.807 0.337 . . . . 1.0 111.652 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.4 mmt-85 -60.0 63.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 127.936 2.494 . . . . 1.0 113.083 170.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.6 mtpt -51.48 135.86 26.96 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 128.956 2.903 . . . . 1.0 112.038 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.4 t -75.69 135.53 26.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 112.936 -1.938 . . . . 1.0 110.642 169.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -111.03 123.47 50.25 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.521 -1.659 . . . . 1.0 106.521 167.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -83.47 145.08 29.15 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 104.209 -2.515 . . . . 1.0 104.209 168.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -127.61 140.27 52.21 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 107.668 -1.234 . . . . 1.0 107.668 172.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -131.7 131.1 42.8 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.42 1.088 . . . . 1.0 109.736 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -96.81 110.1 51.83 Favored Pre-proline 0 CA--C 1.543 0.696 0 C-N-CA 123.043 0.537 . . . . 1.0 111.784 -173.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -65.48 -15.56 50.18 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.583 2.855 . . . . 1.0 114.312 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -88.88 -17.48 29.54 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 114.444 1.276 . . . . 1.0 114.444 178.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 38.5 p -129.72 -22.77 2.93 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 114.481 1.289 . . . . 1.0 114.481 -175.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.51 7.2 87.11 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 124.359 0.98 . . . . 1.0 114.36 -172.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.18 156.08 30.04 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.211 1.505 . . . . 1.0 110.785 173.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -136.12 153.66 32.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 C-N-CA 126.695 1.998 . . . . 1.0 109.635 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.68 167.74 12.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 127.626 2.371 . . . . 1.0 109.193 177.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -146.8 121.57 9.89 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.752 2.421 . . . . 1.0 109.279 173.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.84 152.01 38.02 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.683 0.793 . . . . 1.0 109.904 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -92.1 7.93 40.17 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 121.069 -1.019 . . . . 1.0 112.116 174.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 130.36 -166.01 22.43 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 126.702 2.096 . . . . 1.0 113.432 -173.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.99 170.34 26.27 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 117.196 1.638 . . . . 1.0 117.196 169.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -57.71 100.42 0.05 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.698 2.399 . . . . 1.0 109.015 169.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -130.52 128.04 40.35 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.559 1.544 . . . . 1.0 109.764 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -44.25 -68.29 0.21 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.386 1.624 . . . . 1.0 115.386 -168.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.8 m -59.83 -41.68 91.87 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 119.185 0.902 . . . . 1.0 112.17 -174.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.5 tp -59.27 -38.89 81.23 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.146 0.979 . . . . 1.0 111.545 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.0 mmmt -69.75 -32.46 71.0 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 118.527 -0.749 . . . . 1.0 112.965 175.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -69.12 -42.44 76.04 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.514 1.052 . . . . 1.0 110.922 176.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -61.49 -37.35 83.35 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.685 0.624 . . . . 1.0 112.685 178.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -66.09 -34.45 78.08 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.548 -0.72 . . . . 1.0 112.38 172.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.53 -48.73 63.56 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.824 0.821 . . . . 1.0 111.236 175.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -74.54 -34.15 62.9 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.941 1.697 . . . . 1.0 114.567 -169.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 17.1 m-90 -132.75 -48.06 0.88 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 113.78 1.03 . . . . 1.0 113.78 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.57 153.75 6.07 Favored Glycine 0 N--CA 1.476 1.333 0 CA-C-N 118.908 0.776 . . . . 1.0 114.648 169.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.61 -34.68 84.03 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.061 2.507 . . . . 1.0 113.806 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.24 -45.3 95.09 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.986 0.898 . . . . 1.0 111.124 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.18 -55.98 27.21 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 114.263 -1.335 . . . . 1.0 109.72 175.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 38.9 t -57.87 -46.55 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 125.466 1.506 . . . . 1.0 112.111 -174.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -67.27 -35.69 80.04 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.86 -0.525 . . . . 1.0 112.048 176.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.3 t -65.63 -34.04 77.3 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.72 -0.613 . . . . 1.0 112.217 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 25.6 m0 -70.72 -11.53 61.0 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.027 1.121 . . . . 1.0 114.027 174.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.95 168.32 17.22 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 124.141 1.924 . . . . 1.0 114.76 -171.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 88.5 m -143.58 136.55 27.62 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 129.314 3.045 . . . . 1.0 108.243 -176.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 38.6 tp -96.03 126.54 41.34 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.254 1.022 . . . . 1.0 110.115 -176.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.9 mt -126.07 117.28 22.86 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.654 1.582 . . . . 1.0 110.812 -175.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -82.76 -11.76 81.09 Favored Glycine 0 CA--C 1.539 1.556 0 CA-C-N 115.074 -0.966 . . . . 1.0 115.084 -175.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 11.7 p-80 . . . . . 0 C--O 1.253 1.269 0 C-N-CA 126.347 1.859 . . . . 1.0 112.093 176.81 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.686 0 O4'-C4'-C3' 109.135 3.535 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.965 0 O5'-C5'-C4' 114.353 2.966 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.194 0 O4'-C4'-C3' 109.257 3.657 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.703 0 O4'-C4'-C3' 108.486 2.886 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.144 0 O4'-C4'-C3' 108.738 3.138 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.215 0 O4'-C4'-C3' 109.026 3.426 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.509 1 O4'-C1'-N19 111.802 5.002 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.17 0 O5'-C5'-C4' 114.705 3.218 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.935 1 O4'-C4'-C3' 109.632 4.032 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.364 0 O4'-C1'-N19 110.448 3.311 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.568 0 O4'-C4'-C3' 108.897 3.297 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.25 0 O4'-C1'-N19 110.202 3.002 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 0 O4'-C1'-N19 110.523 3.404 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.963 0 O5'-C5'-C4' 114.946 3.39 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.341 0 O4'-C1'-N19 110.833 3.791 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.97 0 P-O3'-C3' 123.366 3.055 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.623 2.984 0 O4'-C4'-C3' 108.628 3.028 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.999 0 O5'-C5'-C4' 113.926 2.661 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.564 -2.926 0 P-O3'-C3' 124.185 3.737 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.345 2 O4'-C1'-N19 111.449 4.561 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.502 0 O4'-C4'-C3' 107.807 2.207 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.395 1 O4'-C1'-N19 111.769 4.961 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.761 0 O4'-C4'-C3' 109.282 3.682 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.142 1 O4'-C1'-N19 111.46 4.575 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 119.845 -0.121 . . . . 1.0 110.81 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.0 mmp_? -63.45 59.25 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 127.432 2.293 . . . . 1.0 114.465 175.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -55.02 131.04 43.98 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 128.8 2.84 . . . . 1.0 110.395 174.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 85.0 t -74.26 133.86 30.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 113.437 -1.71 . . . . 1.0 111.315 173.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.4 mttp -107.77 122.17 46.2 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 106.505 -1.665 . . . . 1.0 106.505 167.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.04 145.17 28.63 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 104.32 -2.474 . . . . 1.0 104.32 168.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -128.06 142.84 51.1 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.158 -1.052 . . . . 1.0 108.158 172.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -132.68 141.08 48.43 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.046 1.338 . . . . 1.0 109.576 177.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -108.13 109.12 61.82 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 123.119 0.567 . . . . 1.0 112.496 -173.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -53.28 -26.8 35.81 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 124.36 3.374 . . . . 1.0 115.603 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -87.91 -19.6 27.1 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.475 1.11 . . . . 1.0 113.731 -174.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 45.9 p -129.97 -19.45 3.24 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.563 1.319 . . . . 1.0 114.563 -171.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.12 11.69 75.17 Favored Glycine 0 CA--C 1.539 1.57 0 C-N-CA 124.002 0.81 . . . . 1.0 114.215 -173.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -75.89 150.74 37.51 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.429 1.492 . . . . 1.0 109.405 171.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -133.08 155.09 40.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 C-N-CA 126.506 1.923 . . . . 1.0 108.936 172.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.7 167.9 12.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 127.537 2.335 . . . . 1.0 109.267 177.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -146.96 121.14 9.5 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 127.653 2.381 . . . . 1.0 108.92 173.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.0 154.54 42.65 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.825 0.85 . . . . 1.0 109.937 -178.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -95.67 9.83 38.97 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 121.118 -0.989 . . . . 1.0 111.856 174.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 126.1 -166.38 18.89 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 127.086 2.279 . . . . 1.0 113.396 -172.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.05 170.12 29.35 Favored Glycine 0 CA--C 1.535 1.311 0 N-CA-C 117.481 1.752 . . . . 1.0 117.481 169.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -57.49 100.02 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 128.119 2.568 . . . . 1.0 109.147 169.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.3 t60 -130.4 136.9 49.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.344 1.458 . . . . 1.0 110.69 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -49.99 -70.92 0.07 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 125.525 1.53 . . . . 1.0 114.809 -169.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.0 m -60.5 -40.68 92.26 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 118.918 0.781 . . . . 1.0 111.87 -173.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.96 -39.34 77.88 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.282 1.033 . . . . 1.0 111.725 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.82 -36.05 77.73 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.493 0.717 . . . . 1.0 112.407 175.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -67.27 -42.37 83.97 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.248 0.931 . . . . 1.0 110.977 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -61.37 -38.6 87.59 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.821 0.675 . . . . 1.0 112.821 176.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -64.74 -34.9 79.42 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.694 -0.628 . . . . 1.0 112.148 173.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.27 -48.74 64.21 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.645 0.736 . . . . 1.0 110.978 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.58 -34.63 60.66 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.658 1.583 . . . . 1.0 114.79 -169.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.7 m-90 -132.01 -48.15 0.94 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.832 1.049 . . . . 1.0 113.832 -176.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.96 153.94 6.17 Favored Glycine 0 N--CA 1.479 1.557 0 CA-C-N 118.908 0.776 . . . . 1.0 114.856 169.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -61.51 -34.5 85.47 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.945 2.43 . . . . 1.0 113.959 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -60.96 -45.94 92.73 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 122.032 0.92 . . . . 1.0 111.248 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.91 -54.74 42.65 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.296 -1.32 . . . . 1.0 109.922 176.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.4 t -57.87 -47.34 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 C-N-CA 125.594 1.557 . . . . 1.0 112.074 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -66.92 -35.59 80.33 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.273 0.629 . . . . 1.0 112.163 175.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.5 m -66.47 -30.07 70.33 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 118.537 0.608 . . . . 1.0 112.514 178.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 19.2 m0 -75.6 -8.89 57.92 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.057 1.132 . . . . 1.0 114.057 173.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.1 168.81 16.34 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 124.118 1.913 . . . . 1.0 114.939 -172.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 91.4 m -144.54 142.92 30.56 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 130.177 3.391 . . . . 1.0 108.161 -176.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.96 123.6 48.41 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.025 0.93 . . . . 1.0 109.703 -176.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.8 mt -121.66 129.02 52.5 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.744 2.018 . . . . 1.0 110.77 -173.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -75.71 -18.92 79.48 Favored Glycine 0 CA--C 1.538 1.527 0 CA-C-N 115.222 -0.899 . . . . 1.0 115.283 -173.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.103 0 C-N-CA 125.904 1.682 . . . . 1.0 112.291 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.746 0 O4'-C4'-C3' 109.009 3.409 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.197 0 O5'-C5'-C4' 114.643 3.174 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.561 0 O4'-C4'-C3' 109.44 3.84 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.543 0 O4'-C4'-C3' 108.811 3.211 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.361 0 O4'-C4'-C3' 108.796 3.196 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.236 0 O5'-C5'-C4' 114.838 3.313 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.658 0 P-O3'-C3' 124.095 3.662 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.196 0 O5'-C5'-C4' 114.815 3.296 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.116 0 O4'-C4'-C3' 109.425 3.825 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.407 0 O4'-C4'-C3' 108.786 3.186 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.541 0 O4'-C4'-C3' 109.086 3.486 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.216 0 O4'-C1'-N19 110.468 3.335 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.823 0 O4'-C4'-C3' 108.656 3.056 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.191 0 O5'-C5'-C4' 115.138 3.527 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.094 0 O4'-C1'-N19 110.918 3.898 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.836 0 P-O3'-C3' 123.251 2.959 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.22 0 O4'-C4'-C3' 108.51 2.91 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.035 0 O5'-C5'-C4' 114.144 2.817 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.669 0 P-O3'-C3' 123.991 3.576 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.277 2 C5'-C4'-C3' 107.819 -4.587 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.311 0 O4'-C4'-C3' 107.904 2.304 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.749 1 O4'-C1'-N19 111.435 4.543 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.663 0 O4'-C4'-C3' 109.271 3.671 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.225 1 O4'-C1'-N19 111.24 4.299 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 120.336 0.112 . . . . 1.0 111.03 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 44.8 mmt-85 -67.47 61.51 0.06 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 126.392 1.877 . . . . 1.0 112.806 174.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -55.21 132.72 48.33 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 128.739 2.816 . . . . 1.0 111.207 178.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 84.3 t -74.02 134.12 30.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 113.411 -1.722 . . . . 1.0 111.78 173.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -108.0 123.13 48.19 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 106.379 -1.711 . . . . 1.0 106.379 167.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.4 145.24 28.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 104.38 -2.452 . . . . 1.0 104.38 168.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -127.5 141.83 51.55 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.027 -1.101 . . . . 1.0 108.027 172.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -133.04 139.1 47.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.629 1.172 . . . . 1.0 109.27 177.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.8 t-20 -106.08 110.51 64.07 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 112.372 0.508 . . . . 1.0 112.372 -173.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -52.96 -28.27 39.04 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 124.469 3.446 . . . . 1.0 115.793 175.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -86.34 -17.88 33.35 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.32 1.23 . . . . 1.0 114.32 -174.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.1 p -129.27 -22.8 3.06 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 114.0 1.111 . . . . 1.0 114.0 -173.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.37 8.31 83.56 Favored Glycine 0 CA--C 1.538 1.531 0 C-N-CA 124.265 0.936 . . . . 1.0 114.175 -172.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -79.18 157.12 27.93 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 123.137 1.446 . . . . 1.0 110.683 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.1 t -136.65 154.6 32.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 C-N-CA 127.149 2.18 . . . . 1.0 109.496 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.14 167.72 11.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 127.335 2.254 . . . . 1.0 109.301 177.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -146.99 120.58 9.12 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 127.674 2.389 . . . . 1.0 109.206 174.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.58 153.07 39.93 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.707 0.803 . . . . 1.0 109.93 -179.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -95.36 7.33 46.53 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.332 1.053 . . . . 1.0 111.609 176.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 130.82 -166.76 22.46 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 127.006 2.241 . . . . 1.0 113.444 -172.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.41 170.2 23.4 Favored Glycine 0 CA--C 1.536 1.398 0 N-CA-C 117.505 1.762 . . . . 1.0 117.505 170.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -57.6 100.91 0.06 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.728 2.411 . . . . 1.0 108.984 169.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -130.51 131.79 45.28 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.378 1.471 . . . . 1.0 109.875 177.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -48.72 -67.68 0.25 Allowed 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.767 1.766 . . . . 1.0 115.767 -168.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 36.9 m -59.72 -41.29 90.53 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-N 119.194 0.907 . . . . 1.0 112.084 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.9 tp -58.45 -39.12 79.0 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.939 0.896 . . . . 1.0 111.736 177.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -68.34 -35.81 78.32 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.35 0.66 . . . . 1.0 112.293 175.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -67.15 -42.02 85.05 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.366 0.984 . . . . 1.0 110.779 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -62.52 -37.82 87.53 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.606 0.595 . . . . 1.0 112.606 177.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -65.44 -34.3 77.96 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.701 -0.624 . . . . 1.0 112.528 172.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.14 -48.99 60.92 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.505 0.669 . . . . 1.0 111.17 176.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -74.53 -34.69 63.06 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.087 1.755 . . . . 1.0 114.587 -169.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.0 m-90 -132.89 -46.11 0.86 Allowed 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.847 1.054 . . . . 1.0 113.847 -176.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.46 153.9 6.33 Favored Glycine 0 N--CA 1.479 1.505 0 CA-C-N 118.94 0.791 . . . . 1.0 115.024 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -61.75 -33.35 85.71 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.947 2.431 . . . . 1.0 113.949 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -61.18 -45.98 92.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.836 0.826 . . . . 1.0 111.316 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.87 -54.94 40.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.107 1.363 . . . . 1.0 109.967 175.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.9 t -57.98 -47.91 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 125.577 1.551 . . . . 1.0 111.889 -174.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -67.09 -34.89 78.62 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.918 -0.489 . . . . 1.0 112.098 176.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.2 m -67.39 -30.3 70.04 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.667 -0.645 . . . . 1.0 112.572 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.3 m0 -74.41 -10.77 59.9 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.04 1.126 . . . . 1.0 114.04 173.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.65 168.39 17.79 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 124.213 1.959 . . . . 1.0 114.809 -171.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 93.4 m -144.21 142.44 30.51 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 130.083 3.353 . . . . 1.0 107.91 -175.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -107.24 124.13 49.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.925 0.89 . . . . 1.0 109.624 -176.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.6 mt -120.97 127.98 52.3 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.524 1.93 . . . . 1.0 110.962 -173.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -81.73 -14.88 76.91 Favored Glycine 0 CA--C 1.536 1.358 0 N-CA-C 115.377 0.911 . . . . 1.0 115.377 -174.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.217 0 C-N-CA 125.979 1.711 . . . . 1.0 112.075 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.027 0 O4'-C4'-C3' 109.119 3.519 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.015 0 O5'-C5'-C4' 114.308 2.934 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.338 0 O4'-C4'-C3' 109.322 3.722 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.486 0 O4'-C4'-C3' 108.447 2.847 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.261 0 O4'-C4'-C3' 108.928 3.328 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.947 0 O5'-C5'-C4' 114.838 3.313 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.676 0 O4'-C1'-N19 110.615 3.519 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.942 0 O5'-C5'-C4' 115.192 3.565 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.993 1 O4'-C4'-C3' 109.822 4.222 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.708 0 O4'-C1'-N19 110.308 3.135 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.312 0 O4'-C4'-C3' 109.026 3.426 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.019 0 O4'-C1'-N19 109.897 2.621 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.866 0 O4'-C4'-C3' 108.518 2.918 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.997 0 O5'-C5'-C4' 114.917 3.369 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.06 0 O4'-C1'-N19 110.932 3.914 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.921 0 P-O3'-C3' 123.4 3.083 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.179 0 O4'-C1'-N19 110.248 3.061 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.737 0 O5'-C5'-C4' 114.136 2.812 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.753 0 P-O3'-C3' 123.891 3.493 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.226 1 C5'-C4'-C3' 107.417 -4.855 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.664 0 O4'-C4'-C3' 107.665 2.065 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.373 1 O4'-C1'-N19 111.543 4.679 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.452 0 O4'-C4'-C3' 109.192 3.592 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.222 1 O4'-C1'-N19 111.176 4.22 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.386 0.136 . . . . 1.0 111.253 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.5 mmt-85 -69.03 56.25 0.09 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 126.667 1.987 . . . . 1.0 113.168 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -56.05 128.92 37.72 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 128.594 2.757 . . . . 1.0 110.715 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 91.2 t -71.98 135.21 28.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 113.618 -1.628 . . . . 1.0 110.801 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -109.31 121.72 45.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 106.691 -1.596 . . . . 1.0 106.691 167.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.01 144.11 29.33 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 103.887 -2.634 . . . . 1.0 103.887 167.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -127.38 140.03 52.45 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.87 -1.159 . . . . 1.0 107.87 174.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -131.75 134.78 46.23 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.738 1.215 . . . . 1.0 109.616 178.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -99.82 110.41 59.03 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 123.209 0.604 . . . . 1.0 111.651 -173.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -66.37 -14.83 45.85 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.181 2.588 . . . . 1.0 114.3 -179.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -89.17 -20.77 23.8 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.599 1.16 . . . . 1.0 114.084 177.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.6 p -129.99 -20.98 3.05 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.24 1.57 . . . . 1.0 115.24 -171.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.33 10.71 82.14 Favored Glycine 0 CA--C 1.541 1.696 0 C-N-CA 123.857 0.742 . . . . 1.0 114.302 -173.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -74.06 148.76 41.61 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.181 1.392 . . . . 1.0 109.273 170.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.8 t -132.19 154.74 40.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 C-N-CA 126.362 1.865 . . . . 1.0 108.974 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.43 168.08 10.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 127.53 2.332 . . . . 1.0 109.417 177.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -147.21 120.26 8.81 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.808 2.443 . . . . 1.0 109.174 173.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.98 157.79 43.87 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.16 0.984 . . . . 1.0 109.98 -178.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -99.07 11.59 38.57 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 120.792 -1.192 . . . . 1.0 111.855 176.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 123.71 -167.01 16.03 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 127.165 2.317 . . . . 1.0 112.971 -171.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.23 169.5 32.03 Favored Glycine 0 CA--C 1.536 1.393 0 N-CA-C 117.329 1.692 . . . . 1.0 117.329 169.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -57.7 99.3 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 128.057 2.543 . . . . 1.0 109.14 169.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -130.55 132.87 45.8 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.345 1.458 . . . . 1.0 110.583 178.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.7 tppt? -44.83 -71.24 0.08 Allowed 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 125.747 1.619 . . . . 1.0 114.995 -169.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.8 m -61.45 -40.06 93.11 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 118.532 0.605 . . . . 1.0 111.947 -173.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.7 tp -58.25 -40.4 81.68 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.259 1.024 . . . . 1.0 111.488 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -69.65 -32.2 70.72 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.681 0.792 . . . . 1.0 112.982 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.95 -42.59 76.45 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.619 1.1 . . . . 1.0 111.225 176.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.0 m0 -61.14 -36.69 80.44 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.627 0.603 . . . . 1.0 112.627 177.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -65.11 -36.47 84.39 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.424 -0.798 . . . . 1.0 112.611 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.24 -48.01 71.91 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.472 0.653 . . . . 1.0 110.989 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -76.27 -34.05 59.13 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.304 1.442 . . . . 1.0 114.64 -169.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.6 m-90 -134.02 -48.26 0.79 Allowed 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.942 1.089 . . . . 1.0 113.942 -176.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.7 153.73 6.06 Favored Glycine 0 N--CA 1.48 1.627 0 CA-C-N 119.34 0.973 . . . . 1.0 115.265 169.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.57 -33.34 78.42 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 123.212 2.608 . . . . 1.0 114.214 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -62.85 -46.79 86.25 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 122.168 0.985 . . . . 1.0 111.042 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.78 -53.66 55.91 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.313 1.445 . . . . 1.0 109.935 176.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 28.1 t -57.29 -47.79 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 125.774 1.629 . . . . 1.0 111.778 -175.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.89 -36.0 82.2 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.3 0.64 . . . . 1.0 112.562 174.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.2 m -66.84 -30.75 71.02 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.585 0.587 . . . . 1.0 112.585 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 16.2 m0 -75.83 -8.78 57.7 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.947 1.091 . . . . 1.0 113.947 173.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.7 168.9 16.78 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 124.032 1.872 . . . . 1.0 114.831 -172.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 94.9 m -142.53 141.74 32.12 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 130.521 3.529 . . . . 1.0 107.632 -176.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.08 123.32 47.83 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.779 0.832 . . . . 1.0 109.64 -175.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 82.4 mt -121.44 129.13 52.8 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.525 1.93 . . . . 1.0 110.927 -173.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -76.88 -17.45 79.82 Favored Glycine 0 CA--C 1.538 1.508 0 CA-C-N 115.219 -0.901 . . . . 1.0 115.277 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.251 1.142 0 C-N-CA 126.306 1.842 . . . . 1.0 111.004 179.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.006 0 O4'-C4'-C3' 109.239 3.639 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.205 0 O5'-C5'-C4' 114.478 3.055 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.366 0 O4'-C4'-C3' 109.217 3.617 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.737 0 O5'-C5'-C4' 114.072 2.766 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.243 0 O4'-C4'-C3' 108.777 3.177 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.005 0 O4'-C4'-C3' 109.158 3.558 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.619 2.601 0 O4'-C1'-N19 110.524 3.404 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.204 0 O5'-C5'-C4' 114.596 3.14 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.049 0 O4'-C4'-C3' 109.467 3.867 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.337 0 O4'-C4'-C3' 108.914 3.314 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.821 0 O4'-C4'-C3' 109.179 3.579 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.371 0 O4'-C1'-N19 110.192 2.99 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.793 0 O5'-C5'-C4' 114.125 2.804 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.013 0 O5'-C5'-C4' 114.957 3.398 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.435 0 O4'-C1'-N19 110.784 3.731 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.726 0 P-O3'-C3' 123.291 2.992 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.2 0 O4'-C1'-N19 110.072 2.84 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.986 0 O5'-C5'-C4' 113.71 2.507 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.565 -2.826 0 P-O3'-C3' 123.872 3.476 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.183 2 C5'-C4'-C3' 106.68 -5.346 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.494 0 O4'-C4'-C3' 107.87 2.27 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.513 1 O4'-C1'-N19 111.292 4.365 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.62 0 O4'-C4'-C3' 109.347 3.747 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.24 1 O4'-C1'-N19 111.172 4.215 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.462 0 CA-C-O 120.491 0.186 . . . . 1.0 111.337 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 29.9 mmt-85 -69.46 58.27 0.12 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 126.483 1.913 . . . . 1.0 112.637 175.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -55.89 130.96 45.74 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 128.634 2.774 . . . . 1.0 110.995 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.5 t -73.62 134.1 30.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 113.584 -1.643 . . . . 1.0 110.95 172.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 40.2 mttt -108.45 122.32 46.78 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 106.777 -1.564 . . . . 1.0 106.777 167.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.53 144.1 28.9 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 103.932 -2.618 . . . . 1.0 103.932 167.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.4 ' CD1' ' HB2' ' A' ' 120' ' ' ALA . 76.4 m-85 -127.46 138.58 52.99 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 107.84 -1.17 . . . . 1.0 107.84 173.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -131.73 125.97 33.33 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.61 1.164 . . . . 1.0 109.847 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -92.41 110.79 47.11 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 123.163 0.585 . . . . 1.0 111.767 -172.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -65.87 -14.56 45.16 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.371 2.714 . . . . 1.0 114.659 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -88.94 -18.08 28.21 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.169 1.174 . . . . 1.0 114.169 178.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.2 p -129.51 -22.9 2.97 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.382 1.252 . . . . 1.0 114.382 -174.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 76.86 7.55 86.32 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 124.361 0.982 . . . . 1.0 114.486 -172.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -78.05 156.33 30.12 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 119.243 1.521 . . . . 1.0 110.877 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 20.9 t -136.44 153.66 31.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 C-N-CA 126.691 1.997 . . . . 1.0 109.814 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.58 168.07 12.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 127.658 2.383 . . . . 1.0 109.405 177.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -146.74 120.89 9.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.736 2.414 . . . . 1.0 109.136 173.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.92 155.89 43.16 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.898 0.879 . . . . 1.0 109.897 -178.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -97.81 10.15 40.85 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.113 -0.992 . . . . 1.0 111.693 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 126.12 -165.31 19.36 Favored Glycine 0 CA--C 1.532 1.143 0 C-N-CA 127.227 2.346 . . . . 1.0 113.085 -171.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.07 168.44 26.14 Favored Glycine 0 CA--C 1.535 1.32 0 N-CA-C 117.157 1.623 . . . . 1.0 117.157 169.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -57.59 100.49 0.05 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 127.421 2.288 . . . . 1.0 109.035 169.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -130.38 126.34 36.83 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.692 1.597 . . . . 1.0 109.534 178.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -44.84 -66.6 0.37 Allowed 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 115.774 1.768 . . . . 1.0 115.774 -168.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.8 m -60.46 -40.98 93.17 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.403 1.001 . . . . 1.0 112.132 -175.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 42.6 tp -59.5 -39.07 82.61 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.053 0.941 . . . . 1.0 111.545 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -68.56 -32.56 72.57 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.628 0.771 . . . . 1.0 113.036 175.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -68.87 -42.64 76.74 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.426 1.012 . . . . 1.0 110.909 176.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.8 m0 -62.06 -36.01 80.35 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.426 0.528 . . . . 1.0 112.426 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.9 -36.11 82.48 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.5 -0.75 . . . . 1.0 112.464 172.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.07 -48.89 66.87 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.859 0.837 . . . . 1.0 111.004 176.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.2 -33.02 61.37 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.706 1.602 . . . . 1.0 114.546 -169.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -134.5 -48.43 0.77 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.832 1.049 . . . . 1.0 113.832 -176.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.62 153.91 6.11 Favored Glycine 0 N--CA 1.479 1.529 0 CA-C-N 119.35 0.977 . . . . 1.0 115.148 169.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.49 -32.87 80.18 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 123.043 2.496 . . . . 1.0 114.187 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -62.64 -46.61 87.41 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.0 0.905 . . . . 1.0 111.027 176.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.85 -53.81 54.19 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.202 1.401 . . . . 1.0 109.648 176.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.8 t -57.53 -47.09 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 C-N-CA 125.872 1.669 . . . . 1.0 111.788 -175.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.81 -37.99 89.48 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.362 0.665 . . . . 1.0 112.373 173.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 56.7 m -66.51 -29.88 70.08 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.051 0.54 . . . . 1.0 112.435 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 26.8 m0 -74.83 -10.3 59.37 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.184 1.179 . . . . 1.0 114.184 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.4 ' HB2' ' CD1' ' A' ' 85' ' ' TYR . . . -71.83 168.73 17.26 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 124.09 1.9 . . . . 1.0 115.075 -171.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 63.7 m -144.18 139.59 28.84 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 129.857 3.263 . . . . 1.0 108.369 -176.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.6 tp -97.86 126.44 43.24 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.4 1.08 . . . . 1.0 109.763 -177.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 86.6 mt -124.49 120.25 31.46 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.776 1.631 . . . . 1.0 111.12 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -88.4 -8.57 70.88 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.426 1.012 . . . . 1.0 115.457 -175.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.255 1.375 0 C-N-CA 126.038 1.735 . . . . 1.0 112.204 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.925 0 O4'-C4'-C3' 109.115 3.515 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.866 0 O4'-C1'-N19 110.307 3.134 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C4'-C3' 109.16 3.56 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.598 0 O4'-C4'-C3' 108.396 2.796 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.044 0 O4'-C4'-C3' 108.562 2.962 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.916 0 O4'-C4'-C3' 108.905 3.305 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.772 0 O4'-C1'-N19 110.747 3.683 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.397 0 O5'-C5'-C4' 114.401 3.001 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.978 1 O4'-C4'-C3' 109.721 4.121 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.617 0 O4'-C1'-N19 110.399 3.248 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.663 0 O4'-C4'-C3' 109.027 3.427 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C1'-N19 110.168 2.96 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.948 0 O4'-C4'-C3' 108.74 3.14 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.958 0 O5'-C5'-C4' 114.957 3.398 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.073 0 O4'-C1'-N19 110.841 3.802 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.843 0 P-O3'-C3' 123.302 3.002 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.308 0 O4'-C1'-N19 110.235 3.044 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.991 0 O5'-C5'-C4' 113.908 2.649 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.563 -3.02 0 P-O3'-C3' 123.772 3.394 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.087 1 C5'-C4'-C3' 106.657 -5.362 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.777 0 O5'-C5'-C4' 113.309 2.221 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.42 1 O4'-C1'-N19 111.514 4.643 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.658 0 O4'-C4'-C3' 109.15 3.55 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.542 1 O4'-C1'-N19 111.295 4.369 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.613 0.244 . . . . 1.0 111.631 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 50.8 mmt-85 -69.68 61.24 0.16 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 126.124 1.769 . . . . 1.0 112.915 175.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.8 mttt -58.12 131.67 51.21 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 128.413 2.685 . . . . 1.0 110.577 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.3 t -70.66 134.53 29.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 113.572 -1.649 . . . . 1.0 110.996 171.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.4 mttt -107.99 120.1 41.34 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 106.833 -1.543 . . . . 1.0 106.833 167.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.91 143.69 31.48 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 103.21 -2.885 . . . . 1.0 103.21 167.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -127.2 142.5 51.47 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.841 -1.17 . . . . 1.0 107.841 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.68 142.32 49.79 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.869 1.268 . . . . 1.0 109.546 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -109.26 109.6 60.45 Favored Pre-proline 0 CA--C 1.548 0.892 0 N-CA-C 112.846 0.684 . . . . 1.0 112.846 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_exo -53.13 -27.58 37.7 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 124.345 3.363 . . . . 1.0 115.743 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -89.35 -21.62 23.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.774 1.229 . . . . 1.0 114.087 -173.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.5 p -127.04 -17.97 4.72 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 114.286 1.217 . . . . 1.0 114.286 -171.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.71 11.16 72.89 Favored Glycine 0 CA--C 1.541 1.699 0 C-N-CA 123.843 0.735 . . . . 1.0 114.218 -174.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -78.18 150.92 33.45 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.716 1.606 . . . . 1.0 109.696 174.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 t -132.97 154.7 40.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 126.614 1.966 . . . . 1.0 108.913 172.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.28 168.35 10.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 127.372 2.269 . . . . 1.0 109.575 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -146.95 119.77 8.66 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 127.669 2.388 . . . . 1.0 109.605 172.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.97 149.87 34.03 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.894 0.878 . . . . 1.0 109.748 -178.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -92.41 9.9 32.26 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 120.851 -1.155 . . . . 1.0 111.907 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.89 -166.1 20.66 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 127.105 2.288 . . . . 1.0 113.363 -170.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.51 168.2 27.21 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 125.466 1.508 . . . . 1.0 116.818 170.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -56.95 102.57 0.09 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 127.234 2.214 . . . . 1.0 109.077 169.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -130.8 135.13 47.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.031 1.332 . . . . 1.0 111.061 177.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -49.46 -69.17 0.12 Allowed 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 126.2 1.8 . . . . 1.0 114.811 -169.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 38.2 m -62.09 -39.51 92.72 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.35 -0.844 . . . . 1.0 111.942 -175.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 43.4 tp -58.6 -39.42 80.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.464 1.106 . . . . 1.0 111.557 176.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -67.52 -36.23 80.62 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.656 0.783 . . . . 1.0 112.273 175.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -67.32 -42.03 84.31 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.106 0.866 . . . . 1.0 111.313 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 34.9 m0 -61.78 -37.23 83.56 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.69 0.626 . . . . 1.0 112.69 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -64.85 -36.0 82.95 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 121.343 -0.848 . . . . 1.0 112.139 172.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.07 -49.01 66.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.667 0.746 . . . . 1.0 110.816 176.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -69.82 -37.37 76.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.531 1.533 . . . . 1.0 113.726 -170.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 11.6 m-90 -133.84 -54.55 0.87 Allowed 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.62 0.97 . . . . 1.0 113.62 -175.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 147.75 157.24 7.37 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-N 118.974 0.806 . . . . 1.0 114.934 172.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.78 -30.29 68.69 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.954 2.436 . . . . 1.0 113.842 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -62.43 -46.86 86.63 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.083 0.953 . . . . 1.0 111.086 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.84 -52.68 64.68 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.048 1.339 . . . . 1.0 109.979 176.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 38.0 t -57.42 -47.88 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 C-N-CA 125.843 1.657 . . . . 1.0 111.842 -176.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.63 -37.84 88.95 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.838 0.855 . . . . 1.0 112.587 173.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.5 m -65.31 -29.06 69.78 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.771 -0.581 . . . . 1.0 112.535 -178.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -80.74 -5.71 57.47 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.374 1.249 . . . . 1.0 114.374 174.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.27 168.65 16.86 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 124.026 1.87 . . . . 1.0 115.1 -172.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 67.7 m -142.12 135.64 29.27 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 130.083 3.353 . . . . 1.0 108.696 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 26.6 tp -87.86 126.87 35.27 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.641 1.176 . . . . 1.0 110.163 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.7 mt -131.56 145.1 51.55 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.936 2.095 . . . . 1.0 110.361 176.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -56.52 157.21 10.77 Favored Glycine 0 CA--C 1.545 1.909 0 CA-C-N 115.117 -0.947 . . . . 1.0 114.226 171.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 . . . . . 0 C--O 1.255 1.343 0 C-N-CA 125.212 1.405 . . . . 1.0 112.971 179.745 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.075 0 O4'-C4'-C3' 109.222 3.622 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.03 0 O5'-C5'-C4' 114.445 3.032 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.434 0 O4'-C4'-C3' 109.334 3.734 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.307 0 O4'-C4'-C3' 108.523 2.923 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.142 0 O4'-C4'-C3' 108.713 3.113 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.071 0 O5'-C5'-C4' 114.93 3.379 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.585 0 P-O3'-C3' 123.66 3.3 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.19 0 O5'-C5'-C4' 114.614 3.153 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.801 0 O4'-C4'-C3' 109.485 3.885 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.621 0 O4'-C4'-C3' 108.946 3.346 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.652 0 O4'-C4'-C3' 108.998 3.398 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.17 0 O4'-C1'-N19 110.236 3.045 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.704 0 O5'-C5'-C4' 114.291 2.922 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.373 0 O5'-C5'-C4' 114.834 3.31 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.179 0 O4'-C1'-N19 110.919 3.899 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.745 0 O5'-C5'-C4' 114.388 2.991 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.125 0 O4'-C1'-N19 110.074 2.843 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.97 0 O5'-C5'-C4' 113.832 2.594 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.657 0 P-O3'-C3' 123.877 3.481 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.01 1 C5'-C4'-C3' 106.675 -5.35 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.646 0 O5'-C5'-C4' 113.368 2.263 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.418 1 O4'-C1'-N19 111.552 4.69 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.559 0 O4'-C4'-C3' 109.204 3.604 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.148 1 O4'-C1'-N19 111.031 4.039 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.282 0.087 . . . . 1.0 111.15 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.9 mmt-85 -67.56 59.16 0.06 Allowed 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 126.611 1.964 . . . . 1.0 112.996 175.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.4 mttt -54.91 132.75 47.32 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 128.869 2.867 . . . . 1.0 111.074 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.1 t -74.77 134.73 28.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 113.464 -1.698 . . . . 1.0 111.692 174.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.5 mttp -108.68 122.51 47.27 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 106.598 -1.63 . . . . 1.0 106.598 167.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.19 145.68 28.23 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 104.607 -2.368 . . . . 1.0 104.607 168.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -128.03 142.12 51.32 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.907 -1.146 . . . . 1.0 107.907 172.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -133.83 138.03 45.41 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.989 1.316 . . . . 1.0 109.137 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.5 t-20 -105.51 110.31 64.14 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 112.348 0.499 . . . . 1.0 112.348 -173.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -53.29 -27.76 39.99 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 124.405 3.404 . . . . 1.0 115.694 176.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -86.58 -17.47 33.89 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.771 1.228 . . . . 1.0 114.216 -174.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.5 p -129.45 -22.32 3.06 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.267 1.21 . . . . 1.0 114.267 -174.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.95 8.13 82.32 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.369 0.985 . . . . 1.0 114.169 -172.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.15 156.67 29.76 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 119.141 1.47 . . . . 1.0 110.745 173.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -136.62 154.97 33.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 126.799 2.04 . . . . 1.0 109.194 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.71 168.02 10.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 127.513 2.325 . . . . 1.0 109.28 178.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -147.49 121.83 9.64 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 127.735 2.414 . . . . 1.0 109.148 174.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.31 153.6 41.44 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.731 0.812 . . . . 1.0 109.663 -179.081 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -94.51 8.13 43.22 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.964 -1.085 . . . . 1.0 111.807 174.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.51 -166.66 20.97 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 126.919 2.2 . . . . 1.0 113.4 -172.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.47 169.82 26.83 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-O 123.603 1.668 . . . . 1.0 116.886 169.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -57.69 102.97 0.11 Allowed 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 127.644 2.378 . . . . 1.0 108.818 169.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.4 t60 -130.51 131.87 45.32 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.111 1.364 . . . . 1.0 109.767 178.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.4 tttt -49.75 -66.02 0.46 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 115.903 1.816 . . . . 1.0 115.903 -168.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 41.2 m -60.49 -41.23 93.84 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 119.488 1.04 . . . . 1.0 111.891 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.1 tp -59.05 -38.52 79.57 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.103 0.961 . . . . 1.0 111.482 177.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.31 -36.11 78.83 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.681 0.792 . . . . 1.0 112.399 175.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -66.8 -42.14 86.43 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 119.331 0.969 . . . . 1.0 110.75 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -61.71 -38.45 87.9 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.695 0.628 . . . . 1.0 112.695 177.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -65.34 -34.28 77.95 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.53 -0.732 . . . . 1.0 112.38 172.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.02 58.87 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.567 0.699 . . . . 1.0 111.24 176.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -74.58 -34.09 62.81 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.906 1.682 . . . . 1.0 114.669 -169.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -132.89 -47.16 0.86 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.588 0.958 . . . . 1.0 113.588 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.34 154.21 6.3 Favored Glycine 0 N--CA 1.477 1.368 0 CA-C-N 118.952 0.796 . . . . 1.0 115.084 169.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.65 -33.89 85.38 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.088 2.526 . . . . 1.0 113.864 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -61.23 -45.98 92.32 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 122.038 0.923 . . . . 1.0 111.286 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.66 -54.84 41.75 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 114.211 -1.358 . . . . 1.0 109.827 175.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 36.4 t -58.07 -47.37 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 125.462 1.505 . . . . 1.0 112.043 -174.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.32 -35.76 80.08 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.778 -0.576 . . . . 1.0 111.979 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.2 t -65.4 -33.62 76.38 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.476 0.58 . . . . 1.0 112.195 178.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 28.1 m0 -71.55 -11.84 61.06 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.093 1.146 . . . . 1.0 114.093 174.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.15 168.52 17.02 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 124.041 1.877 . . . . 1.0 114.98 -171.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 91.2 m -144.29 143.45 31.01 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 130.213 3.405 . . . . 1.0 107.958 -175.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -108.41 124.25 50.1 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.899 0.88 . . . . 1.0 109.587 -176.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.6 mt -121.89 128.83 52.03 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.817 2.047 . . . . 1.0 110.819 -172.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -91.61 -13.09 58.71 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.377 0.989 . . . . 1.0 115.548 -173.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 . . . . . 0 C--O 1.255 1.366 0 C-N-CA 125.806 1.642 . . . . 1.0 110.992 -179.893 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.845 0 O4'-C4'-C3' 109.075 3.475 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.025 0 O4'-C4'-C3' 108.532 2.932 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.453 0 O4'-C4'-C3' 109.364 3.764 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.694 0 O4'-C4'-C3' 108.377 2.777 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.261 0 O4'-C4'-C3' 108.631 3.031 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.084 0 O4'-C4'-C3' 109.185 3.585 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.879 0 O4'-C1'-N19 110.936 3.92 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.128 0 O5'-C5'-C4' 114.421 3.015 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.938 1 O4'-C4'-C3' 109.689 4.089 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.412 0 O4'-C4'-C3' 108.815 3.215 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.86 0 O4'-C4'-C3' 109.035 3.435 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.17 0 O4'-C1'-N19 110.297 3.121 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.829 0 O5'-C5'-C4' 114.16 2.829 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.057 0 O5'-C5'-C4' 114.999 3.428 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.196 1 O4'-C1'-N19 111.241 4.301 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.123 0 P-O3'-C3' 123.346 3.038 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.193 0 O4'-C1'-N19 110.222 3.027 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.947 0 C2'-C3'-O3' 117.399 2.518 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.567 -2.642 0 P-O3'-C3' 123.993 3.577 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.292 1 C5'-C4'-C3' 107.588 -4.741 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.555 0 O4'-C4'-C3' 107.894 2.294 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.445 1 O4'-C1'-N19 111.475 4.594 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.808 0 O4'-C4'-C3' 109.244 3.644 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.204 1 O4'-C1'-N19 111.347 4.434 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.425 0.155 . . . . 1.0 111.349 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 26.2 mmt-85 -69.65 56.22 0.12 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 126.602 1.961 . . . . 1.0 113.049 176.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -55.07 130.87 43.5 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 129.056 2.943 . . . . 1.0 111.123 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 74.2 t -73.39 132.84 32.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 113.729 -1.578 . . . . 1.0 111.973 173.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.9 mttt -106.43 121.92 45.24 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.753 -1.573 . . . . 1.0 106.753 167.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -83.83 144.66 29.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 103.714 -2.698 . . . . 1.0 103.714 167.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.401 ' CD1' ' HB2' ' A' ' 120' ' ' ALA . 71.2 m-85 -126.78 142.84 51.43 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.918 -1.141 . . . . 1.0 107.918 172.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -132.72 138.51 47.26 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.934 1.294 . . . . 1.0 109.088 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -105.02 110.66 64.8 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 112.317 0.488 . . . . 1.0 112.317 -174.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -53.05 -27.53 36.74 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.33 3.353 . . . . 1.0 115.998 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -87.41 -17.16 32.91 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.83 1.252 . . . . 1.0 114.086 -174.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 42.6 p -129.78 -22.46 2.94 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.362 1.245 . . . . 1.0 114.362 -174.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.76 7.24 83.36 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 124.369 0.985 . . . . 1.0 114.251 -172.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -77.79 156.79 30.29 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 123.14 1.448 . . . . 1.0 110.738 173.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.3 t -137.37 155.12 31.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 126.795 2.038 . . . . 1.0 109.461 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.25 169.64 9.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 127.266 2.226 . . . . 1.0 109.79 177.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -146.15 123.17 11.4 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 128.017 2.527 . . . . 1.0 109.641 170.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.06 155.42 43.34 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.897 0.879 . . . . 1.0 109.735 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.4 mttp -95.2 8.67 42.34 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.121 0.968 . . . . 1.0 111.872 173.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 125.94 -165.82 18.96 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 126.907 2.194 . . . . 1.0 113.232 -170.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.6 168.75 25.14 Favored Glycine 0 CA--C 1.535 1.3 0 N-CA-C 117.021 1.568 . . . . 1.0 117.021 170.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -57.68 102.05 0.09 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.322 2.249 . . . . 1.0 108.796 169.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -130.42 127.78 39.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.349 1.46 . . . . 1.0 109.6 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.1 tttt -45.39 -66.69 0.36 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 116.036 1.865 . . . . 1.0 116.036 -168.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.8 m -60.12 -41.25 92.24 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.23 0.923 . . . . 1.0 112.28 -177.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 45.5 tp -59.95 -38.7 83.19 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.897 0.879 . . . . 1.0 111.576 178.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -68.74 -32.78 72.79 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.679 0.792 . . . . 1.0 112.707 174.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -68.33 -42.9 78.66 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.563 1.074 . . . . 1.0 110.947 176.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.0 m0 -61.61 -36.37 80.52 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.555 0.576 . . . . 1.0 112.555 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.82 -36.05 82.39 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.45 -0.781 . . . . 1.0 112.432 172.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.2 -48.68 67.17 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.701 0.763 . . . . 1.0 111.024 176.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -75.38 -33.56 61.03 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.782 1.633 . . . . 1.0 114.336 -169.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.3 m-90 -134.46 -48.16 0.77 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.987 1.106 . . . . 1.0 113.987 -175.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.82 153.22 5.93 Favored Glycine 0 N--CA 1.479 1.518 0 CA-C-N 119.142 0.883 . . . . 1.0 115.225 169.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.3 -32.51 81.8 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.093 2.529 . . . . 1.0 114.356 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -62.43 -46.63 87.66 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 122.136 0.97 . . . . 1.0 111.03 176.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.39 -53.22 60.63 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 114.15 -1.386 . . . . 1.0 110.179 176.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 34.4 t -57.71 -47.49 85.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 C-N-CA 125.644 1.578 . . . . 1.0 111.88 -175.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.6 -38.08 89.77 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.451 0.7 . . . . 1.0 112.322 173.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.4 m -66.35 -29.66 69.89 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.414 0.524 . . . . 1.0 112.414 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -76.52 -8.85 58.03 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.953 1.094 . . . . 1.0 113.953 173.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.401 ' HB2' ' CD1' ' A' ' 85' ' ' TYR . . . -72.42 168.8 17.71 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 124.032 1.872 . . . . 1.0 114.866 -171.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 95.8 m -144.21 136.29 26.35 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 129.63 3.172 . . . . 1.0 108.444 -175.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 27.6 tp -92.76 128.16 38.53 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 124.663 1.185 . . . . 1.0 109.657 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.6 mt -127.91 131.42 49.39 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.866 1.666 . . . . 1.0 111.246 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -78.81 12.75 21.52 Favored Glycine 0 CA--C 1.541 1.67 0 C-N-CA 125.316 1.436 . . . . 1.0 114.85 175.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 55.6 m170 . . . . . 0 C--O 1.254 1.317 0 C-N-CA 125.321 1.448 . . . . 1.0 113.293 176.197 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.919 0 O4'-C4'-C3' 109.123 3.523 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.996 0 O5'-C5'-C4' 114.504 3.074 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.227 0 O4'-C4'-C3' 109.27 3.67 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.519 0 O4'-C4'-C3' 108.398 2.798 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.137 0 O4'-C4'-C3' 108.697 3.097 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.623 2.984 0 O4'-C4'-C3' 109.0 3.4 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.703 0 O4'-C1'-N19 110.979 3.974 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.247 0 O5'-C5'-C4' 114.409 3.006 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.196 1 O4'-C4'-C3' 109.859 4.259 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.438 0 O4'-C1'-N19 110.364 3.205 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.762 0 O4'-C4'-C3' 108.998 3.398 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.282 0 O4'-C1'-N19 110.079 2.849 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.747 0 O5'-C5'-C4' 114.489 3.063 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.201 0 O5'-C5'-C4' 115.012 3.437 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.336 0 O4'-C1'-N19 110.825 3.781 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.76 0 P-O3'-C3' 123.473 3.145 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.439 0 O4'-C4'-C3' 108.57 2.97 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.766 0 O5'-C5'-C4' 113.984 2.703 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.566 -2.743 0 P-O3'-C3' 123.821 3.434 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.944 1 C5'-C4'-C3' 106.824 -5.251 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.571 0 O4'-C4'-C3' 108.004 2.404 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.501 1 O4'-C1'-N19 111.589 4.737 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.488 0 O4'-C4'-C3' 109.156 3.556 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.114 1 O4'-C1'-N19 111.154 4.192 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 120.348 0.118 . . . . 1.0 111.202 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.2 mmt-85 -68.84 56.51 0.09 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.741 2.016 . . . . 1.0 113.048 175.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 66.3 mttt -56.66 129.12 39.71 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 128.404 2.682 . . . . 1.0 110.538 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.6 t -72.57 132.36 33.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 113.488 -1.687 . . . . 1.0 110.763 173.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -106.39 122.22 45.83 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 106.649 -1.612 . . . . 1.0 106.649 167.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.08 144.9 28.75 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 103.706 -2.702 . . . . 1.0 103.706 167.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -128.28 141.03 51.56 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.745 -1.205 . . . . 1.0 107.745 174.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -131.77 140.57 49.25 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.688 1.195 . . . . 1.0 109.318 177.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -106.35 109.64 63.29 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 123.266 0.627 . . . . 1.0 112.283 -174.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -52.79 -27.33 33.91 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 124.129 3.22 . . . . 1.0 115.847 175.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -88.72 -19.12 26.51 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.558 1.143 . . . . 1.0 113.926 -173.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.0 p -129.84 -20.32 3.18 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 114.561 1.319 . . . . 1.0 114.561 -172.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.79 10.68 77.19 Favored Glycine 0 CA--C 1.537 1.456 0 CA-C-N 118.73 0.696 . . . . 1.0 114.145 -173.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -74.14 149.12 41.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.194 1.397 . . . . 1.0 109.426 170.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -133.13 154.23 39.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 C-N-CA 126.776 2.03 . . . . 1.0 109.0 173.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.15 168.65 10.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 127.456 2.303 . . . . 1.0 109.331 178.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -147.62 120.87 8.94 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 127.843 2.457 . . . . 1.0 109.27 173.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.27 155.21 42.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.086 0.954 . . . . 1.0 109.968 -178.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -96.04 10.57 37.06 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 120.88 -1.137 . . . . 1.0 112.023 176.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 124.77 -167.68 17.06 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 127.106 2.288 . . . . 1.0 112.969 -171.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.67 170.14 31.43 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 116.999 1.559 . . . . 1.0 116.999 170.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -57.03 103.15 0.1 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.452 2.301 . . . . 1.0 109.218 169.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -130.47 134.89 47.44 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.344 1.458 . . . . 1.0 110.243 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -52.44 -66.77 0.33 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 115.918 1.822 . . . . 1.0 115.918 -168.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 34.4 m -60.1 -40.93 91.36 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 119.41 1.004 . . . . 1.0 111.963 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.5 tp -57.55 -39.12 75.96 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.269 1.027 . . . . 1.0 111.765 176.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -68.6 -35.78 77.8 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.829 0.851 . . . . 1.0 112.502 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -67.0 -41.31 86.93 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.278 0.945 . . . . 1.0 110.838 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 34.6 m0 -61.71 -37.31 83.69 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.67 0.618 . . . . 1.0 112.67 175.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -65.16 -36.23 83.59 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.444 -0.785 . . . . 1.0 112.107 172.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.92 -48.27 69.17 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.724 0.774 . . . . 1.0 110.971 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -76.43 -34.12 58.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.384 1.474 . . . . 1.0 114.538 -169.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 13.4 m-90 -133.5 -47.84 0.82 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.053 1.131 . . . . 1.0 114.053 -175.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 140.08 153.47 6.05 Favored Glycine 0 N--CA 1.479 1.543 0 CA-C-N 119.226 0.921 . . . . 1.0 115.354 169.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.15 -33.08 82.88 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.281 2.654 . . . . 1.0 114.359 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -63.35 -46.54 86.11 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.716 0.807 . . . . 1.0 110.875 177.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.9 -53.31 59.87 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.331 1.452 . . . . 1.0 109.812 176.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 29.3 t -57.52 -47.7 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 C-N-CA 125.904 1.682 . . . . 1.0 111.981 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -66.15 -36.17 82.42 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.29 0.636 . . . . 1.0 112.563 173.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 64.4 m -66.63 -30.66 70.99 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.544 0.572 . . . . 1.0 112.544 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -75.89 -8.84 57.86 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.057 1.132 . . . . 1.0 114.057 173.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.52 168.98 16.41 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 124.218 1.961 . . . . 1.0 114.613 -173.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 89.8 m -142.98 139.63 30.71 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 129.851 3.26 . . . . 1.0 108.215 -176.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 36.3 tp -97.43 126.75 42.87 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.376 1.071 . . . . 1.0 109.972 -177.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 85.9 mt -125.63 121.33 33.22 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.92 1.688 . . . . 1.0 110.944 -177.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -87.79 -7.98 73.87 Favored Glycine 0 CA--C 1.536 1.367 0 CA-C-N 114.927 -1.033 . . . . 1.0 115.516 -174.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 126.066 1.746 . . . . 1.0 111.477 -178.608 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.881 0 O4'-C4'-C3' 109.235 3.635 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.948 0 O5'-C5'-C4' 114.376 2.983 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.262 0 O4'-C4'-C3' 109.374 3.774 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.586 0 O4'-C4'-C3' 108.33 2.73 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.514 0 O4'-C4'-C3' 108.895 3.295 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.623 3.042 0 O4'-C4'-C3' 109.255 3.655 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.697 0 O4'-C1'-N19 110.764 3.705 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.061 0 O5'-C5'-C4' 114.534 3.096 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.407 1 O4'-C4'-C3' 109.627 4.027 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.8 0 O4'-C4'-C3' 108.708 3.108 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.616 0 O4'-C4'-C3' 108.854 3.254 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.4 0 O4'-C1'-N19 110.042 2.803 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.954 0 O5'-C5'-C4' 114.329 2.949 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.036 0 O5'-C5'-C4' 114.887 3.348 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.445 0 O4'-C1'-N19 110.952 3.939 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.757 0 P-O3'-C3' 123.365 3.054 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.195 0 O4'-C4'-C3' 108.674 3.074 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.852 0 O5'-C5'-C4' 113.864 2.617 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.696 0 P-O3'-C3' 124.012 3.593 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.949 1 C5'-C4'-C3' 106.982 -5.145 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.551 0 O4'-C4'-C3' 107.974 2.374 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.28 1 O4'-C1'-N19 111.386 4.483 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.586 0 O4'-C4'-C3' 109.234 3.634 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.143 1 O4'-C1'-N19 111.249 4.311 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.121 0.01 . . . . 1.0 111.024 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -66.28 60.77 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.458 1.903 . . . . 1.0 113.737 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.0 mttt -55.32 137.2 48.22 Favored 'General case' 0 CA--C 1.523 -0.091 0 C-N-CA 128.854 2.862 . . . . 1.0 110.464 175.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 97.1 t -77.06 135.82 25.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 113.56 -1.654 . . . . 1.0 110.843 171.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.522 ' HG2' ' HB1' ' A' ' 120' ' ' ALA . 3.5 ttpt -116.32 121.8 43.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.627 -1.249 . . . . 1.0 107.627 167.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.01 147.07 35.0 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 105.239 -2.134 . . . . 1.0 105.239 168.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.459 ' CE1' ' HB2' ' A' ' 120' ' ' ALA . 68.3 m-85 -129.06 140.03 51.77 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.795 -1.187 . . . . 1.0 107.795 172.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -132.81 129.52 38.63 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.711 1.205 . . . . 1.0 109.659 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -95.03 110.91 52.62 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 123.074 0.55 . . . . 1.0 111.597 -172.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.97 -15.25 48.06 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.324 2.682 . . . . 1.0 114.36 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -89.24 -20.52 24.05 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.281 1.215 . . . . 1.0 114.281 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.1 p -130.03 -21.24 3.01 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 114.894 1.442 . . . . 1.0 114.894 -172.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.19 9.42 84.13 Favored Glycine 0 CA--C 1.54 1.596 0 CA-C-N 118.808 0.731 . . . . 1.0 114.373 -173.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -72.95 148.82 43.92 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.684 1.242 . . . . 1.0 109.524 170.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 t -133.03 153.4 37.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 C-N-CA 126.605 1.962 . . . . 1.0 109.501 173.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.08 168.7 10.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 127.458 2.303 . . . . 1.0 109.198 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -147.78 121.42 9.2 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 128.205 2.602 . . . . 1.0 108.996 173.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.32 155.66 42.79 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.773 0.829 . . . . 1.0 109.653 -178.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -96.79 6.13 49.27 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.225 1.01 . . . . 1.0 111.789 173.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 132.11 -165.05 23.66 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.855 2.169 . . . . 1.0 113.609 -175.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.84 170.74 26.43 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 123.461 1.589 . . . . 1.0 117.042 169.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -57.82 101.36 0.07 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.466 2.306 . . . . 1.0 109.014 169.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -130.4 126.36 36.86 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.719 1.608 . . . . 1.0 109.592 178.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -44.84 -67.17 0.31 Allowed 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 116.07 1.878 . . . . 1.0 116.07 -169.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.2 m -60.11 -40.98 91.56 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 119.212 0.914 . . . . 1.0 112.214 -175.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 41.1 tp -59.44 -39.04 82.29 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.23 1.012 . . . . 1.0 111.611 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -68.58 -32.62 72.66 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.753 0.821 . . . . 1.0 113.151 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -69.12 -42.68 75.74 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 119.593 1.088 . . . . 1.0 110.777 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -60.57 -36.91 79.64 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.668 0.618 . . . . 1.0 112.668 177.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.28 -36.53 84.39 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 121.475 -0.765 . . . . 1.0 112.526 172.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.35 -48.37 70.44 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.854 0.835 . . . . 1.0 111.087 176.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -76.31 -33.57 59.05 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.342 1.457 . . . . 1.0 114.58 -169.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.3 m-90 -133.47 -48.83 0.83 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.923 1.083 . . . . 1.0 113.923 -176.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 141.19 153.44 5.96 Favored Glycine 0 N--CA 1.477 1.421 0 CA-C-N 119.046 0.839 . . . . 1.0 115.041 169.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -62.6 -32.94 79.23 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.075 2.517 . . . . 1.0 114.378 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -61.94 -46.64 88.42 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.89 0.852 . . . . 1.0 111.15 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.61 -53.96 51.97 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.996 1.318 . . . . 1.0 109.836 176.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 34.4 t -57.74 -46.69 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 125.425 1.49 . . . . 1.0 112.077 -175.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -64.98 -37.66 88.39 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.354 0.662 . . . . 1.0 112.388 173.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 55.6 m -66.46 -30.14 70.42 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.163 0.585 . . . . 1.0 112.365 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -74.95 -10.02 59.08 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.979 1.103 . . . . 1.0 113.979 173.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.522 ' HB1' ' HG2' ' A' ' 83' ' ' LYS . . . -71.14 167.23 19.77 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 124.032 1.872 . . . . 1.0 114.501 -173.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 95.8 m -146.37 133.11 19.98 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 129.305 3.042 . . . . 1.0 108.466 -174.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.8 tt -100.37 124.83 46.35 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.685 0.794 . . . . 1.0 110.016 -171.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.8 mt -121.73 124.32 43.96 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.657 1.983 . . . . 1.0 111.056 -170.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -74.78 -19.21 80.01 Favored Glycine 0 CA--C 1.538 1.522 0 CA-C-N 115.289 -0.869 . . . . 1.0 115.137 -174.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.257 1.471 0 C-N-CA 125.822 1.649 . . . . 1.0 111.962 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.948 0 O4'-C4'-C3' 109.054 3.454 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.8 0 O5'-C5'-C4' 114.583 3.131 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.397 0 O4'-C4'-C3' 109.192 3.592 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.571 0 O4'-C4'-C3' 108.596 2.996 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.87 0 O4'-C4'-C3' 108.528 2.928 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.135 0 O5'-C5'-C4' 114.859 3.328 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.687 0 O4'-C1'-N19 110.837 3.796 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.832 0 O5'-C5'-C4' 114.665 3.189 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.728 1 O4'-C4'-C3' 109.772 4.172 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.704 0 O4'-C1'-N19 110.242 3.052 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.719 0 O4'-C4'-C3' 109.116 3.516 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.421 0 O4'-C1'-N19 110.229 3.036 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.993 0 O4'-C4'-C3' 108.632 3.032 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.177 0 O5'-C5'-C4' 114.816 3.297 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.197 0 O4'-C1'-N19 110.963 3.954 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.024 0 P-O3'-C3' 123.416 3.097 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.045 0 O4'-C1'-N19 110.24 3.05 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.815 0 O5'-C5'-C4' 113.832 2.594 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.563 -2.953 0 P-O3'-C3' 123.631 3.276 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.997 1 C5'-C4'-C3' 107.731 -4.646 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.502 0 O5'-C5'-C4' 114.387 2.991 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.484 1 O4'-C1'-N19 111.247 4.309 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.482 0 O4'-C4'-C3' 109.237 3.637 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.793 1 O4'-C1'-N19 111.364 4.455 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 111.137 0.051 . . . . 1.0 111.137 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 61.2 mmt-85 -65.41 61.58 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 126.658 1.983 . . . . 1.0 113.482 176.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -54.51 132.8 45.53 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 128.45 2.7 . . . . 1.0 111.04 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 74.5 t -70.88 135.22 28.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 113.088 -1.869 . . . . 1.0 111.264 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.3 mttp -107.44 120.62 42.67 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.304 -1.739 . . . . 1.0 106.304 167.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.85 144.66 29.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 104.108 -2.553 . . . . 1.0 104.108 168.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -127.24 140.17 52.41 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.994 -1.113 . . . . 1.0 107.994 173.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -132.08 130.95 41.91 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.7 1.2 . . . . 1.0 109.704 178.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -97.63 110.95 57.31 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 122.777 0.431 . . . . 1.0 111.31 -173.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -66.32 -14.63 45.05 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.45 2.767 . . . . 1.0 114.666 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -88.63 -17.63 29.67 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.726 1.21 . . . . 1.0 114.219 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 40.0 p -129.75 -23.56 2.82 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 114.534 1.309 . . . . 1.0 114.534 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.87 7.48 87.43 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.294 0.949 . . . . 1.0 114.234 -172.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.44 156.44 29.39 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.098 1.449 . . . . 1.0 110.976 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.7 t -136.37 154.11 32.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 126.681 1.992 . . . . 1.0 109.632 179.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.88 168.01 11.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 127.672 2.389 . . . . 1.0 109.525 177.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -147.03 120.76 9.21 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.585 2.354 . . . . 1.0 109.481 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.32 151.33 37.33 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.753 0.821 . . . . 1.0 109.685 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -95.17 10.13 37.07 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.1 -1.0 . . . . 1.0 111.826 176.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 129.33 -166.09 21.77 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 126.982 2.229 . . . . 1.0 113.093 -172.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.68 169.16 22.39 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 117.195 1.638 . . . . 1.0 117.195 170.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -57.66 100.99 0.06 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.717 2.407 . . . . 1.0 109.2 169.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.8 t60 -130.5 130.74 44.56 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.623 1.569 . . . . 1.0 109.939 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -49.52 -66.96 0.31 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.647 1.721 . . . . 1.0 115.647 -168.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.5 m -60.01 -40.94 90.96 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 119.323 0.965 . . . . 1.0 111.911 -175.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.9 tp -58.89 -38.39 78.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.014 0.926 . . . . 1.0 111.756 177.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -68.05 -36.33 79.7 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.574 0.75 . . . . 1.0 112.281 175.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.92 -42.14 85.87 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.102 0.865 . . . . 1.0 110.839 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.3 m0 -62.17 -38.03 87.52 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.587 0.588 . . . . 1.0 112.587 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.7 -33.87 76.87 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.535 -0.728 . . . . 1.0 112.181 172.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.48 -49.27 56.36 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.435 0.636 . . . . 1.0 111.451 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -74.24 -34.13 63.56 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.204 1.802 . . . . 1.0 114.67 -169.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 16.7 m-90 -133.05 -46.5 0.85 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.574 0.953 . . . . 1.0 113.574 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.42 153.84 6.32 Favored Glycine 0 N--CA 1.48 1.613 0 C-N-CA 123.849 0.738 . . . . 1.0 114.871 170.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.32 -33.59 89.02 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 122.98 2.453 . . . . 1.0 113.67 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -61.26 -45.88 92.65 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.987 0.899 . . . . 1.0 111.387 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.86 -55.16 37.58 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.218 -1.355 . . . . 1.0 109.923 175.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.6 t -57.3 -47.78 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 C-N-CA 125.59 1.556 . . . . 1.0 111.997 -175.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -67.28 -34.61 77.77 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.936 -0.477 . . . . 1.0 112.263 176.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.2 t -65.96 -33.99 77.09 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.73 -0.606 . . . . 1.0 112.234 177.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -71.5 -11.93 61.12 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.031 1.123 . . . . 1.0 114.031 174.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.82 168.71 16.18 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 124.117 1.913 . . . . 1.0 115.116 -170.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 79.5 m -142.26 141.83 32.51 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 130.107 3.363 . . . . 1.0 108.323 -177.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.3 tt -104.44 120.54 41.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.374 1.07 . . . . 1.0 110.206 -176.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 74.9 mt -124.37 154.05 40.95 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.3 2.24 . . . . 1.0 110.92 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -66.64 -179.91 11.57 Favored Glycine 0 CA--C 1.543 1.814 0 C-N-CA 125.632 1.586 . . . . 1.0 115.342 176.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.281 0 C-N-CA 126.154 1.782 . . . . 1.0 110.781 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.818 0 O4'-C4'-C3' 109.093 3.493 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.035 0 O5'-C5'-C4' 114.551 3.108 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.222 0 O4'-C4'-C3' 109.285 3.685 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.433 0 O4'-C4'-C3' 108.642 3.042 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.884 0 O4'-C4'-C3' 108.638 3.038 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.107 0 O5'-C5'-C4' 115.027 3.448 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.766 1 O4'-C1'-N19 111.376 4.47 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.202 0 O5'-C5'-C4' 114.36 2.971 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.869 1 O4'-C4'-C3' 109.874 4.274 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.61 0 O4'-C1'-N19 110.576 3.47 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.718 0 O4'-C4'-C3' 109.091 3.491 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.267 0 O4'-C1'-N19 110.177 2.972 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.887 0 O4'-C4'-C3' 108.544 2.944 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.093 0 O5'-C5'-C4' 114.935 3.382 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.41 0 O4'-C1'-N19 110.975 3.969 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.01 0 P-O3'-C3' 123.375 3.062 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.21 0 O4'-C1'-N19 110.421 3.276 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.041 0 O5'-C5'-C4' 113.765 2.546 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.811 0 P-O3'-C3' 123.982 3.569 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.481 1 C5'-C4'-C3' 107.018 -5.121 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.682 0 O4'-C4'-C3' 107.772 2.172 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.5 1 O4'-C1'-N19 111.617 4.772 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.584 0 O4'-C4'-C3' 109.271 3.671 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.205 1 O4'-C1'-N19 111.237 4.296 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.386 0.136 . . . . 1.0 111.264 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 31.4 mmt-85 -67.81 58.73 0.07 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 126.813 2.045 . . . . 1.0 113.077 175.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.8 mttt -55.54 131.26 45.73 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 128.769 2.828 . . . . 1.0 111.08 178.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 85.7 t -73.77 134.48 29.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 113.629 -1.623 . . . . 1.0 111.433 173.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.8 mttp -108.54 122.92 48.07 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 106.577 -1.638 . . . . 1.0 106.577 167.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.27 145.59 28.22 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 104.442 -2.429 . . . . 1.0 104.442 168.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -128.39 142.29 51.15 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.199 -1.037 . . . . 1.0 108.199 173.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -132.74 139.74 47.75 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.938 1.295 . . . . 1.0 109.485 177.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -106.82 109.75 63.28 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 123.234 0.614 . . . . 1.0 112.483 -173.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -53.36 -26.67 36.07 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.269 3.312 . . . . 1.0 115.957 176.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -88.99 -18.79 26.68 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.52 1.128 . . . . 1.0 113.996 -174.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.9 p -129.54 -19.76 3.36 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.49 1.292 . . . . 1.0 114.49 -172.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.61 11.44 72.74 Favored Glycine 0 CA--C 1.54 1.647 0 CA-C-N 118.741 0.7 . . . . 1.0 114.159 -173.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -75.32 149.61 38.69 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.39 1.476 . . . . 1.0 109.4 171.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.5 t -132.47 154.75 40.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 126.754 2.022 . . . . 1.0 109.035 172.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.89 167.69 12.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 127.318 2.247 . . . . 1.0 109.384 177.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -146.84 120.31 9.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 127.483 2.313 . . . . 1.0 108.888 173.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.22 153.58 41.49 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.75 0.82 . . . . 1.0 109.588 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.4 mttp -95.72 9.05 41.71 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.1 -1.0 . . . . 1.0 111.573 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.84 -166.68 20.4 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 127.238 2.352 . . . . 1.0 113.202 -171.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.92 169.16 27.1 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 117.272 1.669 . . . . 1.0 117.272 169.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -57.64 101.42 0.07 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 127.708 2.403 . . . . 1.0 108.944 169.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -130.66 130.2 43.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.478 1.511 . . . . 1.0 109.625 178.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -48.68 -65.52 0.55 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 115.971 1.841 . . . . 1.0 115.971 -169.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 44.3 m -62.22 -39.22 92.08 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 119.266 0.939 . . . . 1.0 111.925 -175.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.5 tp -59.67 -39.44 84.51 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.773 0.829 . . . . 1.0 111.72 176.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -67.41 -35.83 80.06 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.664 0.786 . . . . 1.0 112.485 175.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -67.2 -43.87 81.05 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.06 0.846 . . . . 1.0 110.271 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.8 m0 -60.22 -38.54 83.7 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.73 -0.668 . . . . 1.0 112.487 176.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -65.18 -34.54 78.62 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.512 -0.742 . . . . 1.0 112.53 172.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.86 -49.85 59.81 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.804 0.812 . . . . 1.0 111.191 176.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -75.58 -34.13 60.64 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.859 1.664 . . . . 1.0 114.822 -169.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.6 m-90 -132.75 -47.01 0.87 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 113.651 0.982 . . . . 1.0 113.651 -176.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.01 154.01 6.28 Favored Glycine 0 N--CA 1.479 1.507 0 CA-C-N 118.944 0.793 . . . . 1.0 114.967 169.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -61.76 -33.83 84.46 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.075 2.517 . . . . 1.0 113.928 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -60.9 -45.96 92.55 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 122.07 0.938 . . . . 1.0 111.376 177.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.69 -54.97 40.23 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.182 -1.372 . . . . 1.0 109.916 175.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.2 t -58.11 -47.82 86.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 125.694 1.598 . . . . 1.0 111.786 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.14 -35.29 79.41 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.127 0.571 . . . . 1.0 112.157 176.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 23.3 t -65.43 -34.01 77.29 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.079 0.552 . . . . 1.0 112.189 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 24.3 m0 -72.28 -10.06 59.29 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.963 1.097 . . . . 1.0 113.963 174.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.45 168.46 17.45 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 124.172 1.939 . . . . 1.0 115.045 -172.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 92.8 m -144.14 142.81 30.79 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 130.133 3.373 . . . . 1.0 107.812 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -107.92 123.55 48.78 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.893 0.877 . . . . 1.0 109.767 -176.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 83.7 mt -121.22 129.8 53.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.758 2.023 . . . . 1.0 110.69 -172.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -77.48 -15.38 81.48 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.582 0.993 . . . . 1.0 115.582 -173.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 . . . . . 0 C--O 1.252 1.233 0 C-N-CA 126.49 1.916 . . . . 1.0 111.072 179.786 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.098 0 O4'-C4'-C3' 109.184 3.584 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.025 0 O5'-C5'-C4' 114.49 3.064 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.565 0 O4'-C4'-C3' 109.377 3.777 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.708 0 O4'-C4'-C3' 108.495 2.895 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.227 0 O4'-C4'-C3' 108.699 3.099 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.072 0 O4'-C4'-C3' 108.994 3.394 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.651 0 O4'-C1'-N19 110.645 3.557 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.265 0 O5'-C5'-C4' 114.456 3.04 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.162 1 O4'-C4'-C3' 109.641 4.041 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.496 0 O4'-C1'-N19 110.486 3.357 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.925 0 O4'-C4'-C3' 108.913 3.313 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.402 0 O4'-C1'-N19 110.248 3.06 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.65 0 O4'-C4'-C3' 108.645 3.045 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.149 0 O5'-C5'-C4' 114.89 3.35 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.214 1 O4'-C1'-N19 111.122 4.153 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.916 0 P-O3'-C3' 123.203 2.919 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.293 0 O4'-C1'-N19 110.253 3.067 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.859 0 O5'-C5'-C4' 113.865 2.618 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.776 0 P-O3'-C3' 124.166 3.721 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.213 1 C5'-C4'-C3' 107.116 -5.056 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.693 0 O4'-C4'-C3' 107.783 2.183 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.56 1 O4'-C1'-N19 111.564 4.705 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.559 0 O4'-C4'-C3' 109.228 3.628 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.315 1 O4'-C1'-N19 111.282 4.352 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 111.13 0.048 . . . . 1.0 111.13 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.6 mmp_? -65.59 57.37 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 127.268 2.227 . . . . 1.0 114.191 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -56.59 127.97 33.94 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 128.795 2.838 . . . . 1.0 110.221 175.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 88.6 t -70.65 133.86 31.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 113.62 -1.627 . . . . 1.0 110.646 174.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -108.09 121.87 45.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.529 -1.656 . . . . 1.0 106.529 168.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.63 144.46 28.58 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 103.694 -2.706 . . . . 1.0 103.694 167.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -127.66 140.36 52.13 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 107.691 -1.226 . . . . 1.0 107.691 174.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -131.83 139.25 48.79 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.848 1.259 . . . . 1.0 109.462 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -105.63 110.38 64.17 Favored Pre-proline 0 CA--C 1.544 0.713 0 N-CA-C 112.413 0.523 . . . . 1.0 112.413 -173.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo -52.73 -27.5 34.14 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 124.338 3.359 . . . . 1.0 115.87 176.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -87.97 -17.24 31.71 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.833 1.253 . . . . 1.0 114.273 -174.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.4 p -129.9 -22.1 2.95 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.114 1.153 . . . . 1.0 114.114 -174.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.01 7.52 81.75 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 124.09 0.852 . . . . 1.0 114.443 -172.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -77.45 156.49 31.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.011 1.406 . . . . 1.0 110.681 173.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.0 t -136.11 155.29 34.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 C-N-CA 126.986 2.115 . . . . 1.0 109.536 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.47 168.42 10.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 127.85 2.46 . . . . 1.0 109.404 177.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -147.48 121.84 9.65 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.757 2.423 . . . . 1.0 109.023 173.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.64 156.68 43.38 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.931 0.892 . . . . 1.0 109.972 -178.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -96.37 9.51 41.01 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.893 -1.129 . . . . 1.0 112.101 175.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 125.24 -167.56 17.57 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 127.186 2.327 . . . . 1.0 112.969 -171.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.1 170.07 32.68 Favored Glycine 0 CA--C 1.537 1.467 0 N-CA-C 117.082 1.593 . . . . 1.0 117.082 169.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -57.33 101.38 0.07 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.703 2.401 . . . . 1.0 108.945 169.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -130.68 133.95 46.52 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.121 1.369 . . . . 1.0 110.638 178.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -45.33 -70.55 0.1 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 125.895 1.678 . . . . 1.0 115.408 -169.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 32.4 m -61.04 -41.21 96.15 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.571 0.748 . . . . 1.0 111.949 -175.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 40.0 tp -58.44 -39.54 80.12 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.099 0.96 . . . . 1.0 111.69 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -69.72 -32.52 71.13 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.778 0.831 . . . . 1.0 112.965 175.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -68.44 -43.17 77.68 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.798 1.181 . . . . 1.0 111.221 175.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -61.56 -35.43 77.75 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.678 0.622 . . . . 1.0 112.678 178.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.76 -36.53 83.83 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 121.515 -0.741 . . . . 1.0 112.514 171.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.7 -48.45 69.24 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.826 0.822 . . . . 1.0 110.818 176.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.94 -32.84 59.74 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.657 1.583 . . . . 1.0 114.448 -169.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -134.87 -50.17 0.76 Allowed 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.008 1.114 . . . . 1.0 114.008 -176.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.2 153.87 6.02 Favored Glycine 0 N--CA 1.477 1.385 0 CA-C-N 119.315 0.962 . . . . 1.0 115.458 169.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.47 -33.24 79.65 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.264 2.643 . . . . 1.0 114.262 -178.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -63.76 -46.71 84.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.927 0.87 . . . . 1.0 110.887 177.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.08 -53.45 58.06 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.223 1.409 . . . . 1.0 110.197 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 25.7 t -57.43 -48.07 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 125.769 1.628 . . . . 1.0 111.804 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.7 -35.79 80.97 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.574 0.583 . . . . 1.0 112.574 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 21.9 t -65.73 -33.44 75.88 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.228 0.611 . . . . 1.0 112.067 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -72.75 -10.97 60.41 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.012 1.116 . . . . 1.0 114.012 174.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.88 169.25 15.12 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 124.321 2.01 . . . . 1.0 114.86 -172.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.0 m -143.67 142.26 30.92 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 130.148 3.379 . . . . 1.0 107.711 -176.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.1 tt -106.98 123.04 47.61 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.067 0.947 . . . . 1.0 109.586 -175.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.4 mt -120.85 126.44 50.07 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.424 1.89 . . . . 1.0 110.888 -172.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -84.37 -15.64 68.47 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 115.337 0.895 . . . . 1.0 115.337 -173.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 125.864 1.665 . . . . 1.0 111.061 -179.903 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.703 0 O4'-C4'-C3' 109.055 3.455 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.973 0 O5'-C5'-C4' 114.477 3.055 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.387 0 O4'-C4'-C3' 109.096 3.496 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.4 0 O4'-C4'-C3' 108.533 2.933 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.209 0 O4'-C4'-C3' 108.606 3.006 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.469 0 O4'-C4'-C3' 108.84 3.24 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.786 0 P-O3'-C3' 124.094 3.662 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.333 0 O5'-C5'-C4' 114.357 2.969 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.003 0 O4'-C4'-C3' 109.444 3.844 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.585 0 O4'-C4'-C3' 108.898 3.298 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.649 0 O4'-C4'-C3' 109.129 3.529 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.35 0 O4'-C1'-N19 110.137 2.921 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.839 0 O4'-C4'-C3' 108.571 2.971 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.035 0 O5'-C5'-C4' 115.104 3.503 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.276 0 O4'-C1'-N19 110.788 3.735 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.065 0 P-O3'-C3' 123.173 2.895 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.329 0 O4'-C4'-C3' 108.43 2.83 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.993 0 O5'-C5'-C4' 114.0 2.714 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.562 -3.127 0 P-O3'-C3' 123.395 3.079 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.127 2 C5'-C4'-C3' 106.801 -5.266 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.049 0 O4'-C4'-C3' 108.085 2.485 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.462 1 O4'-C1'-N19 111.394 4.492 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.515 0 O4'-C4'-C3' 109.334 3.734 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.009 1 O4'-C1'-N19 111.507 4.634 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 111.326 0.121 . . . . 1.0 111.326 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 51.9 mmt-85 -65.41 66.77 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 126.277 1.831 . . . . 1.0 112.637 175.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 44.8 mttt -62.94 137.33 58.24 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 128.934 2.894 . . . . 1.0 110.575 178.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 87.8 t -76.37 136.14 25.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 C-N-CA 125.723 1.609 . . . . 1.0 111.309 172.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -109.63 122.56 47.74 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 106.179 -1.786 . . . . 1.0 106.179 167.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.21 145.27 28.43 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 104.269 -2.493 . . . . 1.0 104.269 168.265 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -127.36 141.76 51.61 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.028 -1.101 . . . . 1.0 108.028 172.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -133.28 137.43 46.02 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.884 1.274 . . . . 1.0 109.041 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -107.45 110.89 63.13 Favored Pre-proline 0 CA--C 1.548 0.888 0 N-CA-C 112.417 0.525 . . . . 1.0 112.417 -172.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -53.19 -27.22 36.74 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 124.636 3.557 . . . . 1.0 115.593 175.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -89.05 -15.08 34.9 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.119 1.368 . . . . 1.0 114.575 -174.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.6 p -128.93 -21.83 3.28 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.351 1.061 . . . . 1.0 113.831 -176.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.77 9.75 79.39 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.577 1.084 . . . . 1.0 114.023 -172.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -83.47 158.89 21.87 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.03 1.415 . . . . 1.0 110.853 175.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -136.74 155.51 33.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 C-N-CA 126.96 2.104 . . . . 1.0 109.577 178.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.99 168.53 9.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 127.468 2.307 . . . . 1.0 109.29 178.206 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -147.22 121.66 9.69 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.685 2.394 . . . . 1.0 109.287 173.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.25 153.61 40.78 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.851 0.861 . . . . 1.0 109.727 -179.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 33.7 mttp -97.06 10.75 38.44 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.875 -1.141 . . . . 1.0 111.5 174.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.98 -165.53 21.73 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 127.253 2.358 . . . . 1.0 113.133 -173.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.12 168.9 23.81 Favored Glycine 0 CA--C 1.537 1.433 0 CA-C-O 123.5 1.611 . . . . 1.0 117.054 170.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -57.72 101.9 0.08 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 127.498 2.319 . . . . 1.0 109.093 169.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -130.51 123.7 30.24 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.497 1.519 . . . . 1.0 109.711 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -43.94 -65.37 0.51 Allowed 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 115.486 1.662 . . . . 1.0 115.486 -169.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.7 m -58.69 -41.59 86.59 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 119.379 0.99 . . . . 1.0 112.454 -176.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.2 tp -60.97 -37.9 84.06 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.058 0.943 . . . . 1.0 111.457 177.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -69.5 -32.79 71.87 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.533 0.733 . . . . 1.0 112.773 174.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.03 -42.1 76.82 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.823 1.192 . . . . 1.0 110.973 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -62.39 -37.65 86.57 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.554 0.576 . . . . 1.0 112.554 177.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -65.67 -32.06 73.42 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.668 -0.645 . . . . 1.0 112.332 172.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.36 -51.4 24.35 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.434 0.635 . . . . 1.0 110.968 176.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HE3' ' CH2' ' A' ' 111' ' ' TRP . 47.1 mtmt -74.68 -29.06 61.09 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 115.309 1.596 . . . . 1.0 115.309 -169.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.432 ' CH2' ' HE3' ' A' ' 110' ' ' LYS . 16.5 m-90 -134.76 -47.51 0.74 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.176 1.176 . . . . 1.0 114.176 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 139.1 154.18 6.31 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 119.09 0.859 . . . . 1.0 114.942 170.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -61.03 -33.95 91.18 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.268 2.645 . . . . 1.0 113.759 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -61.41 -45.82 92.73 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.877 0.846 . . . . 1.0 111.238 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.74 -55.11 38.36 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 114.326 -1.306 . . . . 1.0 110.073 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 32.9 t -57.42 -48.24 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 125.819 1.648 . . . . 1.0 111.923 -174.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -66.94 -34.7 78.35 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.085 0.554 . . . . 1.0 112.147 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.6 m -67.58 -30.45 70.06 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 112.641 0.608 . . . . 1.0 112.641 178.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 17.9 m0 -74.55 -10.97 60.07 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 114.212 1.19 . . . . 1.0 114.212 173.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.7 168.46 16.51 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 124.091 1.901 . . . . 1.0 114.823 -170.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 99.6 m -142.95 143.19 31.87 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 130.133 3.373 . . . . 1.0 107.909 -176.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.0 tt -106.69 122.91 47.31 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.082 0.953 . . . . 1.0 109.818 -176.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt -122.86 137.43 54.94 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.651 1.98 . . . . 1.0 110.52 -174.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -63.64 159.18 39.0 Favored Glycine 0 CA--C 1.54 1.63 0 CA-C-N 115.016 -0.993 . . . . 1.0 114.596 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.326 1.851 . . . . 1.0 110.674 178.235 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.035 0 O4'-C4'-C3' 109.044 3.444 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.236 0 O5'-C5'-C4' 114.513 3.081 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.289 0 O4'-C4'-C3' 109.41 3.81 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.446 0 O4'-C4'-C3' 108.474 2.874 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.077 0 O4'-C4'-C3' 108.856 3.256 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.046 0 O5'-C5'-C4' 114.849 3.321 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.601 1 O4'-C1'-N19 111.031 4.038 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.074 0 O5'-C5'-C4' 114.406 3.004 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.949 0 O4'-C4'-C3' 109.532 3.932 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.28 0 O4'-C1'-N19 110.524 3.405 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.573 0 O4'-C4'-C3' 108.889 3.289 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.117 0 O4'-C1'-N19 110.048 2.81 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.875 0 O4'-C4'-C3' 108.605 3.005 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.073 0 O5'-C5'-C4' 114.901 3.358 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.339 0 O4'-C1'-N19 110.777 3.721 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.685 0 P-O3'-C3' 123.185 2.904 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.252 0 O4'-C1'-N19 110.226 3.033 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.92 0 O5'-C5'-C4' 114.214 2.867 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.564 -2.873 0 P-O3'-C3' 123.755 3.379 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.384 1 C5'-C4'-C3' 107.162 -5.026 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.585 0 O4'-C4'-C3' 107.988 2.388 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.255 1 O4'-C1'-N19 111.879 5.099 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.845 0 O4'-C4'-C3' 109.087 3.487 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.131 1 O4'-C1'-N19 111.148 4.185 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 111.275 0.102 . . . . 1.0 111.275 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 36.7 mmt-85 -66.74 59.57 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 126.627 1.971 . . . . 1.0 113.053 174.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.7 mttt -54.05 133.01 43.67 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 128.744 2.817 . . . . 1.0 111.152 178.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.1 t -75.6 135.05 27.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 113.45 -1.704 . . . . 1.0 111.607 172.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.0 mttp -110.18 123.55 49.97 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 106.928 -1.508 . . . . 1.0 106.928 167.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -83.94 145.4 28.58 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 104.414 -2.439 . . . . 1.0 104.414 168.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -128.48 142.65 51.02 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.04 -1.096 . . . . 1.0 108.04 173.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -132.71 140.85 48.29 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.711 1.204 . . . . 1.0 109.467 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -107.81 109.57 62.26 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 123.077 0.551 . . . . 1.0 112.271 -173.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -53.28 -26.89 36.2 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 124.57 3.513 . . . . 1.0 115.785 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -88.68 -18.82 27.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.506 1.122 . . . . 1.0 113.928 -174.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 47.0 p -129.64 -19.85 3.31 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 114.543 1.312 . . . . 1.0 114.543 -172.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 71.88 11.53 73.99 Favored Glycine 0 CA--C 1.538 1.473 0 C-N-CA 123.879 0.752 . . . . 1.0 114.276 -173.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -75.72 149.82 37.98 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.176 1.39 . . . . 1.0 109.454 171.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -132.94 154.73 40.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 126.802 2.041 . . . . 1.0 108.962 172.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -143.84 168.15 11.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 127.45 2.3 . . . . 1.0 109.448 178.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -147.0 121.1 9.44 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 127.844 2.458 . . . . 1.0 109.097 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -145.71 152.58 39.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.73 0.812 . . . . 1.0 109.826 -178.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -93.06 7.57 43.61 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 120.921 -1.112 . . . . 1.0 111.988 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 128.77 -166.44 21.26 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 126.989 2.233 . . . . 1.0 113.133 -171.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.66 169.66 27.16 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-O 123.366 1.537 . . . . 1.0 116.807 169.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -57.26 103.0 0.1 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.533 2.333 . . . . 1.0 108.92 169.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -130.64 131.87 45.14 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.275 1.43 . . . . 1.0 110.161 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -48.96 -67.46 0.26 Allowed 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 115.909 1.818 . . . . 1.0 115.909 -168.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 34.1 m -59.95 -41.02 90.97 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 119.008 0.822 . . . . 1.0 111.893 -176.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.1 tp -58.53 -38.94 78.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.085 0.954 . . . . 1.0 111.571 177.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -68.54 -35.81 77.95 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.686 0.794 . . . . 1.0 112.352 175.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -66.79 -42.11 86.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.368 0.986 . . . . 1.0 110.744 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -61.47 -38.79 88.53 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.5 0.555 . . . . 1.0 112.5 176.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -65.06 -34.48 78.52 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.424 -0.797 . . . . 1.0 112.081 173.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.65 -48.74 63.25 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.737 0.779 . . . . 1.0 111.388 176.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -75.62 -33.89 60.53 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.773 1.629 . . . . 1.0 114.822 -169.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 14.4 m-90 -133.23 -45.89 0.84 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.814 1.042 . . . . 1.0 113.814 -176.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 138.64 154.23 6.39 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-N 119.073 0.851 . . . . 1.0 115.223 169.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.62 -34.47 84.41 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.063 2.509 . . . . 1.0 113.795 178.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -60.57 -45.87 92.34 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 122.072 0.939 . . . . 1.0 111.357 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.85 -54.84 41.52 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.017 -1.447 . . . . 1.0 110.067 175.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 37.9 t -57.91 -47.67 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 125.528 1.531 . . . . 1.0 112.201 -175.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -67.04 -35.21 79.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.95 0.5 . . . . 1.0 112.232 175.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.6 t -65.38 -33.99 77.26 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.688 -0.633 . . . . 1.0 112.331 177.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 22.6 m0 -72.63 -9.6 58.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.994 1.109 . . . . 1.0 113.994 174.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.51 168.29 16.56 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 124.041 1.877 . . . . 1.0 114.893 -173.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 89.7 m -143.89 138.92 28.91 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 129.79 3.236 . . . . 1.0 108.157 -176.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 30.8 tp -98.63 127.64 44.64 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.335 1.054 . . . . 1.0 109.718 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.5 mt -125.58 122.13 35.59 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.999 1.72 . . . . 1.0 110.878 -176.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -72.49 -20.13 79.3 Favored Glycine 0 CA--C 1.537 1.444 0 CA-C-N 115.259 -0.882 . . . . 1.0 115.113 -175.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.178 0 C-N-CA 126.031 1.733 . . . . 1.0 112.145 178.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.844 0 O4'-C4'-C3' 109.22 3.62 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.823 0 O4'-C1'-N19 110.213 3.017 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.039 0 O4'-C4'-C3' 109.267 3.667 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.369 0 O4'-C4'-C3' 108.385 2.785 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.325 0 O4'-C4'-C3' 108.602 3.002 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.045 0 O4'-C4'-C3' 108.963 3.363 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.663 0 O4'-C1'-N19 110.991 3.989 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.998 0 O5'-C5'-C4' 114.494 3.067 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.054 1 O4'-C4'-C3' 109.768 4.168 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.519 0 P-O3'-C3' 123.391 3.076 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.667 0 O4'-C4'-C3' 109.19 3.59 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.957 0 O4'-C1'-N19 110.164 2.956 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.659 0 O4'-C4'-C3' 108.488 2.888 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.032 0 O5'-C5'-C4' 115.091 3.493 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.464 0 O4'-C1'-N19 110.943 3.929 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.695 0 P-O3'-C3' 123.324 3.02 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.433 0 O4'-C4'-C3' 108.569 2.969 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.048 0 O5'-C5'-C4' 113.826 2.59 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.568 -2.515 0 P-O3'-C3' 124.029 3.608 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.066 1 C5'-C4'-C3' 107.297 -4.936 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.759 0 O4'-C4'-C3' 107.799 2.199 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.437 1 O4'-C1'-N19 111.4 4.501 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.402 0 O4'-C4'-C3' 109.07 3.47 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.054 1 O4'-C1'-N19 111.166 4.207 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 111.689 0.255 . . . . 1.0 111.689 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.1 mmp_? -69.31 58.32 0.11 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.731 2.013 . . . . 1.0 113.518 174.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -53.42 128.19 27.74 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 128.22 2.608 . . . . 1.0 110.179 174.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.8 t -72.3 134.39 29.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 113.633 -1.621 . . . . 1.0 110.521 171.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -108.33 121.57 45.17 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.516 -1.661 . . . . 1.0 106.516 167.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.81 143.82 28.85 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 103.896 -2.631 . . . . 1.0 103.896 167.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -127.66 139.96 52.39 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.761 -1.199 . . . . 1.0 107.761 175.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -131.48 140.0 49.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.546 1.139 . . . . 1.0 108.986 177.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -105.57 109.89 63.68 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 112.542 0.571 . . . . 1.0 112.542 -174.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -52.96 -26.77 32.9 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.18 3.253 . . . . 1.0 115.878 176.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -87.65 -17.44 31.82 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.883 1.273 . . . . 1.0 114.232 -174.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.3 p -129.79 -22.59 2.92 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 114.028 1.122 . . . . 1.0 114.028 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.42 8.78 80.94 Favored Glycine 0 CA--C 1.539 1.554 0 C-N-CA 124.048 0.832 . . . . 1.0 114.352 -172.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -78.32 156.0 29.83 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 119.061 1.43 . . . . 1.0 110.506 172.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -135.83 155.52 36.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 C-N-CA 126.917 2.087 . . . . 1.0 109.563 178.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.69 168.1 10.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 127.689 2.396 . . . . 1.0 109.261 177.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -146.92 122.01 10.11 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 127.772 2.429 . . . . 1.0 109.288 172.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.08 156.4 42.98 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.919 0.888 . . . . 1.0 109.861 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.0 mttp -97.13 10.34 39.64 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.038 -1.039 . . . . 1.0 111.986 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 124.98 -166.65 17.6 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 127.253 2.359 . . . . 1.0 112.858 -171.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.5 169.52 29.72 Favored Glycine 0 CA--C 1.537 1.408 0 N-CA-C 117.405 1.722 . . . . 1.0 117.405 169.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -57.74 100.37 0.05 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 127.607 2.363 . . . . 1.0 109.265 169.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -130.43 130.96 44.96 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.446 1.498 . . . . 1.0 109.75 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -47.17 -67.09 0.31 Allowed 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 115.501 1.667 . . . . 1.0 115.501 -168.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 30.7 m -60.15 -41.02 91.87 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 119.29 0.95 . . . . 1.0 112.083 -174.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 46.4 tp -59.28 -39.52 83.19 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.243 1.017 . . . . 1.0 111.522 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -68.84 -32.44 72.12 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 113.193 0.812 . . . . 1.0 113.193 175.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.33 -42.99 74.6 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 119.422 1.01 . . . . 1.0 110.858 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -61.53 -35.66 78.36 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.761 0.652 . . . . 1.0 112.761 177.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -65.13 -36.91 85.76 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 121.39 -0.819 . . . . 1.0 112.696 171.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.92 -48.26 69.18 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.703 0.763 . . . . 1.0 110.863 176.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -76.07 -32.89 59.48 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.568 1.547 . . . . 1.0 114.415 -169.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 15.5 m-90 -135.0 -49.76 0.75 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.019 1.118 . . . . 1.0 114.019 -176.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.44 153.62 5.95 Favored Glycine 0 N--CA 1.48 1.577 0 CA-C-N 119.416 1.007 . . . . 1.0 115.353 169.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -62.1 -33.24 82.91 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.26 2.64 . . . . 1.0 114.328 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -63.11 -46.76 85.82 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 122.009 0.909 . . . . 1.0 110.966 177.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.64 -53.56 57.02 Favored 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 125.065 1.346 . . . . 1.0 110.032 176.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 27.7 t -57.15 -48.24 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.991 1.717 . . . . 1.0 111.81 -176.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -66.24 -36.01 81.9 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.076 0.551 . . . . 1.0 112.442 174.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.7 m -67.12 -30.58 70.62 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.644 0.609 . . . . 1.0 112.644 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 23.0 m0 -75.05 -10.04 59.1 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.805 1.039 . . . . 1.0 113.805 173.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.98 168.77 16.29 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 124.375 2.036 . . . . 1.0 114.689 -172.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 90.5 m -141.99 141.07 32.86 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 130.156 3.382 . . . . 1.0 107.736 -177.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.3 tt -104.98 121.72 44.33 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.928 0.891 . . . . 1.0 109.787 -175.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.1 mt -120.01 123.66 44.01 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.395 1.878 . . . . 1.0 110.917 -174.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -74.47 -19.38 79.87 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-N 115.223 -0.899 . . . . 1.0 115.201 -174.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.225 0 C-N-CA 126.056 1.742 . . . . 1.0 112.166 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.795 0 O4'-C4'-C3' 109.004 3.404 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.086 0 O5'-C5'-C4' 114.558 3.113 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.403 0 O4'-C4'-C3' 109.147 3.547 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.444 0 O4'-C4'-C3' 108.485 2.885 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.222 0 O4'-C4'-C3' 108.708 3.108 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.624 3.118 0 O4'-C4'-C3' 108.866 3.266 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.62 2.684 0 P-O3'-C3' 124.052 3.627 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.985 0 O5'-C5'-C4' 114.51 3.079 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.381 1 O4'-C4'-C3' 109.741 4.141 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.678 0 O4'-C4'-C3' 108.789 3.189 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.504 0 O4'-C4'-C3' 109.063 3.463 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.032 0 O4'-C1'-N19 110.012 2.764 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.79 0 O5'-C5'-C4' 114.452 3.037 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.133 0 O5'-C5'-C4' 115.043 3.459 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.438 0 O4'-C1'-N19 110.989 3.987 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.819 0 P-O3'-C3' 123.208 2.923 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.358 0 O4'-C1'-N19 110.29 3.112 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.714 0 O5'-C5'-C4' 113.966 2.69 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.564 -2.914 0 P-O3'-C3' 123.533 3.194 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.231 2 C5'-C4'-C3' 106.736 -5.309 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.172 0 O4'-C4'-C3' 108.193 2.593 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.311 1 O4'-C1'-N19 111.374 4.468 . . . . 1.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.59 0 O4'-C4'-C3' 109.152 3.552 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 24' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.139 1 O4'-C1'-N19 111.286 4.357 . . . . 1.0 . . . . . . . . . . 1 1 . 1 stop_ save_