data_5l85_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 5l85 _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 ' 86' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 . . . . . 0 N--CA 1.451 -0.417 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.453 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 38.3 t -89.01 143.59 10.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.069 -173.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.0 m -75.84 142.98 42.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.929 176.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.9 mt -55.24 -31.56 61.6 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.208 -0.906 . . . . 0.0 113.138 -173.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -53.31 -51.05 63.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.946 0.403 . . . . 0.0 110.816 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.502 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 6.2 m-20 -63.81 -35.83 81.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.717 -178.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 84.7 mt -72.66 -39.37 67.18 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.448 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.514 ' HA ' ' CZ ' ' B' ' 476' ' ' TYR . 97.3 mttt -66.94 -26.34 66.79 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.929 0.395 . . . . 0.0 110.985 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -69.99 -17.69 63.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.994 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.454 HD22 HG12 ' A' ' 147' ' ' VAL . 73.4 mt -65.14 -46.88 79.12 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.917 0.389 . . . . 0.0 110.409 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.39 -20.12 71.26 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.578 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -84.59 -23.87 29.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.849 0.357 . . . . 0.0 110.434 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.614 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 43.7 t -70.91 115.42 10.03 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.095 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.11 -30.05 67.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.173 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.9 m -72.99 -45.18 59.38 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.984 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.2 tt -74.3 -44.4 52.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.899 -172.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.614 ' HG2' ' O ' ' A' ' 98' ' ' SER . 2.8 ptp180 -56.99 -32.27 65.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.95 178.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.421 ' HA ' HD21 ' A' ' 106' ' ' LEU . 71.3 m -68.89 -18.06 64.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.864 0.364 . . . . 0.0 111.275 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 139' ' ' PHE . 17.2 mt -78.08 -33.7 50.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.105 0.479 . . . . 0.0 109.718 178.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -63.2 -18.05 63.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.193 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.421 HD21 ' HA ' ' A' ' 103' ' ' SER . 4.4 mm? -68.94 -10.79 59.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.358 178.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -86.13 118.86 71.15 Favored Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -62.08 -26.64 78.37 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.98 2.453 . . . . 0.0 112.615 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -76.29 -46.65 26.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.913 0.387 . . . . 0.0 110.165 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.9 tt -62.04 -42.81 99.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.267 -176.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 8.9 ptp180 -67.21 -31.04 71.15 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.828 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.517 HE21 ' HA ' ' A' ' 112' ' ' GLN . 0.0 OUTLIER -70.37 -38.61 74.8 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.659 -0.246 . . . . 0.0 110.366 176.169 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.434 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 81.3 mt -57.36 -50.92 71.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.159 0.504 . . . . 0.0 109.929 174.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.401 ' HG2' HG23 ' B' ' 474' ' ' VAL . 62.2 mtp -52.01 -57.0 10.81 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.72 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.712 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 27.4 m -64.04 -36.28 76.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.729 -176.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -64.6 -47.69 77.68 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.018 0.437 . . . . 0.0 110.927 178.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 62.3 tp -60.93 -40.35 92.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.058 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -66.4 -41.07 89.87 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.685 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.712 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 71.8 mt-30 -64.1 -28.31 69.69 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.595 0.712 . . . . 0.0 110.27 -178.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 75.69 31.45 56.21 Favored Glycine 0 N--CA 1.444 -0.815 0 CA-C-N 114.687 -1.142 . . . . 0.0 113.703 168.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -51.43 -42.25 61.39 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.059 0.457 . . . . 0.0 109.958 178.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.476 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 10.1 t70 -162.72 72.81 0.34 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 170.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.624 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.6 OUTLIER -53.76 -26.53 23.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.99 178.903 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.31 -54.69 43.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.411 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -25.95 27.25 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.291 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.505 HD23 ' HH ' ' A' ' 130' ' ' TYR . 95.4 mt -62.48 -43.36 99.01 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.438 178.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' MET . . . . . 0.566 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.4 OUTLIER -57.2 -28.49 62.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.921 0.391 . . . . 0.0 111.432 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -84.42 -49.16 8.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.922 0.391 . . . . 0.0 110.509 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -67.96 -16.35 64.02 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.302 -176.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.505 ' HH ' HD23 ' A' ' 126' ' ' LEU . 3.0 m-30 -88.78 -23.26 22.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.734 0.302 . . . . 0.0 111.722 -179.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -84.09 -0.18 50.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.085 0.469 . . . . 0.0 111.03 -176.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.463 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.5 pt20 -101.81 -16.22 16.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.963 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.419 ' O ' HG21 ' A' ' 137' ' ' VAL . 2.4 mt-10 -93.65 118.77 67.51 Favored Pre-proline 0 N--CA 1.449 -0.505 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.701 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 12.1 Cg_endo -55.54 -25.87 51.72 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.072 2.515 . . . . 0.0 112.658 -173.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.6 mt -66.64 -45.23 79.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.964 0.411 . . . . 0.0 110.658 -178.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.409 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 37.0 t80 -76.88 -29.06 55.63 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 -177.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.419 HG21 ' O ' ' A' ' 133' ' ' GLU . 75.2 t -62.9 -42.56 96.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.292 176.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.701 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 33.8 mm-40 -60.64 -46.66 89.47 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.895 0.379 . . . . 0.0 110.016 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . 0.509 ' HA ' ' CD1' ' A' ' 104' ' ' LEU . 77.1 t80 -59.57 -47.39 85.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.771 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.766 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.74 -47.22 84.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.185 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -67.94 -27.37 66.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.12 0.486 . . . . 0.0 110.395 -176.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 69.7 m -75.71 -44.17 43.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.407 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 27.6 p -69.74 -30.61 68.25 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.816 -176.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.766 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 86.1 mt -59.27 -48.12 82.82 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.966 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.42 -21.65 66.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.634 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 54.6 mt -91.02 -32.66 5.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.568 0.223 . . . . 0.0 111.361 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.502 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 14.9 m -102.53 -16.88 7.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -174.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 . . . . . 0 C--N 1.324 -0.524 0 CA-C-O 120.737 0.303 . . . . 0.0 111.571 -178.569 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 41.0 mm . . . . . 0 C--O 1.233 0.188 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -60.72 -41.36 95.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.572 0.701 . . . . 0.0 109.448 177.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -75.71 -49.38 18.46 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.805 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.548 ' O ' HG12 ' B' ' 470' ' ' ILE . 45.6 mt-10 -57.66 -47.93 80.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.171 -173.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . 0.566 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 78.3 mtm180 -60.37 -35.49 75.83 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -177.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.98 -31.22 58.88 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.99 -35.37 73.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.323 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.548 HG12 ' O ' ' B' ' 466' ' ' GLU . 24.6 mm -61.84 -35.92 70.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.101 177.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 86.8 mt -60.46 -38.02 82.85 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.829 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . 0.453 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 1.8 mp0 -68.15 -41.11 82.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.877 0.37 . . . . 0.0 110.579 177.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.1 m -63.96 -56.11 17.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.806 -178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . 0.445 ' O ' HG13 ' B' ' 478' ' ' ILE . 82.7 t -52.3 -51.06 34.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.971 178.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -66.37 -33.33 75.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.492 -172.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . 0.514 ' CZ ' ' HA ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -63.72 -46.89 83.37 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.097 0.475 . . . . 0.0 109.948 176.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 75.6 mt -64.12 -51.02 74.17 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.511 -176.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . 0.445 HG13 ' O ' ' B' ' 474' ' ' VAL . 40.5 mt -58.21 -23.68 22.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.96 0.41 . . . . 0.0 110.918 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -74.73 -35.31 62.66 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.254 -175.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.602 0 C-N-CA 119.916 -0.714 . . . . 0.0 112.406 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.971 0.415 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.99 130.53 34.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.059 -176.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.5 m -67.89 156.8 36.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.049 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.61 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -59.48 -42.07 91.24 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 -176.671 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -52.94 -38.29 61.84 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.99 0.424 . . . . 0.0 111.249 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -80.46 -17.76 50.72 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.176 -177.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 84.2 mt -86.8 -35.35 19.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.316 176.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.61 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 53.2 mtpt -54.47 -37.1 64.84 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -175.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.415 HD21 HG22 ' A' ' 146' ' ' ILE . 0.0 OUTLIER -71.84 -17.07 62.17 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -175.721 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 9.6 mp -60.3 -48.7 80.63 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -175.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -66.81 -21.46 71.26 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.263 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -85.09 -23.25 28.59 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.97 0.414 . . . . 0.0 110.609 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.642 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 42.6 t -65.68 118.21 9.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.259 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.62 -27.24 68.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.265 -177.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 80.2 m -75.12 -43.2 54.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.062 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 20.0 tp -75.64 -44.29 43.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.763 -171.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.642 ' HG2' ' O ' ' A' ' 98' ' ' SER . 7.6 ptp180 -58.91 -30.68 67.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.062 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.1 m -65.47 -24.86 67.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.029 0.443 . . . . 0.0 110.876 177.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.9 mt -83.63 -32.63 25.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.824 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.48 -21.96 66.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.457 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 74.6 mt -71.63 -13.15 61.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.848 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -81.37 113.94 45.53 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.928 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.526 ' HA ' ' NE ' ' A' ' 111' ' ' ARG . 48.9 Cg_exo -56.06 -37.02 96.92 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.088 2.526 . . . . 0.0 113.388 -177.012 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.488 ' CD2' HD23 ' A' ' 135' ' ' LEU . 47.7 t60 -69.27 -41.39 76.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.044 0.449 . . . . 0.0 110.384 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.42 HD13 ' HB2' ' A' ' 139' ' ' PHE . 2.5 tt -64.71 -46.64 81.45 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.985 -177.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.526 ' NE ' ' HA ' ' A' ' 108' ' ' PRO . 16.3 ptt180 -68.15 -28.47 67.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.872 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -44.32 95.85 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.168 0.508 . . . . 0.0 109.737 173.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.86 -47.25 85.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.183 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 51.1 mtp -56.7 -50.79 71.11 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.208 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.599 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.2 m -65.4 -32.27 57.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.861 -0.335 . . . . 0.0 111.136 -178.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -65.94 -41.27 91.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.054 0.454 . . . . 0.0 110.704 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.509 HD12 ' SD ' ' A' ' 127' ' ' MET . 32.9 tp -68.14 -37.38 80.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.759 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.516 ' OD1' HG23 ' B' ' 478' ' ' ILE . 36.7 t70 -64.29 -29.57 70.65 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.778 0.323 . . . . 0.0 111.472 -177.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.599 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 68.4 mt-30 -63.53 -28.37 69.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.375 0.607 . . . . 0.0 110.721 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.27 27.78 72.8 Favored Glycine 0 CA--C 1.516 0.154 0 CA-C-N 114.832 -1.076 . . . . 0.0 114.106 170.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -85.0 -53.79 5.06 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.177 0.513 . . . . 0.0 110.29 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -124.04 33.45 5.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.527 -176.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.622 ' O ' ' HG2' ' A' ' 127' ' ' MET . 0.1 OUTLIER -45.77 -38.27 6.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.847 -1.069 . . . . 0.0 112.08 177.023 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.16 -41.5 79.33 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 121.01 0.433 . . . . 0.0 111.527 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -85.4 -36.36 20.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.523 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 96.2 mt -57.48 -42.48 82.69 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.63 179.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' MET . . . . . 0.622 ' HG2' ' O ' ' A' ' 123' ' ' LYS . 69.4 mmm -53.16 -39.63 63.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.902 0.382 . . . . 0.0 110.768 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 -70.74 -48.9 52.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.307 0.575 . . . . 0.0 110.208 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.593 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -70.64 -19.45 62.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.221 -0.9 . . . . 0.0 112.328 -174.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.558 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.5 m-30 -85.47 -26.22 26.43 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.84 0.352 . . . . 0.0 110.618 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.493 ' HA ' ' HE1' ' A' ' 131' ' ' MET . 19.2 mmt -80.75 0.54 34.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.202 -179.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.593 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.6 pt20 -105.73 -5.15 20.17 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.864 0.364 . . . . 0.0 110.296 177.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.404 ' O ' HG21 ' A' ' 137' ' ' VAL . 2.3 mt-10 -106.23 121.41 45.56 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.651 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 23.8 Cg_endo -61.42 -13.12 27.29 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.298 2.665 . . . . 0.0 113.085 -176.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.488 HD23 ' CD2' ' A' ' 109' ' ' HIS . 6.8 mp -77.3 -40.34 44.69 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.135 177.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.558 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 40.4 t80 -89.06 -33.16 17.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.105 0.479 . . . . 0.0 110.229 -172.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.651 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 9.5 m -58.31 -47.73 86.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.385 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.49 ' N ' HG23 ' A' ' 137' ' ' VAL . 10.8 pt-20 -67.63 -34.96 78.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.775 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . 0.42 ' HB2' HD13 ' A' ' 110' ' ' LEU . 45.3 t80 -58.06 -49.6 76.33 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 173.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.754 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -61.23 -46.42 90.48 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.73 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.49 -32.24 72.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.379 0.609 . . . . 0.0 110.885 -176.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 95.2 m -82.71 -38.42 23.35 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.093 -176.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 25.7 p -73.65 -27.02 61.04 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.246 -176.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.754 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 93.6 mt -60.06 -38.23 82.21 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.098 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -71.87 -16.81 76.52 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.387 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.415 HG22 HD21 ' A' ' 94' ' ' ASN . 25.1 mt -91.26 -28.77 4.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.729 0.299 . . . . 0.0 110.896 -178.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 31.0 m -96.7 2.61 10.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 . . . . . 0 N--CA 1.465 0.296 0 C-N-CA 121.127 -0.229 . . . . 0.0 110.484 175.895 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 57.6 mt . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -57.56 -45.71 84.81 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.469 0.652 . . . . 0.0 109.287 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 63.8 t60 -67.7 -55.87 11.51 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.499 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.455 ' O ' ' HB ' ' B' ' 469' ' ' VAL . 38.4 mt-10 -56.68 -46.5 81.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.588 -172.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -74.12 -28.47 61.36 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.363 -175.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -27.02 48.62 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . 0.455 ' HB ' ' O ' ' B' ' 466' ' ' GLU . 2.4 t -61.23 -33.96 58.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.606 173.01 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.42 HG12 ' O ' ' B' ' 466' ' ' GLU . 30.1 mm -65.4 -28.07 43.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.797 -178.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.81 -29.91 70.47 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.124 0.487 . . . . 0.0 110.344 177.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -81.27 -40.59 23.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.01 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 61.2 m -62.09 -56.85 14.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.816 -177.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . 0.67 ' O ' HG12 ' B' ' 478' ' ' ILE . 88.5 t -54.12 -50.57 54.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.402 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -64.69 -36.89 85.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.984 -171.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -43.78 88.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.24 0.543 . . . . 0.0 109.743 175.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . 0.492 ' O ' ' HD3' ' B' ' 480' ' ' LYS . 78.1 mt -65.91 -53.84 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.227 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . 0.67 HG12 ' O ' ' B' ' 474' ' ' VAL . 8.0 mm -54.5 -31.64 23.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.702 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -55.08 -39.69 69.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.63 -174.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . 0.492 ' HD3' ' O ' ' B' ' 477' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.465 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.019 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.506 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 7.4 ptp180 . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 121.222 0.534 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.606 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 26.0 t -110.12 145.26 16.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.109 -176.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.0 m -62.56 142.16 58.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.072 0.463 . . . . 0.0 110.819 178.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.441 HD22 HD13 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -59.29 -33.18 70.76 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.548 -176.416 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -58.13 -40.86 82.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.791 177.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -65.78 -42.92 90.21 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.47 ' O ' HD12 ' A' ' 95' ' ' LEU . 83.7 mt -66.61 -34.64 78.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.845 -175.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -56.23 -32.95 64.94 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -66.18 -24.59 66.66 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.813 0.339 . . . . 0.0 111.702 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.47 HD12 ' O ' ' A' ' 92' ' ' LEU . 7.5 mp -64.69 -38.03 89.61 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.768 0.318 . . . . 0.0 111.065 -175.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.56 -26.22 71.83 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.67 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -100.71 4.41 43.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.147 0.499 . . . . 0.0 110.856 -178.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.504 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 71.1 m -84.93 107.24 16.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.172 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.39 -29.95 69.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.242 -177.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.2 m -70.64 -39.73 73.49 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 -177.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.443 HD13 ' CD2' ' A' ' 139' ' ' PHE . 40.8 tp -74.73 -48.64 24.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.387 -176.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 98' ' ' SER . 4.5 ptp180 -61.39 -27.29 68.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.109 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.5 t -64.16 -23.91 67.49 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.13 0.491 . . . . 0.0 110.148 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.1 mt -87.51 -33.38 18.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.194 178.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.406 HD21 HD12 ' B' ' 477' ' ' ILE . 11.1 mp -69.86 -6.69 34.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.834 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 58.9 mt -67.93 -14.67 63.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.419 176.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -84.37 121.52 75.2 Favored Pre-proline 0 C--O 1.235 0.325 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.934 175.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.06 -29.91 90.3 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.884 2.389 . . . . 0.0 112.796 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 65.1 t60 -70.49 -44.61 67.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.736 0.303 . . . . 0.0 110.8 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.429 HD23 ' O ' ' A' ' 110' ' ' LEU . 4.3 tt -61.57 -42.14 98.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.221 0.534 . . . . 0.0 110.067 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -70.56 -32.73 70.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.281 -178.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.497 HE21 ' HA ' ' A' ' 112' ' ' GLN . 0.0 OUTLIER -66.47 -37.54 85.33 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.63 175.673 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 76.1 mt -55.06 -51.26 66.89 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.441 ' HB3' HD11 ' B' ' 478' ' ' ILE . 49.5 mtm -53.77 -54.62 35.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 71.7 t -57.03 -39.49 66.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.544 -178.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -65.21 -41.37 94.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.464 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.499 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 54.9 tp -71.19 -31.98 68.3 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.258 -178.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.433 ' HB2' ' CD1' ' B' ' 478' ' ' ILE . 14.1 t70 -61.07 -38.9 87.86 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.954 -178.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -60.35 -29.37 68.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.557 0.694 . . . . 0.0 111.165 -177.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 66.13 21.31 69.85 Favored Glycine 0 N--CA 1.451 -0.367 0 CA-C-N 114.647 -1.161 . . . . 0.0 113.448 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -72.36 -34.24 67.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.324 0.583 . . . . 0.0 110.297 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.426 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 22.1 p-10 -145.38 40.07 1.2 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.384 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.589 ' HD3' ' N ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.04 -33.91 5.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.471 -1.24 . . . . 0.0 112.144 177.735 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.7 -52.1 66.54 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.509 -175.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.503 ' HB3' ' HZ1' ' A' ' 125' ' ' LYS . 0.2 OUTLIER -76.24 -34.57 59.19 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.359 179.9 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 89.2 mt -58.32 -44.34 88.59 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.462 -178.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.58 -35.07 60.42 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.932 0.396 . . . . 0.0 111.103 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -84.21 -41.38 17.03 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.684 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.506 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -71.1 -17.07 62.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.027 -176.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.499 ' CE2' ' HB2' ' A' ' 117' ' ' LEU . 3.8 m-30 -87.58 -28.26 22.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.944 0.402 . . . . 0.0 110.857 179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.466 ' HE2' ' HA ' ' A' ' 131' ' ' MET . 4.0 mmt -80.89 5.2 16.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.322 -177.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 28.4 pt20 -104.03 -7.95 19.92 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 176.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -103.03 126.24 32.99 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.403 -176.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.662 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 30.4 Cg_endo -63.59 -14.28 41.65 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.904 2.403 . . . . 0.0 112.516 -178.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.2 mp -73.46 -44.08 58.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.771 0.32 . . . . 0.0 110.416 176.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.4 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 36.9 t80 -88.8 -29.87 19.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.111 0.481 . . . . 0.0 110.126 -170.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.662 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 18.6 m -59.7 -48.59 86.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.786 177.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.484 ' N ' HG22 ' A' ' 137' ' ' VAL . 36.7 mt-10 -62.24 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.367 176.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . 0.443 ' CD2' HD13 ' A' ' 101' ' ' LEU . 61.8 t80 -54.06 -49.18 69.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.695 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.66 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.72 -47.35 81.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.935 178.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -61.1 -31.25 70.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.506 0.67 . . . . 0.0 110.493 -176.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . 0.424 ' O ' HG13 ' A' ' 146' ' ' ILE . 78.2 m -77.96 -50.14 12.74 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.532 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.508 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -65.88 -29.72 70.21 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.551 0.215 . . . . 0.0 111.298 -175.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.66 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 57.7 mt -66.57 -23.31 66.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.765 0.316 . . . . 0.0 110.745 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -86.55 -14.67 65.27 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.063 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 142' ' ' CYS . 25.4 mt -91.86 -31.62 4.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.858 0.361 . . . . 0.0 110.906 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.442 ' CG1' HD11 ' A' ' 95' ' ' LEU . 23.0 m -106.8 4.95 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -177.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 121.862 0.839 . . . . 0.0 113.202 -172.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . 0.558 ' O ' ' HB2' ' B' ' 467' ' ' ARG . 42.4 mm . . . . . 0 C--O 1.223 -0.303 0 N-CA-C 111.397 0.147 . . . . 0.0 111.397 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -60.66 -47.63 85.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.074 0.464 . . . . 0.0 110.3 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 15.5 t60 -71.81 -43.51 65.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.187 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.537 ' O ' HG12 ' B' ' 470' ' ' ILE . 49.2 mt-10 -69.78 -22.96 63.29 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.016 -174.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . 0.558 ' HB2' ' O ' ' B' ' 463' ' ' ILE . 30.8 ttp180 -62.94 -42.74 99.91 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.188 0.595 . . . . 0.0 111.301 177.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -80.41 -18.38 49.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.405 0.621 . . . . 0.0 109.884 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . 0.486 ' HB ' ' HA ' ' B' ' 466' ' ' GLU . 2.1 t -67.35 -32.0 55.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.386 171.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.537 HG12 ' O ' ' B' ' 466' ' ' GLU . 32.5 mm -60.14 -31.87 49.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.565 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . 0.532 ' O ' ' HG3' ' B' ' 475' ' ' ARG . 85.9 mt -53.9 -44.13 70.24 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.823 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . 0.606 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.4 mp0 -64.8 -41.51 95.75 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.461 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 38.1 m -61.56 -53.28 58.46 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.226 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . 0.48 ' O ' HG13 ' B' ' 478' ' ' ILE . 78.6 t -51.78 -57.78 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.881 176.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' B' ' 471' ' ' LEU . 43.0 mtp180 -73.9 -20.24 60.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.326 -0.397 . . . . 0.0 112.039 -169.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.42 -46.16 70.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.033 0.444 . . . . 0.0 109.967 174.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . 0.406 HD12 HD21 ' A' ' 105' ' ' LEU . 74.8 mt -65.36 -54.6 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.034 -178.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . 0.48 HG13 ' O ' ' B' ' 474' ' ' VAL . 53.5 mt -53.43 -31.57 19.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.967 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 22.7 tptm -56.56 -48.43 77.37 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.275 -174.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.855 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.77 -175.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 . . . . . 0 C--O 1.233 0.216 0 CA-C-O 121.127 0.489 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 24.2 t -75.26 132.01 34.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.416 -173.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.8 m -70.02 153.81 42.74 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.725 176.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.03 -41.49 87.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.867 0.365 . . . . 0.0 110.083 -175.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -55.06 -39.21 68.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.552 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -71.57 -38.35 70.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.907 0.384 . . . . 0.0 110.259 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.9 mt -65.14 -35.07 79.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.251 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.552 ' HB3' ' HZ3' ' A' ' 93' ' ' LYS . 3.0 mmmp? -53.73 -32.27 51.5 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.113 178.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -70.5 -18.38 62.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.741 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.08 -52.1 60.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.63 0.252 . . . . 0.0 111.047 -177.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.45 -16.21 62.58 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.129 -0.557 . . . . 0.0 112.932 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 32.8 mm-40 -83.11 -24.1 32.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.819 0.342 . . . . 0.0 110.687 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.51 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.9 t -74.61 113.33 11.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.323 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -24.55 65.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.469 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.5 m -72.7 -41.07 65.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.7 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.455 ' O ' HD13 ' A' ' 105' ' ' LEU . 61.3 tp -67.43 -54.39 20.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.414 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.598 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 6.8 ptp180 -60.55 -24.94 65.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.229 -179.341 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.3 t -58.85 -30.07 67.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.208 0.528 . . . . 0.0 110.2 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 mt -86.71 -32.74 20.3 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.005 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 101' ' ' LEU . 9.2 mp -61.59 -20.72 63.63 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.476 178.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 80.8 mt -68.14 -12.64 61.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.185 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -84.69 116.55 65.73 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.075 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.412 ' O ' ' HG2' ' A' ' 111' ' ' ARG . 67.5 Cg_exo -52.63 -36.18 70.74 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 123.802 3.002 . . . . 0.0 113.44 -176.187 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -67.34 -45.35 76.66 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.09 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 50.1 tp -65.85 -38.29 88.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.95 0.405 . . . . 0.0 111.046 -176.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 108' ' ' PRO . 30.1 ptt180 -69.93 -27.64 64.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.094 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -70.8 -37.81 73.29 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.549 174.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 88.1 mt -58.07 -46.28 85.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.326 176.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.413 ' HG2' HG22 ' B' ' 474' ' ' VAL . 59.0 mtm -58.1 -54.8 42.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.437 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.583 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 32.0 m -66.53 -23.31 31.23 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -175.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -76.47 -45.79 29.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.15 0.5 . . . . 0.0 110.792 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.471 HD12 ' CD2' ' A' ' 130' ' ' TYR . 0.7 OUTLIER -64.48 -49.97 69.28 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.414 -175.885 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -55.65 -21.4 17.84 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.393 -1.276 . . . . 0.0 111.014 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.583 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 75.2 mt-30 -65.11 -29.67 70.55 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.499 0.666 . . . . 0.0 109.4 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.16 17.09 63.2 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 114.44 -1.254 . . . . 0.0 113.891 172.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -54.36 -54.94 33.81 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.582 ' OD2' ' HG2' ' A' ' 125' ' ' LYS . 27.3 t70 -143.48 65.92 1.31 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.791 0.805 . . . . 0.0 109.464 172.047 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.603 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -55.54 -23.36 26.13 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.92 179.381 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -53.12 -52.95 57.04 Favored 'General case' 0 C--O 1.231 0.131 0 O-C-N 123.319 0.387 . . . . 0.0 111.828 -177.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.582 ' HG2' ' OD2' ' A' ' 122' ' ' ASP . 18.5 pttm -85.38 -30.01 23.97 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.176 -0.61 . . . . 0.0 111.041 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.623 HD22 ' CE1' ' A' ' 130' ' ' TYR . 36.8 mt -60.52 -43.46 97.08 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.854 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' MET . . . . . 0.44 ' O ' ' HG2' ' A' ' 131' ' ' MET . 0.0 OUTLIER -55.61 -38.64 69.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.745 0.307 . . . . 0.0 111.546 179.782 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -84.08 -40.09 18.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.934 0.397 . . . . 0.0 110.873 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.503 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.81 -17.6 63.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.846 -176.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.623 ' CE1' HD22 ' A' ' 126' ' ' LEU . 5.2 m-30 -84.95 -28.41 25.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.066 0.46 . . . . 0.0 110.34 -179.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.44 ' HG2' ' O ' ' A' ' 127' ' ' MET . 54.9 mmm -78.59 4.35 13.72 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.357 -178.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 7.2 pt20 -94.31 -14.83 25.02 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.316 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -99.65 125.25 41.35 Favored Pre-proline 0 N--CA 1.449 -0.48 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.669 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.659 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 29.0 Cg_endo -63.14 -14.21 40.31 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.056 2.504 . . . . 0.0 112.842 -174.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.3 mp -75.52 -36.15 60.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.927 0.394 . . . . 0.0 110.264 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.51 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 35.8 t80 -89.97 -33.88 16.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.152 -173.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.659 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 21.0 m -58.19 -49.29 82.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.027 178.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.447 ' N ' HG23 ' A' ' 137' ' ' VAL . 72.7 mm-40 -62.58 -41.44 98.95 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.542 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -55.31 -49.8 71.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.659 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.781 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.61 -48.8 75.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.707 177.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -59.39 -30.73 68.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.363 0.601 . . . . 0.0 110.621 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.7 m -76.2 -52.68 9.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.398 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.528 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.4 p -64.5 -30.82 71.85 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 121.121 -0.232 . . . . 0.0 111.487 -174.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.781 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 82.6 mt -60.0 -44.96 94.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.779 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -72.19 -15.17 76.68 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.406 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 65.8 mt -91.19 -36.84 8.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 120.748 0.309 . . . . 0.0 111.315 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 27.7 m -94.55 5.93 7.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -173.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 6.7 mm-40 . . . . . 0 C--N 1.326 -0.447 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 174.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 72.6 mt . . . . . 0 C--O 1.226 -0.147 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -58.2 -44.46 88.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.438 0.637 . . . . 0.0 109.827 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 62.9 t60 -65.49 -55.27 18.77 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.293 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.34 -38.0 82.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.133 -173.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -72.23 -42.98 65.1 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 111.642 0.238 . . . . 0.0 111.642 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -76.01 -23.56 55.21 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.8 t -58.34 -32.38 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.702 174.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.51 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 25.9 mm -62.98 -37.55 79.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.814 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 85.1 mt -53.55 -42.26 67.3 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.223 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -65.44 -43.31 90.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.396 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 53.3 m -62.04 -54.09 46.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.593 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . 0.431 HG21 ' O ' ' B' ' 470' ' ' ILE . 69.2 t -47.88 -54.33 3.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.762 176.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.437 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 26.7 ttm180 -67.93 -35.73 78.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.596 -173.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -43.17 95.35 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.051 0.453 . . . . 0.0 110.133 178.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . 0.427 HD13 HD23 ' A' ' 105' ' ' LEU . 97.5 mt -67.42 -55.28 17.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.638 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 56.9 mt -54.46 -23.44 10.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.025 0.441 . . . . 0.0 111.026 176.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . 0.437 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 15.3 tppt? -69.99 -48.88 56.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.927 -175.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . 0.416 ' HD2' ' HB3' ' B' ' 479' ' ' LYS . 2.1 mptp? . . . . . 0 C--N 1.328 -0.363 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.474 -177.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 . . . . . 0 N--CA 1.446 -0.65 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.498 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 27.7 t -99.8 133.69 41.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.295 -174.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.2 m -55.76 134.93 51.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.924 175.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -59.88 -32.86 71.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.263 -176.315 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -60.37 -40.95 92.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.696 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -64.46 -43.07 95.41 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.159 0.504 . . . . 0.0 110.149 177.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 76.8 mt -65.45 -33.91 77.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.409 -178.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 63.0 mttm -62.5 -24.7 67.62 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -74.36 -18.02 60.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.669 0.271 . . . . 0.0 110.791 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 91.0 mt -62.27 -42.31 99.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.957 0.408 . . . . 0.0 110.479 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -70.63 -19.01 76.16 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.723 -0.672 . . . . 0.0 112.379 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -86.5 -24.75 25.45 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.85 0.357 . . . . 0.0 110.435 -178.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.635 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.5 t -68.49 108.33 3.25 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.52 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.4 -24.67 66.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.051 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.5 m -75.43 -48.64 21.89 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.817 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.2 tp -67.36 -49.3 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.802 -174.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.635 ' HG2' ' O ' ' A' ' 98' ' ' SER . 8.2 ptp180 -60.14 -28.51 67.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.279 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.467 ' O ' ' HB2' ' A' ' 106' ' ' LEU . 22.7 t -66.9 -25.68 66.5 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.043 0.449 . . . . 0.0 110.096 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 27.3 mt -76.51 -33.22 58.62 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.59 -15.97 63.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.825 177.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 103' ' ' SER . 3.9 mm? -69.12 -13.83 62.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.645 175.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -78.63 116.32 58.59 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.804 175.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.62 -26.59 82.6 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.99 2.46 . . . . 0.0 112.514 -175.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.455 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 66.2 t60 -74.56 -46.14 40.86 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.776 178.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 51.8 tp -64.77 -39.11 93.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.899 0.381 . . . . 0.0 110.916 -176.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -67.14 -33.22 74.97 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 -70.17 -36.42 74.68 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.24 178.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 109' ' ' HIS . 95.3 mt -58.39 -54.31 48.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.908 175.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 70.7 mtp -55.83 -50.42 70.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.163 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.591 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 48.7 t -59.21 -40.24 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.284 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 16.7 m-20 -60.37 -47.23 86.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.171 0.51 . . . . 0.0 111.088 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 55.9 tp -64.2 -37.74 88.54 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.21 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.401 ' HB2' HD12 ' B' ' 478' ' ' ILE . 26.8 t70 -63.94 -35.63 81.32 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.119 -179.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 74.5 mt-30 -62.45 -28.92 70.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.582 0.706 . . . . 0.0 110.426 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 70.57 27.39 72.61 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 114.443 -1.253 . . . . 0.0 113.61 171.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -56.5 -55.18 37.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.95 0.405 . . . . 0.0 110.4 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.561 ' O ' HD11 ' A' ' 126' ' ' LEU . 27.5 t70 -151.57 77.22 1.23 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.542 0.687 . . . . 0.0 109.723 174.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.61 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.6 OUTLIER -53.68 -23.72 12.31 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.802 -1.09 . . . . 0.0 111.629 178.618 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.9 -51.76 67.92 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -175.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -71.06 -50.06 37.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.8 176.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.561 HD11 ' O ' ' A' ' 122' ' ' ASP . 11.1 mp -51.73 -45.65 63.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -175.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' MET . . . . . 0.445 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.1 OUTLIER -54.38 -45.63 72.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.835 0.35 . . . . 0.0 111.658 -179.556 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 42.5 mtm180 -83.44 -35.44 24.99 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.078 -176.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -73.16 -16.86 61.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.563 -177.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.494 ' HB3' ' CG ' ' A' ' 136' ' ' PHE . 13.1 m-30 -89.16 -27.08 20.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.088 0.471 . . . . 0.0 110.743 177.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.416 ' HE3' HG13 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -79.0 6.29 9.69 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.543 -177.563 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 30.0 pt20 -102.38 -22.85 14.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.845 0.355 . . . . 0.0 110.869 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -103.33 138.6 19.59 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 121.048 0.451 . . . . 0.0 111.37 -175.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.694 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 35.2 Cg_endo -63.42 -13.53 36.74 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.829 3.019 . . . . 0.0 114.043 -171.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.402 HD23 ' CD2' ' A' ' 109' ' ' HIS . 11.0 mp -77.15 -39.15 50.15 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.322 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.494 ' CG ' ' HB3' ' A' ' 130' ' ' TYR . 39.8 t80 -91.51 -33.77 15.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.0 0.428 . . . . 0.0 110.29 -174.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.694 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 15.5 m -56.72 -51.17 70.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.339 179.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.501 ' N ' HG21 ' A' ' 137' ' ' VAL . 39.5 mm-40 -66.48 -35.35 80.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.597 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -56.4 -51.11 69.56 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 173.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.739 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.01 -47.4 83.27 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.702 178.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.72 -33.16 71.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.29 0.567 . . . . 0.0 110.633 -176.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.4 m -76.12 -48.63 19.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.391 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.499 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 25.6 p -67.19 -30.7 70.72 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.91 -174.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 74.6 mt -58.95 -47.14 86.14 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.833 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.33 -27.82 73.57 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.248 -176.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 69.8 mt -76.62 -42.12 34.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.805 0.336 . . . . 0.0 110.726 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 23.4 m -90.2 3.55 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -174.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.637 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 7.4 mm-40 . . . . . 0 N--CA 1.465 0.287 0 O-C-N 123.185 0.303 . . . . 0.0 110.473 176.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 82.4 mt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.802 0.334 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -54.99 -40.23 69.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.356 174.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -74.97 -47.28 30.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.566 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.589 ' O ' HG12 ' B' ' 470' ' ' ILE . 40.5 mt-10 -57.29 -45.96 83.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.79 -176.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . 0.445 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 21.8 mtm180 -64.04 -29.57 70.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -177.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -32.63 59.24 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.4 t -66.14 -35.7 75.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.388 176.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.589 HG12 ' O ' ' B' ' 466' ' ' GLU . 30.7 mm -63.06 -33.78 62.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.246 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . 0.438 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 90.1 mt -57.45 -48.67 78.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.357 177.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . 0.498 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.1 mp0 -58.88 -36.78 75.21 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.094 178.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 57.5 m -63.96 -58.82 5.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.987 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 94.2 t -50.45 -44.55 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.808 175.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 31.2 mmt180 -62.88 -44.04 97.19 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.015 -177.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . 0.407 ' CZ ' ' HA ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -67.56 -50.28 59.23 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.67 -179.348 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 83.9 mt -60.79 -59.27 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.746 -174.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . 0.401 HD12 ' HB2' ' A' ' 118' ' ' ASP . 67.9 mt -58.81 -23.92 24.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.301 -177.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . 0.47 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 5.6 tmtt? -64.57 -42.13 95.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.652 -177.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.655 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.412 ' HA ' ' OE1' ' B' ' 472' ' ' GLN . 37.4 mmt180 . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 121.321 0.581 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 85.2 t -106.7 137.29 38.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.712 -174.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.3 m -71.41 145.78 49.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.17 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.524 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.3 OUTLIER -58.8 -31.95 68.9 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.403 -176.469 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -56.61 -39.08 72.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.755 0.312 . . . . 0.0 110.703 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -70.45 -40.66 73.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.152 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.41 -31.36 70.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.254 -178.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 62.2 mtpt -60.81 -28.37 68.73 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 178.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 -72.32 -16.61 61.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.724 -0.217 . . . . 0.0 111.548 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.49 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 97.0 mt -55.74 -56.48 19.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.535 -176.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -66.01 -21.98 70.17 Favored Glycine 0 CA--C 1.52 0.379 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.691 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -79.62 -20.52 46.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.058 0.456 . . . . 0.0 110.818 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.457 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.9 m -78.8 123.18 26.94 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.364 -177.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.61 -27.85 69.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.929 -173.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.1 m -75.12 -39.66 60.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.039 0.447 . . . . 0.0 110.868 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.553 ' O ' HD13 ' A' ' 105' ' ' LEU . 29.4 tp -73.0 -49.09 30.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.521 -172.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.691 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 9.0 ptp180 -57.18 -33.52 67.55 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.919 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 73.6 m -63.08 -42.06 99.56 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.551 HD12 HD11 ' A' ' 101' ' ' LEU . 0.6 OUTLIER -87.94 -19.13 27.69 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.923 -0.711 . . . . 0.0 111.653 -179.192 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.553 HD13 ' O ' ' A' ' 101' ' ' LEU . 7.5 mp -64.82 -20.99 66.7 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.278 0.561 . . . . 0.0 110.622 170.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.691 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 97.7 mt -71.16 -12.71 61.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.965 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -78.61 118.49 72.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.868 175.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.94 -34.68 92.65 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.421 2.747 . . . . 0.0 112.86 -177.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.544 ' CD2' HD21 ' A' ' 135' ' ' LEU . 60.9 t60 -66.26 -48.76 69.43 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.694 0.283 . . . . 0.0 110.838 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.455 HD22 ' O ' ' A' ' 104' ' ' LEU . 48.7 tp -63.07 -41.79 99.51 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.101 -176.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -66.32 -34.57 78.28 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.193 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -67.67 -28.56 67.8 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 120.597 0.237 . . . . 0.0 111.086 176.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.93 -53.41 18.01 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.447 ' HG3' HG22 ' B' ' 474' ' ' VAL . 33.6 ttp -56.47 -42.91 79.0 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.021 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 20.5 t -62.94 -45.91 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 120.699 0.285 . . . . 0.0 111.22 177.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.452 ' HB2' ' HH ' ' A' ' 130' ' ' TYR . 69.8 m-20 -62.99 -40.95 99.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.02 0.438 . . . . 0.0 111.243 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 46.1 tp -62.63 -37.21 85.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.6 178.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -62.99 -34.63 77.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.412 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -58.91 -27.0 64.84 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.826 -178.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . 0.535 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 65.78 16.93 64.38 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.33 -0.85 . . . . 0.0 113.856 170.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -72.68 -42.96 63.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.311 0.576 . . . . 0.0 109.584 -175.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.429 ' OD1' ' HG2' ' A' ' 125' ' ' LYS . 4.2 t70 -150.04 51.43 0.91 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 173.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.535 ' HG3' ' HA2' ' A' ' 120' ' ' GLY . 0.0 OUTLIER -56.55 -20.71 22.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.66 -1.155 . . . . 0.0 110.582 175.242 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.478 ' H ' ' HD2' ' A' ' 123' ' ' LYS . . . -57.01 -53.81 53.86 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.271 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.429 ' HG2' ' OD1' ' A' ' 122' ' ' ASP . 65.0 pttt -79.61 -28.42 41.0 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.554 178.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.415 ' HB2' ' HA ' ' A' ' 123' ' ' LYS . 95.8 mt -63.51 -40.37 96.88 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.589 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' MET . . . . . 0.461 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.4 OUTLIER -52.92 -34.28 54.44 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.915 0.388 . . . . 0.0 110.857 177.185 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -79.73 -48.79 13.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.786 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.581 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.35 -20.12 64.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.206 -175.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.51 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.3 m-30 -85.04 -36.44 21.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.106 0.479 . . . . 0.0 110.848 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.67 5.94 14.19 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.144 -176.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.581 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.1 pt20 -100.3 -24.09 14.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.905 0.383 . . . . 0.0 110.14 178.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.57 136.15 19.4 Favored Pre-proline 0 N--CA 1.452 -0.356 0 CA-C-O 121.149 0.499 . . . . 0.0 110.881 178.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.655 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 34.1 Cg_endo -64.04 -14.33 42.82 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 123.532 2.821 . . . . 0.0 114.0 -170.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.544 HD21 ' CD2' ' A' ' 109' ' ' HIS . 4.3 mp -69.54 -39.31 77.54 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.942 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.51 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 60.8 t80 -92.2 -30.82 15.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.086 0.47 . . . . 0.0 110.093 -173.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.655 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 35.9 m -59.0 -50.9 78.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.262 -178.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 11.7 pt-20 -72.24 -28.56 63.22 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.876 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -59.53 -49.0 79.47 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 172.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.804 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.57 -45.58 92.25 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.562 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.69 -32.66 73.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.518 -177.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . 0.4 ' O ' HG13 ' A' ' 146' ' ' ILE . 69.0 m -70.76 -51.38 27.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.995 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.425 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.0 p -65.26 -27.42 68.64 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.966 -175.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.804 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.3 mt -60.36 -54.47 45.24 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 120.745 0.307 . . . . 0.0 110.23 177.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.76 -14.29 57.91 Favored Glycine 0 CA--C 1.516 0.127 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.833 -176.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 143' ' ' CYS . 64.5 mt -90.67 -30.48 4.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 120.808 0.337 . . . . 0.0 111.142 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 15.2 m -103.38 -18.35 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.546 -176.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 . . . . . 0 C--N 1.325 -0.484 0 CA-C-O 120.82 0.343 . . . . 0.0 110.307 177.411 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 42.7 mt . . . . . 0 C--O 1.231 0.115 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -65.13 -36.98 85.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.311 0.577 . . . . 0.0 109.823 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -68.24 -55.72 11.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.019 173.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.52 ' O ' ' HB ' ' B' ' 469' ' ' VAL . 40.1 mt-10 -56.5 -51.44 68.49 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.503 -0.772 . . . . 0.0 112.493 -172.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . 0.461 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 96.7 mtt180 -67.59 -25.73 65.92 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -174.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -29.99 37.78 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 177.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . 0.52 ' HB ' ' O ' ' B' ' 466' ' ' GLU . 8.5 t -60.93 -38.53 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.921 174.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.474 HG23 ' CZ ' ' A' ' 136' ' ' PHE . 10.6 mm -63.21 -38.5 82.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.304 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . 0.486 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 80.3 mt -58.65 -46.06 87.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.119 177.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . 0.457 HE21 ' HA ' ' B' ' 469' ' ' VAL . 10.3 mt-30 -62.88 -33.2 74.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.581 177.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 63.0 m -69.66 -54.97 11.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.234 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . 0.459 HG21 ' O ' ' B' ' 470' ' ' ILE . 54.6 t -47.08 -50.02 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.19 175.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' B' ' 471' ' ' LEU . 35.8 mmt180 -63.61 -34.45 77.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.895 0.378 . . . . 0.0 111.171 -175.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -75.35 -49.34 19.39 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.569 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 95.5 mt -60.58 -58.37 7.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.572 -176.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 50.2 mt -56.53 -23.6 17.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.585 -179.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -64.41 -48.65 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -178.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.708 0 CA-C-O 120.895 0.379 . . . . 0.0 111.256 -175.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.551 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 36.4 ptt180 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 91.4 t -100.28 139.08 22.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.895 0.378 . . . . 0.0 110.651 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.1 m -65.42 138.96 58.47 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.341 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.442 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.75 -33.17 72.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.219 -176.608 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -63.17 -40.42 97.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.746 177.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.64 -41.82 98.21 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 93.3 mt -67.38 -32.21 72.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.839 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.442 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 94.3 mttt -61.35 -20.68 63.26 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -77.25 -17.9 58.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.589 0.233 . . . . 0.0 111.131 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 88.2 mt -62.63 -49.57 74.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.273 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -70.61 -14.86 72.81 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.418 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -91.02 -22.59 20.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.882 0.372 . . . . 0.0 110.961 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.654 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 33.0 t -68.49 116.64 9.27 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.386 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.69 -29.63 70.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.045 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 57.5 m -77.44 -37.46 51.53 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.813 -177.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.481 HD12 ' CD2' ' A' ' 139' ' ' PHE . 48.5 tp -75.28 -47.09 29.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.312 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.654 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -60.03 -31.43 69.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.906 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 21.3 t -66.26 -22.92 66.33 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.202 0.525 . . . . 0.0 110.228 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 28.0 mt -80.52 -32.55 36.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.687 178.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.7 mp -69.6 -10.52 58.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.96 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.52 -11.52 53.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.843 174.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -86.0 114.61 58.02 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 173.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -54.72 -30.04 64.85 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.947 2.431 . . . . 0.0 112.608 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -68.26 -45.08 74.15 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.901 178.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 55.3 tp -66.33 -38.61 88.06 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.75 0.31 . . . . 0.0 111.188 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -67.35 -30.99 70.95 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.656 -0.418 . . . . 0.0 109.959 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -73.9 -32.52 63.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.819 177.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.419 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 72.3 mt -59.02 -50.73 72.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.36 176.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 60.0 mtm -56.77 -49.83 74.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.559 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.646 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 60.1 t -59.59 -46.53 93.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.153 -178.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -60.29 -48.26 82.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.024 0.44 . . . . 0.0 111.476 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 61.9 tp -62.98 -36.63 84.15 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.663 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.417 ' OD1' ' HD2' ' B' ' 475' ' ' ARG . 19.3 t70 -66.11 -33.53 76.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.865 -177.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.646 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 60.5 mt-30 -60.27 -28.72 68.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.289 0.566 . . . . 0.0 110.628 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.39 29.37 71.78 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.089 -0.959 . . . . 0.0 114.211 169.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -76.28 -55.1 5.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 117.231 0.515 . . . . 0.0 110.026 176.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -131.25 41.12 3.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.357 0.599 . . . . 0.0 110.146 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.587 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.78 -31.62 5.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.607 -1.179 . . . . 0.0 112.109 177.756 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -54.19 -58.16 8.4 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -177.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -80.02 -26.42 39.82 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.01 -178.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.437 HD22 ' HH ' ' A' ' 130' ' ' TYR . 94.9 mt -62.53 -41.54 98.94 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.5 177.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' MET . . . . . 0.428 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -51.75 -39.15 58.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 0.0 111.12 178.208 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 54.2 mtp180 -81.6 -43.23 18.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.769 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.629 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.86 -26.95 68.84 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.52 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.438 ' HA ' ' HG3' ' A' ' 133' ' ' GLU . 3.4 m-30 -80.54 -19.45 45.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.791 0.329 . . . . 0.0 111.078 -178.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.44 ' HA ' ' HE1' ' A' ' 131' ' ' MET . 2.5 mmt -77.57 -4.92 48.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.348 -177.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.629 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.5 pt20 -100.99 -8.54 22.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.978 0.418 . . . . 0.0 110.472 178.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.525 ' O ' HG22 ' A' ' 137' ' ' VAL . 0.6 OUTLIER -94.35 118.48 67.04 Favored Pre-proline 0 N--CA 1.45 -0.472 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.74 -175.025 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.613 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 16.0 Cg_endo -56.39 -24.53 52.57 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.92 2.413 . . . . 0.0 112.168 -175.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.0 mp -71.04 -43.01 68.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.211 0.529 . . . . 0.0 109.993 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.467 ' CZ ' HG23 ' B' ' 470' ' ' ILE . 29.7 t80 -81.97 -31.33 31.24 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.105 -176.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.525 HG22 ' O ' ' A' ' 133' ' ' GLU . 86.9 t -61.98 -43.53 97.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.481 177.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 48.0 mt-10 -65.97 -42.71 89.56 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.08 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . 0.481 ' CD2' HD12 ' A' ' 101' ' ' LEU . 75.5 t80 -57.21 -48.91 77.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.158 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.776 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.79 -48.17 77.99 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.562 -177.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -66.75 -26.8 67.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.192 0.52 . . . . 0.0 110.416 -174.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 94.0 m -79.72 -48.44 13.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.106 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.9 p -64.31 -29.03 70.13 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.55 0.214 . . . . 0.0 111.02 -175.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.776 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 73.8 mt -59.61 -52.83 63.84 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.508 178.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.45 -15.23 63.45 Favored Glycine 0 C--N 1.329 0.188 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.533 -176.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 64.4 mt -88.4 -26.08 5.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 120.766 0.317 . . . . 0.0 111.082 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 13.6 m -103.67 -14.1 8.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.501 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.499 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 44.8 mt-10 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.435 176.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 54.9 mt . . . . . 0 CA--C 1.528 0.126 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -58.72 -42.41 88.66 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 110.218 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -70.25 -50.36 40.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.809 177.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.577 ' O ' HG12 ' B' ' 470' ' ' ILE . 37.5 mt-10 -61.25 -48.28 82.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.286 -172.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . 0.428 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 37.2 mtm180 -58.32 -36.43 73.38 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.73 -27.31 55.36 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -179.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . 0.481 ' HA ' ' CG ' ' B' ' 472' ' ' GLN . 2.4 t -72.56 -29.54 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 114.717 -1.129 . . . . 0.0 110.513 177.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.577 HG12 ' O ' ' B' ' 466' ' ' GLU . 17.2 mm -68.62 -34.5 65.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 174.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 91.0 mt -60.48 -41.89 95.17 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.362 176.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . 0.551 ' NE2' ' HA ' ' A' ' 86' ' ' ARG . 4.6 mm-40 -52.2 -48.38 65.1 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.61 0.719 . . . . 0.0 110.061 175.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . 0.434 ' O ' HG13 ' B' ' 477' ' ' ILE . 38.1 m -61.51 -54.06 48.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.684 -179.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 89.8 t -50.89 -49.87 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.684 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 24.1 mmm180 -67.1 -28.21 67.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.521 -176.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -76.33 -50.32 14.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.672 0.273 . . . . 0.0 110.672 178.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . 0.434 HG13 ' O ' ' B' ' 473' ' ' CYS . 70.4 mt -63.11 -62.73 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.125 -173.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 46.3 mt -54.83 -24.7 14.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . 0.461 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 21.8 tptm -70.98 -39.43 72.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -175.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . 0.407 ' HD3' ' C ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.733 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.82 -178.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 . . . . . 0 CA--C 1.521 -0.143 0 CA-C-O 121.084 0.469 . . . . 0.0 110.766 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.429 HG21 ' HB ' ' A' ' 147' ' ' VAL . 14.9 p -72.77 148.02 9.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.327 -0.852 . . . . 0.0 111.181 -174.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.4 m -68.41 144.84 54.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.281 -177.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -26.51 68.35 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.793 -175.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 24.2 pt20 -60.82 -35.3 76.18 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.135 0.493 . . . . 0.0 110.313 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -70.7 -37.57 73.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.144 177.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.0 mt -68.07 -37.58 81.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.149 178.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -61.7 -20.16 63.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.889 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -75.89 -17.75 59.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.965 0.412 . . . . 0.0 110.553 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.481 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 87.8 mt -65.94 -45.0 83.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.982 -178.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -68.9 -13.83 67.01 Favored Glycine 0 CA--C 1.52 0.344 0 CA-C-N 116.073 -0.512 . . . . 0.0 113.496 -176.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -107.31 5.9 27.96 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.122 0.487 . . . . 0.0 110.934 179.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 67.9 m -93.4 112.53 24.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.844 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.91 -26.24 68.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.543 -178.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 27.4 m -70.45 -42.24 71.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.532 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.481 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 24.0 tp -73.63 -44.83 55.96 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.889 -173.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.496 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 7.8 ptp180 -60.77 -28.32 68.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.233 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.5 t -61.66 -27.29 68.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.371 0.605 . . . . 0.0 109.861 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 21.0 mt -83.98 -32.54 24.94 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.132 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.5 mp -75.76 2.67 11.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.14 0.495 . . . . 0.0 110.648 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 73.9 mt -79.39 -9.2 59.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.088 174.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -90.4 117.45 68.02 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.824 176.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.53 -39.55 87.72 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.159 2.573 . . . . 0.0 113.033 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -68.8 -41.96 77.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.81 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.461 HD22 ' O ' ' A' ' 110' ' ' LEU . 4.4 tt -60.15 -40.05 88.53 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -179.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.517 ' O ' HG21 ' A' ' 115' ' ' VAL . 59.7 mtm-85 -66.03 -40.53 91.1 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.419 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -63.88 -36.57 84.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.997 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.405 HD12 ' HB2' ' A' ' 136' ' ' PHE . 90.6 mt -58.62 -47.18 85.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 74.4 mtp -58.66 -47.45 84.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.978 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.517 HG21 ' O ' ' A' ' 111' ' ' ARG . 98.6 t -58.15 -42.49 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 CA-C-O 120.963 0.411 . . . . 0.0 111.188 178.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -66.81 -44.55 80.91 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.134 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.548 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 50.7 tp -72.66 -31.09 64.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.415 -177.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.433 ' HB2' HG13 ' B' ' 478' ' ' ILE . 32.8 t70 -54.91 -44.05 73.84 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.027 0.441 . . . . 0.0 110.662 176.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.451 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 53.3 mt-30 -67.18 -30.7 70.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.008 -176.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.01 21.92 68.27 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.046 -0.979 . . . . 0.0 113.324 173.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -54.1 -50.09 67.63 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.834 0.35 . . . . 0.0 110.873 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.403 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 23.5 t0 -135.16 66.62 1.52 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.667 0.746 . . . . 0.0 109.367 172.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.572 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -52.74 -30.11 30.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.684 -1.143 . . . . 0.0 111.363 175.929 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.68 -40.3 96.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.807 0.337 . . . . 0.0 111.18 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -78.87 -47.92 15.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.739 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 82.3 mt -56.77 -47.1 80.87 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.635 -175.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' MET . . . . . 0.489 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.5 OUTLIER -56.03 -35.47 66.9 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -177.754 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -83.87 -44.16 14.58 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.114 0.483 . . . . 0.0 110.538 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.523 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.03 -21.17 65.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.025 -176.067 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.548 ' CE2' ' HB2' ' A' ' 117' ' ' LEU . 3.6 m-30 -81.66 -29.15 33.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.875 0.369 . . . . 0.0 111.006 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.454 ' HE2' ' HA ' ' A' ' 131' ' ' MET . 2.7 mmt -77.57 -4.33 45.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.349 -176.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.9 pt20 -100.89 0.2 38.02 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 176.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -105.89 118.42 55.24 Favored Pre-proline 0 N--CA 1.449 -0.516 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.366 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.662 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 19.2 Cg_endo -60.99 -13.24 26.34 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.985 2.456 . . . . 0.0 112.108 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.77 -48.2 48.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.769 173.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.54 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 37.0 t80 -88.62 -29.86 19.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.829 0.347 . . . . 0.0 110.731 -169.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.662 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.9 m -56.52 -45.75 82.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.985 176.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.472 ' N ' HG22 ' A' ' 137' ' ' VAL . 34.5 mm-40 -58.32 -49.31 77.62 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.352 176.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -54.14 -49.43 69.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.961 177.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.743 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.61 -52.73 59.6 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.28 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -62.45 -29.5 70.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.293 0.568 . . . . 0.0 110.44 -174.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 97.6 m -81.11 -46.76 14.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.605 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 29.5 p -65.28 -31.86 73.23 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.4 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.743 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 65.7 mt -59.11 -41.03 87.19 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.693 178.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.41 -28.23 72.71 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.123 -178.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 62.3 mt -80.16 -36.22 16.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-O 121.053 0.454 . . . . 0.0 110.485 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.429 ' HB ' HG21 ' A' ' 87' ' ' VAL . 19.0 m -93.61 7.44 5.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.02 -176.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.618 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 37.1 mt-10 . . . . . 0 C--O 1.233 0.229 0 CA-C-O 120.534 0.207 . . . . 0.0 110.461 174.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 60.5 mt . . . . . 0 CA--C 1.53 0.199 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 70.1 mtm180 -61.33 -46.82 88.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.605 0.717 . . . . 0.0 109.274 177.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -64.72 -48.12 75.8 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.382 177.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.599 ' O ' HG12 ' B' ' 470' ' ' ILE . 40.4 mt-10 -59.36 -47.8 84.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.595 -177.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . 0.489 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 19.8 mtm180 -63.22 -40.76 98.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.73 -25.49 53.57 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -178.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.13 -37.46 79.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.154 171.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.599 HG12 ' O ' ' B' ' 466' ' ' GLU . 36.2 mm -60.01 -36.87 69.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.125 177.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . 0.545 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 93.1 mt -53.24 -49.93 65.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.387 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -63.69 -40.61 97.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.922 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 61.6 m -59.04 -50.89 72.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.025 0.44 . . . . 0.0 110.035 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . 0.629 ' O ' HG12 ' B' ' 478' ' ' ILE . 85.3 t -56.05 -58.45 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.541 175.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' B' ' 471' ' ' LEU . 7.2 ptp180 -71.87 -20.2 61.84 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -169.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.53 -43.84 92.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 171.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 88.5 mt -70.14 -53.71 22.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.139 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . 0.629 HG12 ' O ' ' B' ' 474' ' ' VAL . 10.1 mm -53.3 -31.88 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.664 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 11.7 tppt? -53.23 -38.06 62.62 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.134 -174.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.367 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.474 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 39.8 ptt180 . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 120.872 0.368 . . . . 0.0 110.718 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.405 ' CG2' HG22 ' B' ' 469' ' ' VAL . 88.7 t -109.28 138.02 38.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.5 m -63.57 140.14 58.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.268 0.556 . . . . 0.0 110.887 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.522 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 10.2 tp -58.54 -40.04 81.89 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.05 -177.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -56.71 -37.44 70.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.722 178.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -67.53 -41.73 83.88 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.23 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.458 ' O ' HD13 ' A' ' 95' ' ' LEU . 83.7 mt -69.69 -32.41 71.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.647 -176.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 9.2 mtpm? -62.82 -26.17 68.62 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -69.47 -21.5 63.7 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.734 0.302 . . . . 0.0 111.14 -177.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 92' ' ' LEU . 8.6 mp -64.54 -41.07 96.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.32 -174.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.69 -20.84 68.61 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.439 177.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -89.61 -22.9 22.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.72 0.295 . . . . 0.0 110.911 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.686 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 37.4 t -67.4 111.1 3.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.545 -177.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.31 -26.81 68.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.679 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.3 m -71.87 -48.04 48.63 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.049 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.3 tp -70.7 -46.72 62.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.793 -173.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.686 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -58.56 -29.83 66.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.876 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 33.7 t -67.16 -24.33 65.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.07 0.462 . . . . 0.0 110.049 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.5 mt -84.02 -36.11 23.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.678 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.449 HD21 HD12 ' B' ' 477' ' ' ILE . 11.2 mp -63.86 -22.53 66.96 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.433 177.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 76.7 mt -63.59 -16.86 62.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.971 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -79.47 120.26 79.73 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -62.41 -22.73 74.46 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 123.19 2.593 . . . . 0.0 113.013 -174.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.558 ' NE2' HD11 ' A' ' 113' ' ' LEU . 70.9 t60 -76.32 -48.9 18.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.009 178.099 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.5 tp -61.91 -37.18 83.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.911 0.386 . . . . 0.0 111.148 -175.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -67.83 -22.16 65.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.56 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.408 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 10.8 mm100 -74.98 -43.15 55.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.739 176.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.558 HD11 ' NE2' ' A' ' 109' ' ' HIS . 10.5 mp -52.19 -43.88 64.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.621 0.248 . . . . 0.0 111.352 176.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.416 ' HG2' HG23 ' B' ' 474' ' ' VAL . 55.8 mtm -59.91 -53.7 54.76 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.302 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 26.4 m -68.72 -23.98 28.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 111.518 -177.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -75.84 -51.71 11.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.169 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 60.7 tp -61.05 -34.5 74.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.454 -177.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.433 ' OD2' ' HG2' ' B' ' 475' ' ' ARG . 24.5 t70 -62.66 -35.55 79.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.415 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.563 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 69.0 mt-30 -63.27 -29.6 70.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.498 0.666 . . . . 0.0 111.169 -177.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.92 25.42 71.96 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 114.54 -1.209 . . . . 0.0 114.034 174.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -67.01 -46.47 74.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.295 0.548 . . . . 0.0 110.053 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.514 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 17.8 m-20 -141.63 46.4 1.69 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.697 176.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.61 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -48.32 -32.11 6.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.999 178.371 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.23 -49.89 75.82 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.468 0.175 . . . . 0.0 111.382 -177.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.445 ' HG2' ' HB3' ' A' ' 122' ' ' ASP . 58.6 pttt -75.76 -30.63 59.23 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.143 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 91.9 mt -63.58 -43.67 96.29 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.427 -179.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.6 mmt -50.61 -36.83 36.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.929 0.395 . . . . 0.0 111.169 177.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 30.0 mmm180 -81.74 -47.23 13.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.043 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.561 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.86 -24.34 66.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.972 -176.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.466 ' CE1' ' HB2' ' A' ' 117' ' ' LEU . 3.4 m-30 -78.86 -29.7 44.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.807 0.337 . . . . 0.0 111.098 -178.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.443 ' HE3' ' HA ' ' A' ' 131' ' ' MET . 4.7 mmt -73.51 -10.33 59.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.358 -176.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.3 pt20 -98.99 -15.3 19.13 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.104 -179.116 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.533 ' OE1' HD21 ' A' ' 113' ' ' LEU . 3.7 mt-10 -87.54 119.01 70.55 Favored Pre-proline 0 N--CA 1.451 -0.406 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.604 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 14.1 Cg_endo -56.25 -23.26 44.71 Favored 'Trans proline' 0 CA--C 1.52 -0.185 0 C-N-CA 123.066 2.511 . . . . 0.0 112.453 -173.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.5 mp -72.56 -42.09 65.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.324 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.454 ' CZ ' HG23 ' B' ' 470' ' ' ILE . 31.0 t80 -76.64 -29.97 56.67 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.189 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 133' ' ' GLU . 57.5 t -61.24 -44.7 98.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.048 176.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.604 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 42.0 mt-10 -67.63 -41.34 84.06 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.323 178.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -57.11 -50.93 71.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.11 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.702 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.71 -45.1 87.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.032 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -63.48 -29.77 71.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.381 0.61 . . . . 0.0 110.588 -174.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . 0.446 ' O ' HG13 ' A' ' 146' ' ' ILE . 89.1 m -82.79 -47.86 11.45 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.359 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.514 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 29.1 p -62.92 -32.33 73.6 Favored 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 121.177 -0.209 . . . . 0.0 111.383 -174.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 79.3 mt -65.68 -26.87 67.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.809 0.338 . . . . 0.0 111.092 -178.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -85.87 -14.84 66.53 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.013 177.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 142' ' ' CYS . 32.5 mt -91.63 -42.96 13.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.867 0.365 . . . . 0.0 110.892 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.437 ' CG1' HD12 ' A' ' 95' ' ' LEU . 20.4 m -90.61 7.76 4.1 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.884 -174.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 . . . . . 0 C--N 1.326 -0.417 0 CA-C-O 121.128 0.49 . . . . 0.0 110.53 179.712 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 47.9 mt . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . 0.48 ' HD3' ' N ' ' B' ' 465' ' ' HIS . 0.0 OUTLIER -75.19 -28.94 60.2 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.57 -176.21 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . 0.48 ' N ' ' HD3' ' B' ' 464' ' ' ARG . 13.4 t60 -76.24 -45.33 33.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.132 173.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -63.17 -30.48 71.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . 0.433 ' O ' HD21 ' B' ' 471' ' ' LEU . 32.8 mtp180 -63.31 -55.07 27.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.613 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . 0.475 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -70.93 -18.57 62.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.829 0.823 . . . . 0.0 109.997 -174.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . 0.405 HG22 ' CG2' ' A' ' 87' ' ' VAL . 1.3 t -73.08 -20.2 18.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.52 178.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.462 ' O ' HG22 ' B' ' 474' ' ' VAL . 35.8 mm -72.84 -37.35 54.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 122.188 0.994 . . . . 0.0 108.4 -178.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . 0.547 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.5 OUTLIER -51.28 -48.86 62.11 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 113.166 -1.834 . . . . 0.0 110.546 177.152 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . 0.474 ' NE2' ' HA ' ' A' ' 86' ' ' ARG . 3.6 mm-40 -46.74 -54.23 10.16 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.798 -1.092 . . . . 0.0 110.498 174.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 33.0 m -60.79 -54.11 49.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.668 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . 0.462 HG22 ' O ' ' B' ' 470' ' ' ILE . 75.7 t -48.61 -54.79 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.905 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.584 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 52.2 mtt180 -74.31 -19.8 60.35 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.883 -0.598 . . . . 0.0 112.402 -171.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -74.54 -45.7 43.91 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 172.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . 0.449 HD12 HD21 ' A' ' 105' ' ' LEU . 92.2 mt -64.46 -55.11 23.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.772 -177.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . 0.423 HG13 ' O ' ' B' ' 474' ' ' VAL . 52.4 mt -54.06 -26.18 14.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.059 0.457 . . . . 0.0 111.084 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . 0.584 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 1.6 tppp? -73.04 -42.11 63.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.926 -172.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.694 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.876 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 121.222 0.534 . . . . 0.0 110.486 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 39.7 t -81.84 131.67 33.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.614 -172.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.3 m -63.98 144.82 56.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.468 176.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.528 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.85 -34.22 74.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.705 -173.892 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -61.24 -40.93 95.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.711 -0.222 . . . . 0.0 110.742 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -63.34 -39.42 94.49 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.452 ' HA ' HD13 ' A' ' 95' ' ' LEU . 88.2 mt -69.06 -32.42 71.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.64 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.528 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 97.4 mttt -58.04 -27.32 63.48 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -178.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.42 ' HB2' HG21 ' A' ' 146' ' ' ILE . 24.0 m-80 -72.64 -18.63 61.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.797 0.332 . . . . 0.0 111.277 -178.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.452 HD13 ' HA ' ' A' ' 92' ' ' LEU . 7.4 mp -71.02 -40.58 71.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.113 -175.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -63.05 -21.07 63.33 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.693 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -108.71 6.51 25.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.064 0.459 . . . . 0.0 110.739 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.624 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.9 t -76.96 108.54 10.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.24 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.14 67.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.131 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.1 m -71.7 -43.87 65.18 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.185 0.517 . . . . 0.0 110.78 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.535 HD13 HD13 ' A' ' 104' ' ' LEU . 21.4 tp -71.09 -49.56 43.15 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.446 -171.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.0 ptp180 -57.72 -32.07 67.05 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.327 -179.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 67.5 m -62.95 -40.23 97.02 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.535 HD13 HD13 ' A' ' 101' ' ' LEU . 0.5 OUTLIER -88.56 -15.75 34.35 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.508 -0.877 . . . . 0.0 112.161 -178.965 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.498 HD12 ' O ' ' A' ' 101' ' ' LEU . 8.7 mp -68.74 -12.06 61.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.194 0.521 . . . . 0.0 110.591 171.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 80.1 mt -73.14 -13.42 61.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.021 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -74.03 123.7 89.47 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.865 176.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.5 -30.34 90.52 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.111 2.54 . . . . 0.0 112.763 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -78.77 -41.29 30.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.657 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.525 HD12 ' O ' ' A' ' 104' ' ' LEU . 5.0 tt -63.18 -42.48 99.39 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -68.06 -27.19 66.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.151 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -70.84 -43.07 69.3 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.187 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.443 HD12 ' HB2' ' A' ' 136' ' ' PHE . 85.8 mt -56.11 -51.77 66.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.315 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 59.7 mtp -54.28 -54.15 44.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.829 -179.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.646 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.8 m -65.89 -34.45 70.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.343 -176.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -62.86 -46.36 88.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.086 0.47 . . . . 0.0 110.61 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.436 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 62.7 tp -64.47 -36.39 84.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.621 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.41 -36.74 84.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.802 177.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.646 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 75.7 mt-30 -68.2 -32.15 72.17 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.868 0.842 . . . . 0.0 110.508 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 66.11 27.08 72.63 Favored Glycine 0 N--CA 1.447 -0.567 0 CA-C-N 114.145 -1.389 . . . . 0.0 113.18 175.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.67 -32.38 59.18 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.176 0.512 . . . . 0.0 110.806 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.48 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 15.4 t0 -160.52 69.23 0.37 Allowed 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 168.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.437 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -55.31 -26.77 42.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.007 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.75 -49.39 73.22 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.057 0.456 . . . . 0.0 110.596 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.0 -38.03 66.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.557 178.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 95.4 mt -61.65 -46.67 88.79 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.162 -177.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -54.88 -33.86 62.4 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.006 0.431 . . . . 0.0 111.187 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -79.34 -49.08 12.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.449 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.668 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.45 -27.03 67.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.057 -176.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.579 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.2 m-30 -79.26 -27.54 42.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.877 0.37 . . . . 0.0 111.436 -176.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.482 ' HA ' ' HE1' ' A' ' 131' ' ' MET . 3.3 mmt -86.13 3.42 42.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.821 0.344 . . . . 0.0 111.574 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.668 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.8 pt20 -100.56 -19.61 16.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.039 0.447 . . . . 0.0 109.965 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -105.36 137.45 19.27 Favored Pre-proline 0 N--CA 1.448 -0.548 0 CA-C-O 121.393 0.616 . . . . 0.0 111.688 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.609 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 56.4 Cg_endo -68.45 -11.87 33.19 Favored 'Trans proline' 0 CA--C 1.527 0.144 0 C-N-CA 123.904 3.069 . . . . 0.0 113.974 -173.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 45.5 mt -77.8 -37.62 48.33 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.427 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.579 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 45.5 t80 -88.98 -32.1 17.8 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.573 -173.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.609 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 10.5 m -54.87 -44.89 74.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.831 176.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 25.7 mm-40 -57.62 -50.29 73.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.433 176.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -54.94 -48.93 72.51 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.211 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.752 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.28 -49.55 71.37 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.052 -0.977 . . . . 0.0 111.019 -177.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.71 -31.11 72.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.218 0.532 . . . . 0.0 110.55 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . 0.544 ' O ' HG13 ' A' ' 146' ' ' ILE . 65.4 m -70.61 -47.72 58.72 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.018 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 28.3 p -67.5 -30.98 70.8 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.526 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.752 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.8 mt -65.71 -27.95 68.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.708 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -83.24 -14.67 73.78 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.226 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.544 HG13 ' O ' ' A' ' 142' ' ' CYS . 21.1 mt -91.8 -40.83 12.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.199 0.523 . . . . 0.0 110.505 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.428 ' CG1' HD12 ' A' ' 95' ' ' LEU . 15.3 m -94.75 7.5 6.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.398 -177.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 . . . . . 0 C--O 1.234 0.252 0 CA-C-O 121.369 0.604 . . . . 0.0 112.112 -173.586 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 29.4 mm . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.802 0.334 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -57.76 -35.46 70.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.915 0.388 . . . . 0.0 110.769 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -69.95 -48.9 56.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.962 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.461 ' O ' HG12 ' B' ' 470' ' ' ILE . 6.5 mm-40 -55.91 -50.42 70.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.93 -178.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -59.92 -40.86 90.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.396 -176.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -79.0 -23.46 44.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.382 0.61 . . . . 0.0 109.666 -178.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -65.32 -32.15 56.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.422 173.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.461 HG12 ' O ' ' B' ' 466' ' ' GLU . 26.3 mm -61.94 -29.87 47.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.391 179.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 83.7 mt -63.53 -31.86 73.15 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.881 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -71.7 -35.22 70.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.059 0.457 . . . . 0.0 110.092 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 45.4 m -72.7 -59.08 2.89 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.077 -177.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . 0.415 ' O ' HG13 ' B' ' 478' ' ' ILE . 11.5 p -54.95 -45.34 76.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.085 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.517 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 18.8 tpp85 -65.68 -35.17 80.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.634 0.254 . . . . 0.0 110.96 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.06 -47.88 78.42 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 120.687 0.28 . . . . 0.0 110.65 -179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 50.6 mt -67.55 -55.4 17.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.846 -174.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . 0.415 HG13 ' O ' ' B' ' 474' ' ' VAL . 46.3 mt -58.52 -25.55 28.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.156 -175.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . 0.517 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 22.8 tptp -65.09 -34.6 78.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.219 -173.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . 0.419 ' H ' ' HD2' ' B' ' 480' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.547 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.884 176.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 . . . . . 0 N--CA 1.451 -0.375 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 24.5 t -80.55 134.72 26.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.099 -173.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.1 m -67.58 144.34 55.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.981 176.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.513 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 1.6 tt -62.32 -33.38 74.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.994 -173.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -56.01 -43.66 77.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.665 174.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -68.66 -28.09 66.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.412 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 90.7 mt -78.68 -35.26 45.43 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.622 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 50.1 mtpt -57.72 -29.49 64.77 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -73.22 -18.66 61.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.606 0.241 . . . . 0.0 111.082 -176.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.507 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 82.1 mt -62.67 -47.16 84.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.032 -175.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.93 -15.36 81.03 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.259 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -95.5 -16.0 22.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.15 0.5 . . . . 0.0 110.397 -177.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.607 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 33.0 t -77.49 121.31 23.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.967 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.45 -27.62 67.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.629 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.6 m -69.24 -45.93 68.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.225 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.507 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 38.8 tp -71.11 -46.97 60.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.57 -173.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.607 ' HG2' ' O ' ' A' ' 98' ' ' SER . 8.9 ptp180 -60.29 -27.27 67.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.534 -178.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.6 m -62.99 -22.88 67.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.974 0.416 . . . . 0.0 110.662 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.5 mt -86.57 -34.38 19.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.32 0.581 . . . . 0.0 109.717 178.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.427 HD13 ' O ' ' A' ' 101' ' ' LEU . 9.3 mp -64.1 -18.37 64.34 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.612 178.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 63.7 mt -66.06 -21.02 66.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.293 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -78.39 118.1 70.24 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.265 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.4 -36.66 97.54 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.069 2.512 . . . . 0.0 112.589 178.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.3 t60 -68.29 -44.06 76.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.86 0.362 . . . . 0.0 110.558 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.4 tt -65.59 -46.01 81.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.277 -176.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.413 ' O ' HG22 ' A' ' 115' ' ' VAL . 13.5 ptp180 -64.47 -34.18 77.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.491 -179.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -66.65 -34.97 79.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.947 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.3 mt -59.47 -48.59 81.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.129 0.49 . . . . 0.0 109.717 174.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 68.6 mtp -55.75 -52.09 65.14 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.973 176.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.481 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 84.0 t -60.25 -38.83 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.542 -179.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -64.56 -43.01 95.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.07 0.462 . . . . 0.0 111.071 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 56.4 tp -67.55 -38.41 84.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.57 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -63.97 -27.83 69.4 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.084 0.469 . . . . 0.0 111.375 -175.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.481 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 70.9 mt-30 -63.19 -29.77 71.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.516 0.674 . . . . 0.0 110.785 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.5 29.3 72.93 Favored Glycine 0 CA--C 1.518 0.226 0 CA-C-N 114.551 -1.204 . . . . 0.0 114.239 172.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -73.1 -55.45 6.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.568 0.699 . . . . 0.0 109.526 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -135.16 50.85 2.12 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.502 176.349 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.551 ' HD3' ' N ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -48.68 -37.57 18.89 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 113.505 -1.679 . . . . 0.0 111.961 179.003 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.16 -46.53 77.1 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.908 0.385 . . . . 0.0 110.866 -176.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -65.57 -41.91 92.39 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.183 177.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.509 HD21 ' HH ' ' A' ' 130' ' ' TYR . 95.5 mt -62.63 -43.67 98.22 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.572 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -34.67 65.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.933 0.397 . . . . 0.0 111.142 -178.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.9 mmm180 -77.01 -46.09 25.04 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.007 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.93 -38.65 86.56 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.421 -178.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.509 ' HH ' HD21 ' A' ' 126' ' ' LEU . 3.2 m-30 -72.31 -21.78 61.28 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.865 -174.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.455 ' HA ' ' HE1' ' A' ' 131' ' ' MET . 3.6 mmt -79.43 -1.23 36.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.14 -179.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -98.79 -20.03 17.11 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 175.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -88.17 120.89 70.72 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.733 -175.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.636 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 27.9 Cg_endo -62.2 -14.11 36.13 Favored 'Trans proline' 0 N--CA 1.465 -0.157 0 C-N-CA 122.863 2.375 . . . . 0.0 112.671 -175.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.3 mp -77.32 -40.26 44.88 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.592 176.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.408 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 32.8 t80 -88.74 -31.01 18.63 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.066 -172.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.636 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 16.6 m -58.47 -49.11 83.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.246 177.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.517 ' N ' HG23 ' A' ' 137' ' ' VAL . 11.0 pt-20 -70.96 -36.64 72.64 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.558 179.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -56.29 -48.07 77.36 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 174.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.766 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.46 -49.78 74.07 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.726 178.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -62.09 -30.76 71.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.209 0.528 . . . . 0.0 110.627 -175.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 64.6 m -77.3 -45.29 26.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.537 -179.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.3 p -69.33 -28.11 65.96 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.861 0.362 . . . . 0.0 110.53 -177.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.766 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 83.3 mt -62.13 -31.3 71.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.69 178.163 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.517 ' HA2' ' OE2' ' A' ' 148' ' ' GLU . . . -79.87 -17.69 74.36 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.452 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 49.0 mt -91.16 -26.24 5.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.109 0.48 . . . . 0.0 110.569 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 17.3 m -104.05 -3.43 9.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.599 -177.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.517 ' OE2' ' HA2' ' A' ' 145' ' ' GLY . 12.7 pt-20 . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.255 0.55 . . . . 0.0 110.393 -178.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 47.3 mm . . . . . 0 CA--C 1.528 0.118 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -58.56 -43.36 89.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.886 0.375 . . . . 0.0 110.772 178.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -64.12 -48.83 74.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.067 175.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.579 ' O ' HG12 ' B' ' 470' ' ' ILE . 43.4 mt-10 -60.14 -43.83 95.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.45 -176.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -58.78 -39.97 82.62 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -30.89 60.23 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.5 t -62.46 -35.51 70.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.584 176.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.579 HG12 ' O ' ' B' ' 466' ' ' GLU . 31.6 mm -63.41 -34.85 69.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.493 178.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 82.8 mt -57.44 -42.5 82.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.691 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -62.78 -43.11 99.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.441 177.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 56.1 m -63.65 -55.5 23.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.752 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . 0.458 ' O ' HG13 ' B' ' 478' ' ' ILE . 75.0 t -51.16 -55.7 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.868 178.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -68.85 -32.13 71.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.582 -172.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.14 -47.03 88.13 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 120.962 0.41 . . . . 0.0 109.941 177.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . 0.406 HD12 HD22 ' A' ' 105' ' ' LEU . 79.6 mt -63.54 -53.34 46.4 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.099 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . 0.458 HG13 ' O ' ' B' ' 474' ' ' VAL . 49.9 mt -58.63 -26.76 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.868 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -57.7 -41.31 81.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.736 -179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.24 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.872 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 . . . . . 0 N--CA 1.45 -0.454 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.49 HG22 ' HB ' ' A' ' 147' ' ' VAL . 12.0 p -84.16 154.11 3.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.168 -173.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.7 m -59.36 141.33 54.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.467 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.2 tt -68.03 -30.97 70.32 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.865 -178.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -54.25 -43.97 71.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.48 173.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.442 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 2.8 m-20 -63.31 -35.63 81.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.137 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.401 HD21 ' HA ' ' B' ' 473' ' ' CYS . 44.6 mt -71.01 -34.47 71.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.194 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.561 ' HB3' ' HZ3' ' A' ' 93' ' ' LYS . 9.8 mtpm? -59.64 -24.13 63.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.317 -0.401 . . . . 0.0 112.053 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -77.42 -17.44 58.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.177 -179.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.552 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 91.8 mt -62.7 -46.02 90.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.438 -176.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.66 -18.32 69.99 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.622 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -84.67 -16.19 42.73 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.938 0.399 . . . . 0.0 110.608 -179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.641 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.7 t -78.27 122.07 25.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.084 -176.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.51 -25.2 63.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.428 177.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 97.2 m -72.78 -45.2 59.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.919 178.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.552 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 36.2 tp -69.45 -51.26 37.83 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.766 -172.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.641 ' HG2' ' O ' ' A' ' 98' ' ' SER . 6.2 ptp180 -58.45 -29.5 66.2 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.974 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 33.3 t -62.05 -42.67 99.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -178.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.672 HD23 ' SG ' ' A' ' 142' ' ' CYS . 0.5 OUTLIER -87.96 -16.2 34.46 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.261 -178.608 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.511 HD11 ' O ' ' A' ' 101' ' ' LEU . 9.4 mp -69.36 -12.22 61.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.179 0.514 . . . . 0.0 110.541 171.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 83.1 mt -73.09 -17.63 61.39 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.792 178.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -71.0 118.75 68.44 Favored Pre-proline 0 C--O 1.234 0.256 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.34 -32.37 71.71 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 123.063 2.509 . . . . 0.0 112.755 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -71.56 -49.86 36.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.534 0.206 . . . . 0.0 110.849 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.578 HD23 ' O ' ' A' ' 104' ' ' LEU . 33.2 tp -63.51 -43.17 97.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 120.774 0.321 . . . . 0.0 111.077 -176.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -66.15 -30.59 71.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.182 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.513 HE21 ' HA ' ' A' ' 112' ' ' GLN . 0.0 OUTLIER -72.33 -39.3 68.29 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.654 175.86 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 72.4 mt -56.72 -50.24 72.78 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 57.5 mtp -53.94 -55.51 26.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.904 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.611 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 34.5 m -67.21 -23.89 31.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -176.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 57.3 m-20 -72.22 -38.81 68.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.189 0.519 . . . . 0.0 110.69 177.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.27 -43.61 81.4 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.521 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -61.61 -16.55 49.31 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.604 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.611 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 77.6 mt-30 -74.43 -29.73 61.61 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.4 14.93 60.62 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 114.578 -1.192 . . . . 0.0 113.908 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -55.14 -55.03 35.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.475 0.655 . . . . 0.0 110.186 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -135.09 55.8 1.87 Allowed 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.909 175.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.563 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -49.96 -30.52 10.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.933 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.86 -53.06 61.08 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.724 0.297 . . . . 0.0 111.09 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -75.72 -28.75 58.67 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.494 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.455 HD21 ' CE2' ' A' ' 130' ' ' TYR . 94.6 mt -64.25 -48.71 74.74 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.41 178.016 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.95 -40.21 60.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.951 0.405 . . . . 0.0 111.403 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -79.26 -44.84 20.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.972 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.569 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.99 -26.88 65.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.693 -176.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.455 ' CE2' HD21 ' A' ' 126' ' ' LEU . 4.3 m-30 -76.85 -29.44 55.86 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.93 0.395 . . . . 0.0 110.992 -178.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.424 ' HA ' ' CE ' ' A' ' 131' ' ' MET . 1.4 mmt -76.33 -2.79 33.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.89 -175.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.3 pt20 -103.96 -8.11 19.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.085 0.469 . . . . 0.0 110.416 176.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.466 ' O ' HG23 ' A' ' 137' ' ' VAL . 7.3 mt-10 -95.08 118.85 66.48 Favored Pre-proline 0 N--CA 1.449 -0.522 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 -178.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.481 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 19.7 Cg_endo -58.47 -21.39 53.8 Favored 'Trans proline' 0 CA--C 1.519 -0.244 0 C-N-CA 122.826 2.351 . . . . 0.0 111.976 -177.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.37 -39.02 81.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.28 177.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -87.86 -29.15 21.13 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.225 -178.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 133' ' ' GLU . 86.4 t -62.82 -44.06 99.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.696 177.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 14.0 pt-20 -67.76 -32.88 73.79 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.404 179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . 0.421 ' HB2' HD22 ' A' ' 110' ' ' LEU . 30.6 t80 -61.91 -52.73 62.91 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.062 0.458 . . . . 0.0 109.948 174.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.688 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -59.6 -42.75 93.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.175 -178.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -62.72 -33.04 74.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.418 0.628 . . . . 0.0 110.427 -175.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . 0.672 ' SG ' HD23 ' A' ' 104' ' ' LEU . 89.4 m -75.74 -47.93 23.94 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.167 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.526 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 22.4 p -67.58 -32.81 73.82 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.933 -176.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.688 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.3 mt -69.56 -27.16 64.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.063 -179.099 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -79.29 -20.64 69.09 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.465 -0.874 . . . . 0.0 111.807 177.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 65.5 mt -91.04 -35.89 7.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.84 0.352 . . . . 0.0 111.342 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.49 ' HB ' HG22 ' A' ' 87' ' ' VAL . 30.9 m -83.2 5.24 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.309 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 C--N 1.323 -0.545 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 170.559 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 43.0 mm . . . . . 0 C--O 1.234 0.282 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -70.83 -25.28 62.77 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.198 -176.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . 0.513 ' HD2' ' OE1' ' B' ' 466' ' ' GLU . 49.8 t60 -74.17 -50.92 17.18 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.366 174.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.575 ' O ' HG12 ' B' ' 470' ' ' ILE . 54.7 mm-40 -54.86 -44.63 74.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.07 -175.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -59.0 -35.51 73.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.994 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -31.1 54.94 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -178.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.1 -36.67 78.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.722 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.575 HG12 ' O ' ' B' ' 466' ' ' GLU . 28.3 mm -60.99 -36.91 75.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.346 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 90.3 mt -57.13 -44.24 83.13 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.809 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -62.71 -38.9 92.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.663 177.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . 0.422 ' O ' HG13 ' B' ' 477' ' ' ILE . 60.5 m -66.72 -59.9 3.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.175 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 10.3 p -54.36 -43.78 63.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.04 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 73.6 mtp180 -67.65 -30.29 69.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.523 0.202 . . . . 0.0 111.373 -177.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . 0.407 ' CZ ' ' HE2' ' B' ' 480' ' ' LYS . 0.5 OUTLIER -68.77 -46.83 67.74 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.09 0.471 . . . . 0.0 109.929 176.42 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . 0.422 HG13 ' O ' ' B' ' 473' ' ' CYS . 56.5 mt -64.55 -51.82 62.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.257 -175.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 61.8 mt -56.59 -24.85 19.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.758 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 13.4 ttmm -71.23 -32.85 69.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.87 -173.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . 0.407 ' HE2' ' CZ ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.597 0 C-N-CA 119.795 -0.762 . . . . 0.0 112.308 176.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.0 ptp180 . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.4 p -110.46 160.89 9.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.771 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.0 m -72.41 164.58 26.12 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.783 0.325 . . . . 0.0 111.593 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.424 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -69.82 -38.76 76.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.503 -176.652 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -53.1 -42.05 65.56 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.116 0.484 . . . . 0.0 110.877 177.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.449 ' O ' HG11 ' A' ' 147' ' ' VAL . 3.1 m-20 -67.02 -23.08 65.87 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.999 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.445 ' O ' HD12 ' A' ' 95' ' ' LEU . 81.2 mt -87.17 -34.37 19.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.098 0.475 . . . . 0.0 110.753 177.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 2.6 mmmp? -56.72 -36.51 69.8 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.76 -15.81 61.19 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -174.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 92' ' ' LEU . 8.3 mp -63.46 -42.9 98.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.81 0.338 . . . . 0.0 110.834 -178.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -71.08 -13.26 72.72 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.711 176.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -94.27 -11.3 30.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.238 0.542 . . . . 0.0 109.779 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.641 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.4 t -81.61 113.08 19.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.578 -176.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.83 -25.65 67.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.62 178.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 63.3 m -71.29 -46.06 61.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.054 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.404 HD13 ' CD2' ' A' ' 139' ' ' PHE . 61.1 tp -72.3 -45.98 57.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.563 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.641 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -58.59 -31.05 67.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.116 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 37.6 t -62.54 -22.5 66.36 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.228 0.537 . . . . 0.0 110.423 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.443 HD11 ' SG ' ' A' ' 142' ' ' CYS . 21.7 mt -84.44 -31.71 24.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.876 178.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.24 -2.1 17.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.203 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.28 -18.43 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.836 0.351 . . . . 0.0 110.235 172.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -84.84 115.41 60.78 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.902 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.36 -37.89 92.98 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.776 2.317 . . . . 0.0 111.879 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.469 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 66.7 t60 -60.28 -46.95 88.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.724 177.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.455 HD23 ' O ' ' A' ' 110' ' ' LEU . 4.4 tt -59.67 -40.72 88.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.176 0.512 . . . . 0.0 109.64 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -66.38 -40.32 89.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.447 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.63 -37.18 85.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.675 176.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 109' ' ' HIS . 86.1 mt -58.02 -52.22 66.41 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 175.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 65.5 mtp -53.41 -51.72 61.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.871 176.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.588 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 56.8 t -58.38 -46.65 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.351 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -60.48 -42.8 97.02 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.032 0.444 . . . . 0.0 111.488 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.491 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 54.3 tp -68.01 -36.02 79.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.887 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.12 -24.27 63.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.064 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.588 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 77.4 mt-30 -61.98 -30.65 71.08 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.725 0.774 . . . . 0.0 110.612 177.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.49 25.82 74.67 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 114.336 -1.302 . . . . 0.0 113.368 174.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -76.73 -55.39 5.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.208 0.527 . . . . 0.0 109.826 -178.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.504 ' OD2' ' HE2' ' A' ' 125' ' ' LYS . 4.5 p-10 -135.01 43.12 2.73 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.887 177.052 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.576 ' HD3' ' N ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.59 -35.68 9.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.974 177.054 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.41 -42.16 98.75 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.014 0.435 . . . . 0.0 110.97 -177.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.504 ' HE2' ' OD2' ' A' ' 122' ' ' ASP . 35.7 ttpt -72.79 -44.99 60.86 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.2 0.524 . . . . 0.0 110.059 175.708 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 95.1 mt -56.72 -38.72 72.73 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.326 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.7 mmt -51.2 -40.0 57.74 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 110.959 177.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 24.0 mmm180 -79.32 -40.41 30.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.826 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.573 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.76 -27.28 67.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.692 -177.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.491 ' CE1' ' HB2' ' A' ' 117' ' ' LEU . 3.3 m-30 -81.87 -29.32 32.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.977 0.418 . . . . 0.0 111.21 -176.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.497 ' HE3' ' HA ' ' A' ' 131' ' ' MET . 15.0 mmt -77.32 4.98 9.45 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.539 -177.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 20.7 pt20 -107.07 -9.54 16.16 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.189 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -99.27 120.08 58.95 Favored Pre-proline 0 N--CA 1.452 -0.362 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.769 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.646 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 27.7 Cg_endo -62.38 -13.76 34.75 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.797 2.332 . . . . 0.0 112.224 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.0 mp -72.84 -46.39 53.25 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.611 176.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.488 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 32.3 t80 -87.04 -31.4 20.55 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.493 -169.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.646 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.7 m -56.93 -48.29 81.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.879 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 37.4 mt-10 -65.56 -42.57 91.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.638 178.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . 0.404 ' CD2' HD13 ' A' ' 101' ' ' LEU . 60.0 t80 -53.89 -50.05 67.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.376 0.607 . . . . 0.0 109.609 176.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.748 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.35 -46.32 87.14 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.098 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.31 -28.93 69.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.31 0.576 . . . . 0.0 110.948 -174.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . 0.443 ' SG ' HD11 ' A' ' 104' ' ' LEU . 91.5 m -80.84 -41.83 22.56 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.685 -177.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 27.9 p -69.79 -27.34 64.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.616 0.246 . . . . 0.0 111.151 -177.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.748 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 81.6 mt -59.64 -44.9 93.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.059 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -65.11 -17.66 63.81 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.615 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 20.6 mt -91.7 -31.56 4.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.765 0.316 . . . . 0.0 111.054 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.449 HG11 ' O ' ' A' ' 91' ' ' ASN . 13.6 m -98.48 -17.41 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 . . . . . 0 C--N 1.326 -0.43 0 CA-C-O 120.917 0.389 . . . . 0.0 110.286 178.135 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . 0.572 ' HA ' ' HG2' ' B' ' 466' ' ' GLU . 27.3 mt . . . . . 0 CA--C 1.53 0.174 0 CA-C-O 120.883 0.373 . . . . 0.0 111.596 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -66.89 -35.3 79.7 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . 0.48 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 19.0 t60 -73.38 -47.67 40.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.672 -177.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.588 ' O ' HG12 ' B' ' 470' ' ' ILE . 12.3 pt-20 -63.21 -36.91 85.22 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.779 -176.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -61.77 -40.82 96.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.418 . . . . 0.0 112.039 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . 0.48 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.6 p-10 -81.8 -23.52 36.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -177.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.17 -36.82 77.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.679 173.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.588 HG12 ' O ' ' B' ' 466' ' ' GLU . 26.5 mm -60.58 -34.35 58.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.28 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 73.0 mt -59.61 -43.55 93.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.167 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -62.62 -41.31 98.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.876 177.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 55.1 m -63.42 -57.3 10.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.437 -178.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 98.3 t -51.22 -45.33 31.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.602 175.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.586 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 0.8 OUTLIER -60.74 -42.2 96.87 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.317 -178.17 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -67.07 -45.98 75.7 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.673 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.18 -57.22 10.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.93 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 44.9 mt -60.32 -21.13 21.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.782 0.325 . . . . 0.0 111.253 -177.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . 0.586 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 19.3 tptm -67.91 -42.31 81.33 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.77 -177.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . 0.493 ' HZ1' ' HB2' ' B' ' 480' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.518 0 N-CA-C 112.43 0.529 . . . . 0.0 112.43 -178.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? . . . . . 0 CA--C 1.519 -0.229 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.4 HG23 ' HB ' ' A' ' 147' ' ' VAL . 11.2 p -81.35 148.79 5.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.772 -175.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 25.2 m -55.54 139.9 42.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.227 -176.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.502 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -61.43 -35.95 78.98 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.04 -179.235 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -60.62 -39.95 90.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.65 177.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.411 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 2.7 m-20 -60.71 -38.82 86.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.811 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.2 mt -69.96 -36.62 75.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.054 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 9.2 mtpm? -59.93 -17.79 40.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.21 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -83.29 -17.36 42.79 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.597 0.237 . . . . 0.0 111.378 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 84.8 mt -61.28 -44.22 97.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.83 0.348 . . . . 0.0 111.245 -176.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -71.1 -14.46 73.72 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.384 -179.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -87.94 -18.18 29.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.877 0.37 . . . . 0.0 110.503 -178.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.646 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 28.0 t -80.68 115.81 20.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.763 -177.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.72 -21.47 65.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.48 176.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 29.5 m -74.3 -43.71 55.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.927 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 63.2 tp -73.38 -48.38 34.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.424 -175.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.646 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.8 ptp180 -58.77 -29.6 66.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.072 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 28.9 t -63.11 -31.32 72.43 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-O 121.127 0.489 . . . . 0.0 109.956 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.1 mt -75.45 -38.14 59.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.898 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.8 -17.98 65.15 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.819 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 62.1 mt -65.81 -19.01 65.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.741 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -75.61 120.84 83.52 Favored Pre-proline 0 C--O 1.236 0.352 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 173.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.73 -25.55 79.47 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.674 2.249 . . . . 0.0 112.29 -178.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -71.24 -48.8 48.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.093 178.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 58.2 tp -65.77 -37.27 85.88 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 120.86 0.362 . . . . 0.0 111.103 -175.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -69.15 -27.94 65.99 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.161 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.444 ' HA ' HG22 ' A' ' 115' ' ' VAL . 8.6 mm100 -70.44 -38.85 74.6 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.391 174.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 94.5 mt -59.35 -47.21 86.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.194 0.521 . . . . 0.0 110.054 174.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 69.9 mtp -57.66 -51.95 67.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.668 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.618 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 32.9 m -65.79 -31.51 54.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.516 -177.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -64.69 -45.89 84.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.941 0.401 . . . . 0.0 110.635 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.9 tp -66.69 -40.3 88.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.21 -178.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -63.28 -41.38 98.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.76 -178.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.618 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 48.5 mt-30 -68.76 -29.09 67.4 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.521 0.677 . . . . 0.0 110.592 -177.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 83.15 29.84 32.79 Favored Glycine 0 C--N 1.318 -0.472 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.96 174.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -52.2 -54.62 28.74 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.218 0.533 . . . . 0.0 110.207 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.623 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 9.9 t0 -155.79 65.97 0.6 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 172.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.13 -27.23 53.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.211 -177.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.56 -47.3 86.8 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.105 0.479 . . . . 0.0 110.478 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -75.25 -42.14 55.83 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.662 177.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 87.7 mt -58.45 -44.24 89.15 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.485 -175.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' MET . . . . . 0.425 ' SD ' HD23 ' B' ' 471' ' ' LEU . 0.8 OUTLIER -52.25 -37.83 56.44 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.995 0.426 . . . . 0.0 111.421 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -84.06 -42.38 16.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.81 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.07 -21.64 64.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.983 -176.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.48 ' HH ' HD21 ' A' ' 126' ' ' LEU . 4.4 m-30 -82.77 -26.37 31.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.893 0.377 . . . . 0.0 111.203 -178.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.468 ' HE3' ' HA ' ' A' ' 131' ' ' MET . 2.7 mmt -81.58 3.2 25.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.04 0.448 . . . . 0.0 111.501 -175.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 24.7 pt20 -102.84 -7.15 21.81 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.851 174.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -99.49 122.66 50.88 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.324 -176.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.67 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 28.7 Cg_endo -62.01 -14.54 37.93 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.061 2.507 . . . . 0.0 112.867 -177.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 51.6 mt -82.75 -33.94 27.28 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.316 176.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.46 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 34.7 t80 -89.62 -31.14 17.68 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.107 -176.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.67 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 14.0 m -60.88 -48.44 88.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.08 177.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.459 ' N ' HG21 ' A' ' 137' ' ' VAL . 40.9 mm-40 -66.3 -36.5 83.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.849 176.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -56.46 -49.1 75.62 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 173.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.683 ' HA ' ' SG ' ' A' ' 143' ' ' CYS . . . -64.0 -43.0 96.98 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.507 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.46 -36.55 73.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.375 0.607 . . . . 0.0 110.292 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 65.1 m -77.05 -49.82 14.49 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.08 -0.963 . . . . 0.0 111.403 -179.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.683 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.5 p -64.21 -36.84 85.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.775 -176.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 46.2 mt -67.95 -34.58 76.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.409 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -73.92 -17.12 79.28 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.163 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 82.4 mt -90.97 -49.02 13.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.689 0.28 . . . . 0.0 110.775 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.411 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 16.3 m -86.62 1.8 5.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 -172.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 . . . . . 0 C--N 1.325 -0.461 0 CA-C-O 120.94 0.4 . . . . 0.0 111.266 179.01 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 65.9 mt . . . . . 0 C--O 1.225 -0.201 0 CA-C-O 120.754 0.311 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -56.37 -44.15 79.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.689 178.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . 0.557 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 58.7 t60 -67.71 -45.29 75.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.778 176.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -60.14 -38.45 83.11 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.566 -179.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 21.6 ttp180 -67.95 -42.92 80.22 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.713 -176.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . 0.557 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.6 p-10 -76.66 -16.51 59.52 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.675 0.75 . . . . 0.0 110.047 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . 0.485 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 1.4 t -74.67 -21.76 17.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.286 177.195 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . . . . . . . . . 36.8 mm -68.94 -32.82 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-O 122.338 1.066 . . . . 0.0 109.062 -175.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . 0.566 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.6 OUTLIER -50.96 -54.83 20.9 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 113.017 -1.901 . . . . 0.0 110.768 179.145 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . 0.485 ' NE2' ' HA ' ' B' ' 469' ' ' VAL . 2.4 mp0 -50.83 -44.81 59.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.938 176.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 50.6 m -62.81 -56.36 18.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.511 -179.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 92.4 t -52.01 -53.88 16.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.016 178.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.455 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 50.2 mtp180 -72.65 -27.33 62.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.623 -171.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -67.17 -46.63 73.38 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.053 0.454 . . . . 0.0 109.867 176.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 79.3 mt -63.03 -54.92 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.729 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 41.9 mt -56.33 -28.16 25.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.047 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 25.3 tptp -56.94 -39.46 74.55 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.976 -177.081 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.524 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.029 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 71.5 mtm180 . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.6 p -99.83 155.79 4.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.455 -174.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.0 m -69.29 151.82 45.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.244 0.545 . . . . 0.0 111.204 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.412 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -63.79 -33.38 75.53 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.905 -174.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -56.35 -39.66 73.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.864 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -68.6 -37.87 80.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.54 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.9 -36.95 78.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.983 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 98.4 mttt -58.76 -27.08 64.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.742 178.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -72.53 -18.02 61.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.162 -178.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.431 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 94.0 mt -61.98 -54.41 42.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.161 -177.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -63.02 -21.22 63.43 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 121.145 -0.55 . . . . 0.0 113.07 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -76.35 -20.72 56.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.02 0.438 . . . . 0.0 110.744 -178.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.45 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 15.0 m -89.0 117.13 27.8 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.706 -175.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.16 -27.68 68.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.584 -176.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 60.3 m -70.03 -42.67 72.65 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.092 -178.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.431 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 43.6 tp -69.84 -49.77 49.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.539 -176.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.612 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 8.1 ptp180 -60.35 -27.23 67.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.649 -177.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.5 t -61.36 -28.98 69.61 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.368 0.604 . . . . 0.0 109.858 176.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.6 mt -80.18 -32.02 38.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.965 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.433 HD23 HD12 ' B' ' 477' ' ' ILE . 9.5 mp -66.56 -22.56 66.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.551 0.691 . . . . 0.0 110.173 177.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 63.4 mt -72.97 -9.15 58.41 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.997 -179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -79.84 121.23 82.03 Favored Pre-proline 0 C--O 1.233 0.236 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 175.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -63.16 -19.9 69.76 Favored 'Trans proline' 0 CA--C 1.528 0.218 0 C-N-CA 122.777 2.318 . . . . 0.0 112.679 -179.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.51 ' O ' ' HB2' ' A' ' 112' ' ' GLN . 71.1 t60 -81.87 -49.89 9.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.717 0.294 . . . . 0.0 110.746 175.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.41 HD12 ' HB2' ' A' ' 139' ' ' PHE . 2.6 tt -62.93 -41.84 99.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.488 -174.366 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -61.77 -29.94 70.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.515 177.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.51 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 6.6 mm-40 -64.15 -49.19 73.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.262 175.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.558 HD22 ' OE2' ' A' ' 133' ' ' GLU . 8.9 mp -52.04 -44.97 64.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.948 0.404 . . . . 0.0 110.646 174.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 73.9 mtp -57.45 -59.28 5.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.199 178.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.653 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 26.4 m -66.49 -27.62 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.652 -175.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -71.2 -53.53 14.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.976 0.417 . . . . 0.0 110.986 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 59.7 tp -62.11 -39.56 92.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.011 -176.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -66.71 -27.94 68.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.66 -0.246 . . . . 0.0 111.653 -173.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.653 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 72.6 mt-30 -64.06 -29.66 70.78 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.682 0.754 . . . . 0.0 110.374 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.71 29.04 72.72 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.603 173.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.31 -49.5 27.19 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 5.4 m-20 -136.72 42.61 2.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.944 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.586 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.99 -33.05 7.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.576 -1.193 . . . . 0.0 112.377 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -56.26 -55.6 31.35 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.682 0.277 . . . . 0.0 111.667 -176.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -75.04 -29.98 60.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.782 0.325 . . . . 0.0 110.375 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.451 HD21 ' HH ' ' A' ' 130' ' ' TYR . 97.6 mt -65.73 -40.9 92.64 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.875 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -34.54 64.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.067 0.46 . . . . 0.0 110.64 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -78.87 -49.7 12.45 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.005 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.512 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.09 -16.54 64.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.345 -175.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.451 ' HH ' HD21 ' A' ' 126' ' ' LEU . 3.4 m-30 -88.75 -28.75 20.3 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.765 0.317 . . . . 0.0 111.059 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.416 ' HE2' ' HA ' ' A' ' 131' ' ' MET . 3.2 mmt -71.14 -4.95 28.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.407 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 28.3 pt20 -98.76 -18.44 17.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.258 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.558 ' OE2' HD22 ' A' ' 113' ' ' LEU . 4.2 mt-10 -88.86 123.06 68.49 Favored Pre-proline 0 CA--C 1.515 -0.387 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -176.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.403 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 12.6 Cg_endo -55.88 -25.1 50.91 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.169 2.58 . . . . 0.0 112.604 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.31 -45.22 66.69 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.201 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -73.74 -31.68 63.48 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -178.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 133' ' ' GLU . 82.9 t -62.54 -42.77 97.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.336 176.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 8.3 mm-40 -66.67 -45.91 77.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.341 175.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . 0.41 ' HB2' HD12 ' A' ' 110' ' ' LEU . 69.8 t80 -57.54 -48.64 78.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.646 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.773 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.76 -49.52 74.7 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.111 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -60.21 -33.84 72.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.413 0.625 . . . . 0.0 110.294 -176.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . 0.448 ' O ' HG13 ' A' ' 146' ' ' ILE . 99.6 m -69.56 -50.3 46.04 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.723 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.0 p -69.49 -29.06 66.62 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.638 -176.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.773 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.6 mt -60.89 -40.32 92.59 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.061 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -74.05 -29.78 62.17 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.414 -0.898 . . . . 0.0 111.985 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 142' ' ' CYS . 62.6 mt -77.5 -37.05 24.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.67 -0.265 . . . . 0.0 111.234 -177.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 143' ' ' CYS . 23.0 m -87.33 2.92 5.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.399 -178.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.609 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 19.0 mm-40 . . . . . 0 C--N 1.324 -0.52 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 168.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . 0.426 ' HA ' ' HB2' ' B' ' 466' ' ' GLU . 65.7 mt . . . . . 0 N--CA 1.455 -0.179 0 N-CA-C 111.465 0.172 . . . . 0.0 111.465 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -55.25 -49.81 71.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.312 0.577 . . . . 0.0 109.444 174.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . 0.45 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 29.0 t60 -70.24 -45.45 66.46 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.165 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.426 ' HB2' ' HA ' ' B' ' 463' ' ' ILE . 39.5 mt-10 -64.19 -22.83 67.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.242 -174.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 38.9 ttt180 -80.15 -41.38 25.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 178.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . 0.45 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -84.47 -17.48 38.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.534 0.683 . . . . 0.0 110.597 -174.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 3.4 p -78.3 -19.39 13.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.343 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . . . . . . . . . 39.4 mm -69.11 -31.07 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 122.427 1.108 . . . . 0.0 108.737 -175.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . 0.568 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.6 OUTLIER -54.81 -52.63 62.1 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 112.929 -1.941 . . . . 0.0 110.284 179.358 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -53.09 -44.5 67.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.932 174.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 50.7 m -61.28 -55.52 30.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.433 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 94.1 t -51.67 -51.58 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.908 176.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -64.6 -40.75 96.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.616 -173.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.47 -43.57 96.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 0.0 110.447 178.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . 0.433 HD12 HD23 ' A' ' 105' ' ' LEU . 78.2 mt -65.57 -55.42 19.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.274 -178.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 47.0 mt -56.97 -25.14 21.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.067 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -58.89 -47.06 86.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.111 -176.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . 0.441 ' H ' ' HD2' ' B' ' 480' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.651 0 C-N-CA 119.903 -0.719 . . . . 0.0 112.073 -179.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 . . . . . 0 N--CA 1.45 -0.446 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 45.2 t -98.6 128.74 49.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.863 0.363 . . . . 0.0 110.502 -175.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.0 m -68.74 150.07 48.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.526 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.456 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.62 -34.41 74.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.374 -173.842 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -60.05 -39.89 87.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 0.0 110.296 178.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.41 -38.83 81.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.098 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.443 ' HA ' HD11 ' A' ' 95' ' ' LEU . 94.3 mt -69.46 -35.17 75.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.934 -177.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 96.6 mttt -59.31 -30.99 68.75 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -177.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -68.58 -19.59 64.48 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.513 0.196 . . . . 0.0 111.148 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.443 HD11 ' HA ' ' A' ' 92' ' ' LEU . 8.7 mp -64.1 -39.15 93.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.955 0.407 . . . . 0.0 110.623 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -72.48 -19.12 78.8 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.597 175.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -83.86 -24.6 30.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.032 0.444 . . . . 0.0 110.371 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.643 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 48.3 t -77.39 111.73 13.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.77 -177.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.2 -21.31 62.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.313 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 58.8 m -71.43 -46.79 59.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.96 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.5 HD13 ' CD1' ' A' ' 139' ' ' PHE . 59.5 tp -68.25 -51.08 49.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.968 -175.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.643 ' HG2' ' O ' ' A' ' 98' ' ' SER . 6.3 ptp180 -59.96 -28.19 67.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.682 -178.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.411 ' HA ' HD22 ' A' ' 106' ' ' LEU . 33.7 t -62.2 -23.62 66.73 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.095 0.474 . . . . 0.0 110.399 178.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.3 mt -82.38 -24.79 34.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.028 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' A' ' 102' ' ' ARG . 10.2 mp -75.74 -8.68 57.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.51 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 103' ' ' SER . 4.4 mm? -67.48 -22.92 65.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.889 172.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -71.25 113.88 23.02 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.858 177.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' A' ' 111' ' ' ARG . 25.1 Cg_endo -61.68 -24.29 77.48 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.938 2.425 . . . . 0.0 112.846 -175.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 47.1 t60 -78.47 -42.46 29.71 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.824 0.345 . . . . 0.0 110.376 177.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.413 HD23 ' O ' ' A' ' 110' ' ' LEU . 3.6 tt -65.36 -42.97 92.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.035 -176.544 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.436 ' HD3' ' HA ' ' A' ' 108' ' ' PRO . 12.7 ptm180 -67.56 -31.62 71.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.648 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.425 HE21 ' HA ' ' A' ' 112' ' ' GLN . 0.0 OUTLIER -63.52 -43.02 98.39 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.426 173.545 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 86.0 mt -57.34 -49.34 76.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 75.0 mtp -54.89 -49.32 71.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.073 177.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 45.8 t -60.56 -39.9 82.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.032 0.444 . . . . 0.0 111.343 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.485 ' HA ' ' NE2' ' A' ' 119' ' ' GLN . 74.4 m-20 -68.32 -38.61 81.73 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.268 -178.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.544 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 59.7 tp -73.66 -44.66 56.19 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.61 -178.194 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.437 ' OD1' ' HD3' ' B' ' 475' ' ' ARG . 30.9 t70 -71.0 -27.99 64.09 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -171.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.485 ' NE2' ' HA ' ' A' ' 116' ' ' ASN . 11.0 pt20 -68.29 -17.54 64.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.279 0.562 . . . . 0.0 110.675 178.26 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 67.39 29.42 74.16 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.442 -0.799 . . . . 0.0 113.864 170.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -76.87 -51.99 10.27 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.954 0.377 . . . . 0.0 111.167 179.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.44 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 17.6 m-20 -132.89 37.06 3.46 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.252 0.549 . . . . 0.0 110.518 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.574 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -46.11 -34.29 4.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.557 -1.201 . . . . 0.0 112.521 179.269 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.2 -46.9 88.14 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.834 0.349 . . . . 0.0 111.462 -176.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 122' ' ' ASP . 3.9 mppt? -81.44 -35.33 30.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.138 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 85.4 mt -59.8 -44.25 94.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.046 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' MET . . . . . 0.459 ' HB3' ' NH2' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -54.75 -29.85 54.92 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.796 0.331 . . . . 0.0 111.822 179.314 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -83.19 -50.32 8.56 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.98 0.419 . . . . 0.0 110.441 176.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.737 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.34 -29.97 71.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.104 -176.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.584 ' HB3' ' CD1' ' A' ' 136' ' ' PHE . 3.5 m-30 -73.37 -21.92 60.41 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 122.172 -0.33 . . . . 0.0 111.367 -177.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.485 ' HE3' ' HA ' ' A' ' 131' ' ' MET . 3.3 mmt -85.19 -5.26 59.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.899 0.38 . . . . 0.0 110.892 -177.125 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.737 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.6 pt20 -103.6 -6.63 21.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.896 0.379 . . . . 0.0 110.22 176.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.508 ' O ' HG22 ' A' ' 137' ' ' VAL . 4.1 mt-10 -92.31 120.3 67.68 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.184 -177.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.513 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 22.5 Cg_endo -60.74 -21.0 68.32 Favored 'Trans proline' 0 N--CA 1.464 -0.21 0 C-N-CA 122.754 2.303 . . . . 0.0 112.339 -175.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 63.4 mt -82.08 -43.96 17.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.706 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.584 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 47.1 t80 -73.48 -31.21 63.63 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.601 -0.44 . . . . 0.0 109.998 -177.018 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.508 HG22 ' O ' ' A' ' 133' ' ' GLU . 78.0 t -60.67 -39.98 83.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.483 176.627 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 17.7 mm-40 -63.18 -46.67 86.0 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.965 0.412 . . . . 0.0 110.129 177.373 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . 0.5 ' CD1' HD13 ' A' ' 101' ' ' LEU . 58.7 t80 -57.93 -50.23 74.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.376 178.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.754 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.45 -48.69 74.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.497 -176.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -63.99 -30.33 71.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.159 0.504 . . . . 0.0 110.295 -176.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 61.4 m -70.27 -51.07 33.28 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.819 178.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.431 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 24.3 p -66.7 -25.2 66.42 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.242 -176.222 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.754 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 79.1 mt -57.42 -44.0 84.27 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.913 0.387 . . . . 0.0 110.805 177.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.414 ' O ' ' HG2' ' A' ' 148' ' ' GLU . . . -76.75 -14.59 82.39 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.309 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 41.1 mt -91.46 -29.32 4.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.751 0.31 . . . . 0.0 111.026 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 23.0 m -100.64 5.3 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 CA-C-O 120.698 0.285 . . . . 0.0 110.559 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 145' ' ' GLY . 4.9 pt-20 . . . . . 0 N--CA 1.441 -0.89 0 CA-C-O 121.321 0.582 . . . . 0.0 109.704 178.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 77.6 mt . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . 0.523 ' HD2' ' H ' ' B' ' 464' ' ' ARG . 0.0 OUTLIER -76.74 -29.43 56.17 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.608 -0.837 . . . . 0.0 109.901 -175.31 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . 0.568 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 45.2 t60 -65.55 -48.28 72.99 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.524 171.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.407 ' O ' HG12 ' B' ' 470' ' ' ILE . 37.8 mt-10 -62.48 -22.36 66.19 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.407 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . 0.465 ' HG2' ' SD ' ' A' ' 131' ' ' MET . 28.4 mtp-105 -79.0 -44.78 21.57 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 176.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . 0.568 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -78.53 -19.68 52.39 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.411 -175.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . 0.468 HG11 ' O ' ' B' ' 465' ' ' HIS . 31.4 m -71.28 -22.51 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.973 0.416 . . . . 0.0 110.523 176.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.407 HG12 ' O ' ' B' ' 466' ' ' GLU . 31.3 mm -66.42 -30.75 50.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.886 177.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 77.8 mt -60.3 -38.09 82.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.789 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . 0.423 ' NE2' ' HA ' ' B' ' 469' ' ' VAL . 2.2 mp0 -68.44 -40.0 81.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.067 0.461 . . . . 0.0 110.102 176.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.5 m -62.15 -57.29 12.09 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.509 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 96.3 t -53.08 -49.6 49.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.514 176.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.509 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 1.8 tpp180 -59.87 -44.27 94.26 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.689 0.281 . . . . 0.0 111.259 -175.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -62.49 -47.06 85.65 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.8 -177.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 72.1 mt -65.6 -54.5 27.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.146 -178.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 11.2 mt -57.02 -28.89 30.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.182 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 21.5 tptm -59.13 -40.25 84.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.053 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.433 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.258 -179.129 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 121.042 0.449 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.449 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 61.8 t -101.46 139.88 21.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.631 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.427 ' O ' ' HB2' ' A' ' 91' ' ' ASN . 30.1 m -59.82 134.77 57.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.998 0.427 . . . . 0.0 110.196 178.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.515 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 3.9 tt -65.02 -33.64 76.52 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.642 -173.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -58.51 -37.78 76.31 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.396 175.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.44 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 4.1 m-20 -65.49 -38.57 90.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.988 176.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 78.1 mt -68.89 -34.01 74.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.177 -178.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 56.7 mtpt -59.66 -24.47 63.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.081 -179.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -74.54 -19.28 60.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.215 -0.194 . . . . 0.0 111.206 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.36 -42.78 99.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.932 0.396 . . . . 0.0 110.915 -177.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.45 -9.84 81.96 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.441 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -103.06 -24.47 13.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.658 0.266 . . . . 0.0 111.34 -178.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.529 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 23.8 p -71.42 115.92 11.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.921 -176.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.07 -26.96 69.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.308 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 35.9 m -70.17 -44.34 68.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.887 0.375 . . . . 0.0 110.937 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 46.5 tp -72.23 -49.13 37.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.522 -174.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 98' ' ' SER . 2.4 ptp180 -58.43 -29.56 66.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.17 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 34.0 t -65.71 -22.82 66.65 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.918 0.39 . . . . 0.0 110.256 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 24.2 mt -84.2 -28.37 27.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.226 0.536 . . . . 0.0 109.65 178.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.534 ' O ' ' HD2' ' A' ' 111' ' ' ARG . 9.7 mp -74.03 2.64 8.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.154 178.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -75.7 -19.73 58.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.893 0.378 . . . . 0.0 110.056 171.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -80.17 114.36 46.22 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.572 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -55.82 -39.77 89.16 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.501 2.801 . . . . 0.0 113.137 -177.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -69.03 -41.42 77.71 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.762 0.315 . . . . 0.0 110.624 -178.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.426 ' O ' HD21 ' A' ' 110' ' ' LEU . 3.8 tt -60.45 -41.53 94.27 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.534 ' HD2' ' O ' ' A' ' 105' ' ' LEU . 57.1 mtp85 -62.78 -44.28 96.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.912 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.81 -24.81 67.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.497 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 65.7 mt -79.16 -51.58 9.33 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 121.646 0.736 . . . . 0.0 109.079 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.481 ' HG3' HG11 ' B' ' 474' ' ' VAL . 44.0 ttp -59.55 -43.86 93.41 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.39 -1.277 . . . . 0.0 111.211 -177.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.476 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.4 m -68.01 -23.98 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.88 0.372 . . . . 0.0 111.744 -178.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 28.2 m-20 -72.69 -42.35 64.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.282 0.563 . . . . 0.0 110.673 177.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 27.9 tp -60.42 -37.27 80.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.041 -177.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -67.53 -32.22 72.86 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.867 0.365 . . . . 0.0 110.979 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.476 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 68.8 mt-30 -60.75 -28.89 69.04 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.497 -178.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . 0.526 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 70.51 20.54 77.16 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.039 -0.982 . . . . 0.0 114.06 169.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -69.01 -50.59 47.5 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.451 0.643 . . . . 0.0 109.691 -178.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.463 ' OD2' ' HE2' ' A' ' 125' ' ' LYS . 13.4 p-10 -141.01 40.21 1.8 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.648 179.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.615 ' HD2' ' H ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -52.78 -26.99 16.0 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.794 -1.094 . . . . 0.0 112.033 179.429 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.615 ' H ' ' HD2' ' A' ' 123' ' ' LYS . . . -67.6 -39.13 84.8 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.25 0.547 . . . . 0.0 110.137 -177.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.511 ' C ' ' HD2' ' A' ' 125' ' ' LYS . 5.1 tmmm? -79.45 -45.03 20.2 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.07 177.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.407 HD22 ' CE1' ' A' ' 130' ' ' TYR . 94.5 mt -56.25 -38.11 70.68 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.463 -178.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.58 -44.89 56.94 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.953 0.406 . . . . 0.0 111.385 177.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -84.18 -36.34 22.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.801 -178.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -70.24 -16.81 63.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.638 -178.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.463 ' HB3' ' CD1' ' A' ' 136' ' ' PHE . 7.3 m-30 -87.45 -22.1 25.16 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.934 0.397 . . . . 0.0 110.737 178.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.471 ' HE2' ' HA ' ' A' ' 131' ' ' MET . 5.8 mmt -77.85 -6.11 53.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.963 -177.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.9 pt20 -99.59 -4.23 31.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.948 0.404 . . . . 0.0 110.235 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.514 ' O ' HG21 ' A' ' 137' ' ' VAL . 3.9 mt-10 -104.65 119.89 52.15 Favored Pre-proline 0 N--CA 1.452 -0.356 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.461 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 16.1 Cg_endo -57.11 -24.53 58.9 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.976 2.451 . . . . 0.0 112.363 -175.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.419 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.1 mp -67.01 -51.66 52.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.347 -179.304 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.463 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 27.7 t80 -75.64 -28.04 58.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -174.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.514 HG21 ' O ' ' A' ' 133' ' ' GLU . 99.4 t -59.38 -43.26 89.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.331 175.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 44.8 mt-10 -64.74 -46.85 80.48 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.818 0.342 . . . . 0.0 110.173 178.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -56.98 -47.09 81.61 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.556 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.691 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -68.16 -45.55 73.21 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.72 -176.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.73 -32.47 73.79 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.996 0.427 . . . . 0.0 110.331 -176.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 91.2 m -77.01 -42.77 37.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.686 -176.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.417 ' HA ' HD12 ' A' ' 146' ' ' ILE . 27.8 p -64.95 -27.07 68.59 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.212 -177.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.691 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 82.2 mt -63.2 -39.34 94.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.767 0.318 . . . . 0.0 110.927 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -74.25 -14.76 80.43 Favored Glycine 0 C--O 1.225 -0.418 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.088 178.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.417 HD12 ' HA ' ' A' ' 143' ' ' CYS . 50.7 mt -90.78 -40.34 12.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.972 0.415 . . . . 0.0 110.493 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.44 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 29.7 m -87.15 12.57 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.883 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 7.7 pt-20 . . . . . 0 C--O 1.236 0.342 0 O-C-N 124.115 0.885 . . . . 0.0 112.146 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . 0.488 ' O ' ' HG3' ' B' ' 467' ' ' ARG . 71.5 mt . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 120.36 0.124 . . . . 0.0 111.329 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . 0.502 ' HD2' ' C ' ' B' ' 464' ' ' ARG . 1.4 ppt_? -70.63 -37.53 73.81 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -177.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . 0.538 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 49.8 t60 -65.88 -46.92 76.61 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.387 176.179 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.628 ' O ' HG12 ' B' ' 470' ' ' ILE . 39.7 mt-10 -58.91 -36.5 74.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.695 -179.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' B' ' 463' ' ' ILE . 19.1 mtm180 -66.67 -46.8 74.48 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . 0.538 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.9 p-10 -75.16 -19.01 60.07 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.934 -177.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.0 t -66.8 -34.88 72.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.347 170.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.628 HG12 ' O ' ' B' ' 466' ' ' GLU . 35.1 mm -65.12 -29.63 47.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 96.8 mt -56.05 -41.17 74.61 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.598 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . 0.449 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.4 mp0 -64.79 -44.11 91.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.76 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . 0.415 ' O ' HG13 ' B' ' 477' ' ' ILE . 42.6 m -63.01 -52.95 60.97 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.268 0.556 . . . . 0.0 110.626 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . 0.481 HG11 ' HG3' ' A' ' 114' ' ' MET . 24.5 t -56.45 -55.11 20.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.663 178.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.626 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 53.2 mtm180 -68.99 -20.18 64.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.232 -174.64 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -73.82 -55.28 6.41 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.193 176.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . 0.415 HG13 ' O ' ' B' ' 473' ' ' CYS . 62.2 mt -60.54 -59.15 4.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-O 120.917 0.389 . . . . 0.0 111.242 -173.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . 0.45 ' CD1' ' HA ' ' A' ' 115' ' ' VAL . 46.3 mt -53.71 -30.49 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.872 -176.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . 0.626 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 1.5 ttmm -81.65 -19.04 42.53 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -166.214 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 C-N-CA 118.946 -1.102 . . . . 0.0 112.659 167.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.2 ptt180 . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 121.042 0.449 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.581 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 48.8 t -109.72 136.0 46.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.58 -175.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.593 ' OG ' ' HG2' ' A' ' 90' ' ' GLN . 37.0 t -63.25 144.02 57.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.565 176.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.42 -21.36 66.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.846 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.593 ' HG2' ' OG ' ' A' ' 88' ' ' SER . 11.6 pt20 -66.5 -39.88 88.94 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 177.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -69.79 -35.24 74.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.11 177.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.3 mt -70.31 -37.94 74.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.763 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -61.73 -22.53 65.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.814 0.34 . . . . 0.0 111.849 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -78.69 -17.98 55.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.535 -178.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 95.9 mt -61.31 -47.07 87.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.698 -179.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -69.35 -12.21 65.87 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.744 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -86.44 -24.45 25.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.738 0.304 . . . . 0.0 110.899 -177.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.559 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 82.0 p -80.43 124.58 29.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.96 0.409 . . . . 0.0 110.432 -177.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.22 -26.65 65.82 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.075 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.7 m -68.22 -48.14 65.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.067 -178.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -67.8 -49.99 59.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.463 -175.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.559 ' HG2' ' O ' ' A' ' 98' ' ' SER . 7.9 ptp180 -60.63 -27.87 68.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.402 -178.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.3 t -68.62 -23.35 64.43 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.275 0.56 . . . . 0.0 110.001 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.1 mt -81.33 -32.51 32.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.811 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.8 mp -72.19 -5.29 34.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.349 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 57.1 mt -76.69 -8.31 57.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.229 176.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -87.48 117.84 69.08 Favored Pre-proline 0 C--N 1.332 -0.157 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 173.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -58.52 -32.15 95.88 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.825 2.35 . . . . 0.0 112.613 -178.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.8 t60 -66.86 -43.45 83.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.96 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 54.3 tp -63.3 -35.3 79.89 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.913 0.387 . . . . 0.0 110.008 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 -59.92 -42.97 95.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.075 177.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.543 HE21 ' HA ' ' A' ' 112' ' ' GLN . 0.0 OUTLIER -64.26 -45.61 87.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.13 178.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.409 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 91.9 mt -56.3 -47.04 79.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.155 0.502 . . . . 0.0 110.351 178.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.445 ' HB3' HG13 ' B' ' 474' ' ' VAL . 71.4 mtp -58.75 -50.82 72.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.926 177.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.592 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 52.2 t -59.27 -41.97 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 120.804 0.335 . . . . 0.0 111.301 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -64.28 -45.24 88.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.262 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 48.5 tp -67.02 -39.94 87.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.298 -177.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.465 ' CB ' HD11 ' B' ' 478' ' ' ILE . 16.9 t70 -62.39 -33.53 74.95 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.961 -175.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 63.1 mt-30 -60.26 -26.86 66.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.265 0.555 . . . . 0.0 110.501 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . 0.474 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 68.2 23.67 74.74 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.096 -0.956 . . . . 0.0 114.075 170.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -78.9 -45.83 19.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.132 0.491 . . . . 0.0 110.029 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.472 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 10.4 m-20 -132.44 31.65 4.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.756 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.633 ' HD2' ' N ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -53.22 -28.02 24.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.184 -0.916 . . . . 0.0 112.099 -179.013 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.633 ' N ' ' HD2' ' A' ' 123' ' ' LYS . . . -64.11 -38.43 91.03 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.369 0.604 . . . . 0.0 110.753 -175.455 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -87.21 -42.02 13.28 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.004 179.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.519 HD21 ' HH ' ' A' ' 130' ' ' TYR . 86.2 mt -55.0 -42.04 72.02 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.404 -178.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.62 -41.53 55.04 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -82.34 -39.79 22.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.511 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.402 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.48 -32.28 73.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.251 -178.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.519 ' HH ' HD21 ' A' ' 126' ' ' LEU . 3.4 m-30 -78.34 -17.35 56.65 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.01 -177.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.451 ' HE2' ' HA ' ' A' ' 131' ' ' MET . 3.6 mmt -76.85 -4.22 42.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.251 -177.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 8.0 pt20 -88.38 -20.01 25.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.104 0.478 . . . . 0.0 109.854 175.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -92.2 121.66 66.23 Favored Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.658 -172.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.676 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 28.4 Cg_endo -63.17 -14.06 39.44 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.107 2.538 . . . . 0.0 112.502 -178.223 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 52.7 mt -80.04 -34.6 38.13 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.88 177.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -89.58 -35.01 16.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.227 -175.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.676 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.8 m -57.62 -48.68 82.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.223 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.459 ' N ' HG23 ' A' ' 137' ' ' VAL . 27.3 mm-40 -61.34 -42.15 98.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.423 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -57.19 -50.96 71.22 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.219 0.533 . . . . 0.0 109.665 176.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.766 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.06 -45.37 92.53 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.976 179.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -63.02 -32.86 74.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.286 0.565 . . . . 0.0 110.493 -175.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 90.9 m -79.69 -44.87 20.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.611 -177.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.45 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -66.4 -28.27 68.5 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.157 -175.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.766 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.9 mt -58.82 -51.03 71.74 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.688 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.12 -21.45 65.99 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.322 -176.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 52.3 mt -86.99 -35.15 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.676 0.274 . . . . 0.0 110.853 -179.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 18.7 m -95.88 -5.75 10.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -175.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 25.0 mt-10 . . . . . 0 C--N 1.327 -0.373 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.949 175.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . 0.456 ' O ' ' HD2' ' B' ' 467' ' ' ARG . 50.3 mm . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -58.87 -47.39 85.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.237 0.542 . . . . 0.0 110.398 177.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . 0.495 ' HD2' ' OE1' ' B' ' 466' ' ' GLU . 46.6 t60 -64.47 -43.11 95.23 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.051 178.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.495 ' OE1' ' HD2' ' B' ' 465' ' ' HIS . 7.9 mm-40 -63.59 -22.67 67.02 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.408 -178.448 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . 0.549 ' HA ' ' HE ' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -84.14 -41.19 17.32 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.155 176.649 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -31.09 71.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.689 0.281 . . . . 0.0 110.623 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 31.5 m -69.59 -21.82 24.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-O 120.791 0.329 . . . . 0.0 110.907 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.491 HG12 ' O ' ' B' ' 466' ' ' GLU . 42.8 mm -66.64 -32.77 59.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.224 178.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 71.6 mt -58.79 -45.05 90.74 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.291 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . 0.581 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.5 mp0 -62.24 -39.9 94.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.586 177.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . 0.578 ' O ' HG12 ' B' ' 477' ' ' ILE . 59.9 m -64.12 -57.71 8.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.356 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . 0.445 HG13 ' HB3' ' A' ' 114' ' ' MET . 85.4 t -52.02 -50.28 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.12 176.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -66.65 -33.16 75.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.225 -174.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -61.23 -45.57 94.01 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 175.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . 0.578 HG12 ' O ' ' B' ' 473' ' ' CYS . 9.2 mm -57.95 -63.5 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 121.765 0.793 . . . . 0.0 109.228 178.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . 0.465 HD11 ' CB ' ' A' ' 118' ' ' ASP . 16.6 mt -56.32 -30.05 29.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.167 -1.379 . . . . 0.0 112.065 -174.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -60.31 -44.3 95.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . 0.479 ' HB2' ' HZ2' ' B' ' 480' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.516 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.655 -177.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? . . . . . 0 N--CA 1.454 -0.259 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -88.58 146.95 5.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.545 -176.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.0 m -63.87 144.69 56.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.312 0.577 . . . . 0.0 111.249 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 tt -66.13 -30.39 70.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.107 -0.952 . . . . 0.0 110.156 -176.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -58.79 -36.91 75.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.347 176.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -68.09 -40.06 82.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.0 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 83.7 mt -65.14 -34.49 78.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.439 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.568 ' HZ2' ' HB3' ' A' ' 93' ' ' LYS . 10.4 mtpm? -59.1 -25.21 63.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.016 179.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -72.29 -16.81 61.91 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.442 ' HB2' ' CE1' ' B' ' 476' ' ' TYR . 93.1 mt -62.01 -51.93 66.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.769 0.318 . . . . 0.0 110.719 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -64.08 -19.3 63.56 Favored Glycine 0 CA--C 1.519 0.34 0 C-N-CA 121.02 -0.61 . . . . 0.0 112.47 176.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -79.3 -16.43 56.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.725 0.298 . . . . 0.0 110.751 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.525 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 31.0 t -83.23 120.07 25.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.06 0.457 . . . . 0.0 111.051 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.96 -27.95 67.04 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.401 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 77.3 m -70.33 -47.38 61.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.884 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' ' 105' ' ' LEU . 17.4 tp -65.72 -50.15 65.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.92 -174.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.525 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.8 ptp180 -58.09 -25.1 60.91 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.142 -0.223 . . . . 0.0 111.44 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 73.9 m -74.15 -39.35 63.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.518 HD13 HD12 ' A' ' 101' ' ' LEU . 0.7 OUTLIER -87.12 -15.51 38.23 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.908 177.94 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.586 HD12 ' O ' ' A' ' 101' ' ' LEU . 7.3 mp -68.95 -4.34 16.3 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.109 0.481 . . . . 0.0 110.774 168.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 97.1 mt -81.95 -11.73 58.73 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.774 177.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.576 ' O ' ' HG3' ' A' ' 111' ' ' ARG . 56.4 m-80 -75.88 115.21 44.29 Favored Pre-proline 0 N--CA 1.463 0.192 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 175.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.42 -26.3 82.41 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.556 2.171 . . . . 0.0 112.193 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -69.62 -47.09 64.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.261 177.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.403 HD21 ' O ' ' A' ' 104' ' ' LEU . 58.5 tp -64.01 -34.6 78.37 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.343 0.592 . . . . 0.0 110.145 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' A' ' 107' ' ' ASN . 70.5 mtp85 -65.05 -42.47 94.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.679 177.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -64.01 -39.79 94.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.062 177.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 84.0 mt -59.04 -48.45 81.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.828 178.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.451 ' HG2' HG21 ' B' ' 474' ' ' VAL . 44.2 mtm -57.77 -53.02 62.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.575 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.561 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.1 m -65.7 -28.86 45.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.714 -175.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -69.14 -46.77 66.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.084 0.469 . . . . 0.0 110.518 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.62 HD13 ' SD ' ' A' ' 127' ' ' MET . 33.8 tp -63.3 -38.94 93.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.861 -178.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.534 ' OD1' ' HG2' ' B' ' 475' ' ' ARG . 9.4 t70 -63.71 -30.34 71.45 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.851 -177.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 74.4 mt-30 -60.09 -29.63 68.71 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.503 0.668 . . . . 0.0 109.819 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.35 18.72 73.65 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 114.62 -1.173 . . . . 0.0 113.902 171.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -67.07 -55.36 14.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.202 0.501 . . . . 0.0 110.227 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -133.71 45.22 2.68 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.368 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.599 ' O ' ' HG2' ' A' ' 127' ' ' MET . 0.0 OUTLIER -56.92 -29.5 63.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.462 -178.037 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.45 -38.41 84.08 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.812 0.339 . . . . 0.0 111.412 -177.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.53 ' H ' ' HD2' ' A' ' 125' ' ' LYS . 0.0 OUTLIER -87.4 -33.9 18.95 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.477 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 97.4 mt -60.69 -36.02 77.74 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.729 -179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' MET . . . . . 0.62 ' SD ' HD13 ' A' ' 117' ' ' LEU . 73.9 mmm -53.6 -43.91 68.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.975 0.417 . . . . 0.0 110.454 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.8 mmm180 -72.44 -38.79 68.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.981 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.518 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.89 -24.55 63.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.419 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -88.82 -30.62 18.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.834 0.35 . . . . 0.0 110.699 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 1.3 mmt -68.75 -10.36 56.07 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.503 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.8 pt20 -95.65 -9.65 31.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.87 0.367 . . . . 0.0 110.499 -178.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.561 ' O ' HG21 ' A' ' 137' ' ' VAL . 3.4 mt-10 -91.97 121.88 66.13 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.749 -175.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.497 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 18.3 Cg_endo -59.31 -20.19 54.33 Favored 'Trans proline' 0 C--O 1.226 -0.113 0 C-N-CA 122.963 2.442 . . . . 0.0 112.585 -177.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.1 mt -80.33 -41.18 25.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.99 0.424 . . . . 0.0 110.535 178.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -78.59 -32.38 47.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.087 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.561 HG21 ' O ' ' A' ' 133' ' ' GLU . 79.6 t -59.91 -42.01 87.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.781 177.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 17.5 mm-40 -69.25 -42.97 74.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.106 178.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -58.35 -49.22 77.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.695 178.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.786 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -61.64 -47.43 85.42 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.98 -177.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -63.91 -33.21 75.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.163 0.506 . . . . 0.0 110.263 -178.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . 0.45 ' O ' HG13 ' A' ' 146' ' ' ILE . 65.3 m -67.4 -51.46 51.59 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.761 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.442 ' O ' HG23 ' A' ' 147' ' ' VAL . 26.1 p -64.64 -33.15 75.26 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.704 -0.225 . . . . 0.0 111.203 -177.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.5 mt -62.71 -36.92 84.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.934 0.397 . . . . 0.0 110.825 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -77.19 -15.32 81.68 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.355 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 142' ' ' CYS . 67.6 mt -91.71 -38.9 11.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.069 0.462 . . . . 0.0 110.964 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 143' ' ' CYS . 19.3 m -95.57 11.35 4.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.108 -177.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.421 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 2.8 pt-20 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.456 179.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . 0.458 ' H ' HD11 ' B' ' 463' ' ' ILE . 4.2 mp . . . . . 0 CA--C 1.526 0.032 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -70.5 -39.71 74.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.17 0.51 . . . . 0.0 109.768 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 47.6 t60 -62.48 -51.19 68.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.083 174.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.663 ' O ' HG12 ' B' ' 470' ' ' ILE . 34.5 mt-10 -61.59 -43.67 98.43 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.198 -175.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -55.46 -40.08 71.16 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 177.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -31.49 52.85 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -177.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.4 t -63.66 -36.0 74.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.266 175.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.663 HG12 ' O ' ' B' ' 466' ' ' GLU . 34.0 mm -60.86 -38.57 79.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.879 176.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 87.2 mt -59.29 -37.06 76.75 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -68.12 -44.23 76.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.689 176.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 60.4 m -63.15 -56.1 19.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.104 -177.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . 0.451 HG21 ' HG2' ' A' ' 114' ' ' MET . 73.9 t -48.85 -52.66 9.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.762 176.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.534 ' HG2' ' OD1' ' A' ' 118' ' ' ASP . 88.4 mtm180 -69.68 -23.05 63.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.918 -174.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . 0.442 ' CE1' ' HB2' ' A' ' 95' ' ' LEU . 0.8 OUTLIER -71.17 -47.36 58.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.969 0.414 . . . . 0.0 110.013 176.559 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . 0.465 HD11 HD21 ' A' ' 105' ' ' LEU . 74.5 mt -64.89 -54.16 33.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.513 -177.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . 0.416 HG13 ' O ' ' B' ' 474' ' ' VAL . 50.5 mt -54.39 -26.45 15.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.694 178.35 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 3.6 ttmp? -70.81 -31.15 67.8 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.908 -173.325 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.551 0 C-N-CA 119.785 -0.766 . . . . 0.0 112.581 175.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.325 0 CA-C-O 121.34 0.591 . . . . 0.0 111.847 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.9 p -107.3 157.82 7.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.467 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.8 m -64.07 147.59 51.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.224 0.535 . . . . 0.0 111.251 -176.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.421 HD21 HD11 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -67.68 -31.68 71.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.218 -174.846 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -57.97 -41.13 82.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.369 176.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.444 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 5.3 m-20 -64.41 -40.27 95.46 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.227 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.421 HD11 HD21 ' A' ' 89' ' ' LEU . 83.3 mt -67.71 -36.62 80.96 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.889 -178.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -62.81 -19.06 63.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -79.02 -17.76 54.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.61 0.243 . . . . 0.0 111.034 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.402 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 95.4 mt -61.82 -52.69 63.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.816 0.341 . . . . 0.0 111.327 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -64.27 -22.81 67.63 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.794 -176.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -97.38 -15.31 20.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.275 0.537 . . . . 0.0 111.576 -175.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 68.3 m -71.8 116.11 11.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.51 -29.06 65.99 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.707 -174.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 18.7 m -68.79 -48.54 63.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.958 0.409 . . . . 0.0 110.902 -178.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.413 ' O ' HD11 ' A' ' 105' ' ' LEU . 41.9 tp -68.88 -48.05 64.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.668 -172.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.567 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 7.8 ptp180 -60.3 -28.38 68.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.479 -178.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 71.1 m -66.69 -25.63 66.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.99 0.424 . . . . 0.0 110.789 177.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.442 ' O ' HD23 ' A' ' 110' ' ' LEU . 22.6 mt -81.48 -33.26 32.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.413 HD11 ' O ' ' A' ' 101' ' ' LEU . 11.0 mp -67.48 -12.68 60.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.531 177.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 70.3 mt -77.54 -8.0 57.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.348 177.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -84.21 115.01 58.17 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.705 176.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.33 -36.65 87.6 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.451 2.767 . . . . 0.0 113.373 -175.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 60.3 t60 -69.15 -45.01 71.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.594 0.235 . . . . 0.0 110.866 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.442 HD23 ' O ' ' A' ' 104' ' ' LEU . 49.8 tp -62.12 -38.2 88.03 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.132 0.491 . . . . 0.0 109.999 -178.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.407 ' O ' HG21 ' A' ' 115' ' ' VAL . 58.7 mtp180 -56.11 -49.79 72.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.048 174.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.419 ' HA ' ' NE2' ' A' ' 112' ' ' GLN . 6.7 mm-40 -63.04 -24.16 67.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.924 -179.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 77.4 mt -78.6 -53.24 7.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -177.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' MET . . . . . 0.464 ' HG3' HG13 ' B' ' 474' ' ' VAL . 42.0 ttp -61.28 -42.21 98.27 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.367 -1.288 . . . . 0.0 111.58 -177.29 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.407 HG21 ' O ' ' A' ' 111' ' ' ARG . 26.3 m -72.95 -28.88 27.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.38 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -62.59 -46.2 89.37 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.145 0.497 . . . . 0.0 110.652 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.1 tp -56.46 -33.89 66.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.399 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -65.92 -32.27 73.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.564 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.66 -29.04 69.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.54 0.686 . . . . 0.0 110.553 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 71.94 19.04 78.06 Favored Glycine 0 C--N 1.322 -0.248 0 CA-C-N 114.89 -1.05 . . . . 0.0 113.775 172.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -70.07 -56.01 8.02 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.988 0.423 . . . . 0.0 110.076 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.578 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 20.4 m-20 -123.52 41.37 3.49 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.468 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.85 -33.16 48.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.026 -177.138 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.55 -38.99 65.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.156 0.503 . . . . 0.0 110.896 -177.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.6 mtpt -79.08 -38.84 35.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.502 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 89.6 mt -61.79 -39.09 90.48 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.962 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.88 -35.85 58.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.872 0.368 . . . . 0.0 111.326 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -84.1 -45.43 13.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.227 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.695 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -64.09 -31.96 73.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.749 -177.403 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.54 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 5.2 m-30 -72.39 -22.49 61.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.151 0.5 . . . . 0.0 110.411 -178.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' MET . . . . . 0.468 ' HE2' ' HA ' ' A' ' 131' ' ' MET . 1.6 mmt -85.74 1.39 49.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.995 -178.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.695 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 17.7 pt20 -101.19 -14.13 17.84 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 175.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -91.13 120.03 68.64 Favored Pre-proline 0 N--CA 1.451 -0.388 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.331 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . 0.658 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 29.0 Cg_endo -62.6 -13.61 34.71 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.98 2.453 . . . . 0.0 112.32 -179.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 86.9 mt -83.52 -32.29 25.98 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.07 178.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.54 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 47.4 t80 -90.43 -34.36 15.65 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.303 -177.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.658 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 8.6 m -57.11 -46.16 84.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.414 178.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.456 ' N ' HG23 ' A' ' 137' ' ' VAL . 5.7 mm-40 -62.31 -43.93 97.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.45 177.07 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -55.1 -49.74 70.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.818 175.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.743 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.81 -47.99 81.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.946 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -61.82 -33.45 74.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.4 0.619 . . . . 0.0 110.524 -176.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.6 m -76.8 -40.92 46.45 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.49 -177.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' CYS . . . . . 0.493 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -73.07 -29.47 62.98 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.607 -177.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.743 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.4 mt -60.52 -44.09 96.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.604 178.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.38 -20.68 69.78 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.333 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 56.6 mt -87.85 -30.48 5.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.842 0.353 . . . . 0.0 110.568 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.444 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 23.2 m -102.31 8.98 9.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -176.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 42.6 mm-40 . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 120.644 0.259 . . . . 0.0 110.725 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 59.8 mt . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.492 0.187 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -58.66 -42.12 87.67 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 70.8 t60 -65.96 -46.78 76.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.06 177.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 466' ' ' GLU . . . . . 0.599 ' O ' HG12 ' B' ' 470' ' ' ILE . 6.1 mm-40 -56.01 -50.22 71.5 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.059 -178.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 36.2 mtm180 -65.26 -33.08 75.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.618 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.05 -31.44 62.87 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.4 t -66.13 -36.32 77.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.223 174.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 470' ' ' ILE . . . . . 0.599 HG12 ' O ' ' B' ' 466' ' ' GLU . 43.2 mm -61.1 -35.96 69.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.201 176.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 471' ' ' LEU . . . . . 0.478 ' O ' ' HG3' ' B' ' 475' ' ' ARG . 93.3 mt -56.44 -48.48 76.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.12 176.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -59.46 -40.47 86.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.039 177.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.0 m -61.84 -55.47 29.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.976 0.417 . . . . 0.0 110.055 178.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 474' ' ' VAL . . . . . 0.464 HG13 ' HG3' ' A' ' 114' ' ' MET . 45.8 t -51.75 -50.42 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.597 177.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 475' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' B' ' 471' ' ' LEU . 82.8 mtp180 -64.47 -39.0 92.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.286 -175.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 476' ' ' TYR . . . . . 0.404 ' O ' ' HG3' ' B' ' 480' ' ' LYS . 0.9 OUTLIER -67.72 -45.84 73.88 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 120.867 0.365 . . . . 0.0 110.502 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.97 -60.54 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.434 -175.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 56.3 mt -53.65 -28.1 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.763 0.316 . . . . 0.0 111.326 -178.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -76.45 -32.55 58.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.078 -173.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 480' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.612 0 C-N-CA 120.02 -0.672 . . . . 0.0 112.108 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.839 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.553 ' HA ' ' OD1' ' A' ' 85' ' ' ASP . 7.6 Cg_exo -73.1 65.12 4.24 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.39 2.727 . . . . 0.0 112.577 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 -89.75 -55.11 3.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.799 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 22.7 ptp -88.83 8.94 26.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.224 0.535 . . . . 0.0 110.315 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.553 ' OD1' ' HA ' ' A' ' 82' ' ' PRO . 8.8 m-20 -78.76 -13.5 59.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.653 171.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 -90.52 132.6 35.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.417 -0.811 . . . . 0.0 109.784 177.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.453 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 38.3 t -89.01 143.59 10.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.069 -173.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.0 m -75.84 142.98 42.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.929 176.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.9 mt -55.24 -31.56 61.6 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.208 -0.906 . . . . 0.0 113.138 -173.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -53.31 -51.05 63.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.946 0.403 . . . . 0.0 110.816 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.502 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 6.2 m-20 -63.81 -35.83 81.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.717 -178.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 84.7 mt -72.66 -39.37 67.18 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.448 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.514 ' HA ' ' CZ ' ' B' ' 476' ' ' TYR . 97.3 mttt -66.94 -26.34 66.79 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.929 0.395 . . . . 0.0 110.985 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -69.99 -17.69 63.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.994 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.454 HD22 HG12 ' A' ' 147' ' ' VAL . 73.4 mt -65.14 -46.88 79.12 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.917 0.389 . . . . 0.0 110.409 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.39 -20.12 71.26 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.578 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -84.59 -23.87 29.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.849 0.357 . . . . 0.0 110.434 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.614 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 43.7 t -70.91 115.42 10.03 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.095 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.11 -30.05 67.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.173 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.9 m -72.99 -45.18 59.38 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.984 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.2 tt -74.3 -44.4 52.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.899 -172.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.614 ' HG2' ' O ' ' A' ' 98' ' ' SER . 2.8 ptp180 -56.99 -32.27 65.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.95 178.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.421 ' HA ' HD21 ' A' ' 106' ' ' LEU . 71.3 m -68.89 -18.06 64.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.864 0.364 . . . . 0.0 111.275 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 139' ' ' PHE . 17.2 mt -78.08 -33.7 50.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.105 0.479 . . . . 0.0 109.718 178.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -63.2 -18.05 63.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.193 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.421 HD21 ' HA ' ' A' ' 103' ' ' SER . 4.4 mm? -68.94 -10.79 59.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.358 178.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -86.13 118.86 71.15 Favored Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -62.08 -26.64 78.37 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.98 2.453 . . . . 0.0 112.615 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -76.29 -46.65 26.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.913 0.387 . . . . 0.0 110.165 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.9 tt -62.04 -42.81 99.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.267 -176.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 8.9 ptp180 -67.21 -31.04 71.15 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.828 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.517 HE21 ' HA ' ' A' ' 112' ' ' GLN . 0.0 OUTLIER -70.37 -38.61 74.8 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.659 -0.246 . . . . 0.0 110.366 176.169 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.434 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 81.3 mt -57.36 -50.92 71.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.159 0.504 . . . . 0.0 109.929 174.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.401 ' HG2' HG23 ' B' ' 474' ' ' VAL . 62.2 mtp -52.01 -57.0 10.81 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.72 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.712 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 27.4 m -64.04 -36.28 76.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.729 -176.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -64.6 -47.69 77.68 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.018 0.437 . . . . 0.0 110.927 178.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 62.3 tp -60.93 -40.35 92.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.058 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -66.4 -41.07 89.87 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.685 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.712 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 71.8 mt-30 -64.1 -28.31 69.69 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.595 0.712 . . . . 0.0 110.27 -178.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 75.69 31.45 56.21 Favored Glycine 0 N--CA 1.444 -0.815 0 CA-C-N 114.687 -1.142 . . . . 0.0 113.703 168.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -51.43 -42.25 61.39 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.059 0.457 . . . . 0.0 109.958 178.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.476 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 10.1 t70 -162.72 72.81 0.34 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 170.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.624 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.6 OUTLIER -53.76 -26.53 23.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.99 178.903 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.31 -54.69 43.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.411 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -25.95 27.25 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.291 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.505 HD23 ' HH ' ' A' ' 130' ' ' TYR . 95.4 mt -62.48 -43.36 99.01 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.438 178.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' MET . . . . . 0.566 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.4 OUTLIER -57.2 -28.49 62.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.921 0.391 . . . . 0.0 111.432 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -84.42 -49.16 8.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.922 0.391 . . . . 0.0 110.509 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -67.96 -16.35 64.02 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.302 -176.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.505 ' HH ' HD23 ' A' ' 126' ' ' LEU . 3.0 m-30 -88.78 -23.26 22.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.734 0.302 . . . . 0.0 111.722 -179.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -84.09 -0.18 50.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.085 0.469 . . . . 0.0 111.03 -176.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.463 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.5 pt20 -101.81 -16.22 16.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.963 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.419 ' O ' HG21 ' A' ' 137' ' ' VAL . 2.4 mt-10 -93.65 118.77 67.51 Favored Pre-proline 0 N--CA 1.449 -0.505 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.701 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 12.1 Cg_endo -55.54 -25.87 51.72 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.072 2.515 . . . . 0.0 112.658 -173.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.6 mt -66.64 -45.23 79.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.964 0.411 . . . . 0.0 110.658 -178.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.409 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 37.0 t80 -76.88 -29.06 55.63 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 -177.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.419 HG21 ' O ' ' A' ' 133' ' ' GLU . 75.2 t -62.9 -42.56 96.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.292 176.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.701 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 33.8 mm-40 -60.64 -46.66 89.47 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.895 0.379 . . . . 0.0 110.016 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . 0.509 ' HA ' ' CD1' ' A' ' 104' ' ' LEU . 77.1 t80 -59.57 -47.39 85.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.771 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.766 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.74 -47.22 84.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.185 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -67.94 -27.37 66.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.12 0.486 . . . . 0.0 110.395 -176.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 69.7 m -75.71 -44.17 43.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.407 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 27.6 p -69.74 -30.61 68.25 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.816 -176.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.766 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 86.1 mt -59.27 -48.12 82.82 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.966 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.42 -21.65 66.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.634 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 54.6 mt -91.02 -32.66 5.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.568 0.223 . . . . 0.0 111.361 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.502 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 14.9 m -102.53 -16.88 7.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -174.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -84.27 113.85 51.01 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-O 120.737 0.303 . . . . 0.0 111.571 -178.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . 0.436 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 88.4 Cg_endo -81.78 -8.66 12.26 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.432 2.088 . . . . 0.0 110.401 171.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 2.2 m -65.93 114.93 5.5 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.681 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -72.8 163.15 28.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.299 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -85.99 66.22 9.48 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 121.59 0.709 . . . . 0.0 110.336 -178.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 51.12 -94.37 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 113.707 -1.588 . . . . 0.0 112.848 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -128.08 26.73 5.75 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.397 -176.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 44.6 m . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.669 -0.682 . . . . 0.0 110.519 178.569 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 11.3 t70 . . . . . 0 N--CA 1.482 1.129 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 41.0 mm -63.27 -30.67 50.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.22 -172.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -60.72 -41.36 95.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.572 0.701 . . . . 0.0 109.448 177.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -75.71 -49.38 18.46 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.805 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.548 ' O ' HG12 ' B' ' 470' ' ' ILE . 45.6 mt-10 -57.66 -47.93 80.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.171 -173.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . 0.566 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 78.3 mtm180 -60.37 -35.49 75.83 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -177.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.98 -31.22 58.88 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.99 -35.37 73.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.323 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.548 HG12 ' O ' ' B' ' 466' ' ' GLU . 24.6 mm -61.84 -35.92 70.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.101 177.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 86.8 mt -60.46 -38.02 82.85 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.829 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . 0.453 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 1.8 mp0 -68.15 -41.11 82.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.877 0.37 . . . . 0.0 110.579 177.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.1 m -63.96 -56.11 17.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.806 -178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . 0.445 ' O ' HG13 ' B' ' 478' ' ' ILE . 82.7 t -52.3 -51.06 34.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.971 178.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -66.37 -33.33 75.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.492 -172.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . 0.514 ' CZ ' ' HA ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -63.72 -46.89 83.37 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.097 0.475 . . . . 0.0 109.948 176.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 75.6 mt -64.12 -51.02 74.17 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.511 -176.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.445 HG13 ' O ' ' B' ' 474' ' ' VAL . 40.5 mt -58.21 -23.68 22.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.96 0.41 . . . . 0.0 110.918 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.508 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 20.7 tptp -74.73 -35.31 62.66 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.254 -175.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.03 -16.11 11.67 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 119.916 -0.714 . . . . 0.0 112.406 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -91.96 -60.5 1.84 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.07 0.462 . . . . 0.0 111.963 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -90.33 -77.85 0.39 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.525 -167.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -110.18 -48.71 3.15 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.555 -171.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.508 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 80.28 13.07 82.42 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.693 -178.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 2.3 pp -69.67 160.79 30.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.175 0.512 . . . . 0.0 112.127 -175.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -127.99 65.2 1.37 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.903 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 21.9 p -82.52 -28.02 31.33 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.927 -178.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . 0.507 ' N ' HD21 ' B' ' 488' ' ' ASN . 0.8 OUTLIER -84.77 72.71 10.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.627 -177.199 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 32.3 t -140.18 152.16 45.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.984 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -85.06 75.59 10.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.343 0.592 . . . . 0.0 110.252 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -89.99 8.28 33.24 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.749 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 28.5 t -73.77 122.68 22.79 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.15 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -98.55 21.48 11.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.216 0.531 . . . . 0.0 110.661 -179.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -76.89 -32.74 57.66 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.108 177.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 60.1 t . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.635 -0.698 . . . . 0.0 110.531 179.094 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 111.669 -0.573 . . . . 0.0 111.669 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.9 99.53 0.47 Allowed 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.662 2.241 . . . . 0.0 112.304 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -168.09 -75.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.428 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 15.7 tpt -95.56 2.59 54.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.738 0.78 . . . . 0.0 109.93 -177.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -88.87 12.85 14.08 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.055 -177.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -58.07 131.65 51.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.25 174.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.99 130.53 34.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.059 -176.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.5 m -67.89 156.8 36.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.049 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.61 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -59.48 -42.07 91.24 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 -176.671 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -52.94 -38.29 61.84 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.99 0.424 . . . . 0.0 111.249 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.424 HD22 ' HA ' ' A' ' 149' ' ' PRO . 5.6 m-20 -80.46 -17.76 50.72 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.176 -177.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 84.2 mt -86.8 -35.35 19.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.316 176.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.61 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 53.2 mtpt -54.47 -37.1 64.84 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -175.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.415 HD21 HG22 ' A' ' 146' ' ' ILE . 0.0 OUTLIER -71.84 -17.07 62.17 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -175.721 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 9.6 mp -60.3 -48.7 80.63 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -175.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -66.81 -21.46 71.26 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.263 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -85.09 -23.25 28.59 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.97 0.414 . . . . 0.0 110.609 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.642 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 42.6 t -65.68 118.21 9.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.259 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.62 -27.24 68.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.265 -177.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 80.2 m -75.12 -43.2 54.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.062 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 20.0 tp -75.64 -44.29 43.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.763 -171.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.642 ' HG2' ' O ' ' A' ' 98' ' ' SER . 7.6 ptp180 -58.91 -30.68 67.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.062 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.1 m -65.47 -24.86 67.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.029 0.443 . . . . 0.0 110.876 177.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.9 mt -83.63 -32.63 25.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.824 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.48 -21.96 66.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.457 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 74.6 mt -71.63 -13.15 61.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.848 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -81.37 113.94 45.53 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.928 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.526 ' HA ' ' NE ' ' A' ' 111' ' ' ARG . 48.9 Cg_exo -56.06 -37.02 96.92 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.088 2.526 . . . . 0.0 113.388 -177.012 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.488 ' CD2' HD23 ' A' ' 135' ' ' LEU . 47.7 t60 -69.27 -41.39 76.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.044 0.449 . . . . 0.0 110.384 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.42 HD13 ' HB2' ' A' ' 139' ' ' PHE . 2.5 tt -64.71 -46.64 81.45 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.985 -177.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.526 ' NE ' ' HA ' ' A' ' 108' ' ' PRO . 16.3 ptt180 -68.15 -28.47 67.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.872 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -44.32 95.85 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.168 0.508 . . . . 0.0 109.737 173.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.86 -47.25 85.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.183 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 51.1 mtp -56.7 -50.79 71.11 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.208 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.599 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.2 m -65.4 -32.27 57.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.861 -0.335 . . . . 0.0 111.136 -178.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -65.94 -41.27 91.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.054 0.454 . . . . 0.0 110.704 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.509 HD12 ' SD ' ' A' ' 127' ' ' MET . 32.9 tp -68.14 -37.38 80.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.759 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.516 ' OD1' HG23 ' B' ' 478' ' ' ILE . 36.7 t70 -64.29 -29.57 70.65 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.778 0.323 . . . . 0.0 111.472 -177.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.599 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 68.4 mt-30 -63.53 -28.37 69.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.375 0.607 . . . . 0.0 110.721 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.27 27.78 72.8 Favored Glycine 0 CA--C 1.516 0.154 0 CA-C-N 114.832 -1.076 . . . . 0.0 114.106 170.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -85.0 -53.79 5.06 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.177 0.513 . . . . 0.0 110.29 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -124.04 33.45 5.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.527 -176.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.622 ' O ' ' HG2' ' A' ' 127' ' ' MET . 0.1 OUTLIER -45.77 -38.27 6.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.847 -1.069 . . . . 0.0 112.08 177.023 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.16 -41.5 79.33 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 121.01 0.433 . . . . 0.0 111.527 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -85.4 -36.36 20.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.523 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 96.2 mt -57.48 -42.48 82.69 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.63 179.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' MET . . . . . 0.622 ' HG2' ' O ' ' A' ' 123' ' ' LYS . 69.4 mmm -53.16 -39.63 63.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.902 0.382 . . . . 0.0 110.768 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 -70.74 -48.9 52.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.307 0.575 . . . . 0.0 110.208 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.593 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -70.64 -19.45 62.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.221 -0.9 . . . . 0.0 112.328 -174.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.558 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.5 m-30 -85.47 -26.22 26.43 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.84 0.352 . . . . 0.0 110.618 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.493 ' HA ' ' HE1' ' A' ' 131' ' ' MET . 19.2 mmt -80.75 0.54 34.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.202 -179.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.593 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.6 pt20 -105.73 -5.15 20.17 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.864 0.364 . . . . 0.0 110.296 177.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.404 ' O ' HG21 ' A' ' 137' ' ' VAL . 2.3 mt-10 -106.23 121.41 45.56 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.651 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 23.8 Cg_endo -61.42 -13.12 27.29 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.298 2.665 . . . . 0.0 113.085 -176.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.488 HD23 ' CD2' ' A' ' 109' ' ' HIS . 6.8 mp -77.3 -40.34 44.69 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.135 177.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.558 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 40.4 t80 -89.06 -33.16 17.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.105 0.479 . . . . 0.0 110.229 -172.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.651 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 9.5 m -58.31 -47.73 86.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.385 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.49 ' N ' HG23 ' A' ' 137' ' ' VAL . 10.8 pt-20 -67.63 -34.96 78.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.775 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . 0.42 ' HB2' HD13 ' A' ' 110' ' ' LEU . 45.3 t80 -58.06 -49.6 76.33 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 173.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.754 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -61.23 -46.42 90.48 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.73 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.49 -32.24 72.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.379 0.609 . . . . 0.0 110.885 -176.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 95.2 m -82.71 -38.42 23.35 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.093 -176.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 25.7 p -73.65 -27.02 61.04 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.246 -176.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.754 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 93.6 mt -60.06 -38.23 82.21 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.098 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -71.87 -16.81 76.52 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.387 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.415 HG22 HD21 ' A' ' 94' ' ' ASN . 25.1 mt -91.26 -28.77 4.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.729 0.299 . . . . 0.0 110.896 -178.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 31.0 m -96.7 2.61 10.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -57.04 111.82 3.83 Favored Pre-proline 0 N--CA 1.465 0.296 0 C-N-CA 121.127 -0.229 . . . . 0.0 110.484 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . 0.424 ' HA ' HD22 ' A' ' 91' ' ' ASN . 55.6 Cg_endo -71.12 -20.45 28.57 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.456 2.104 . . . . 0.0 111.782 -178.07 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 14.7 m -88.94 91.19 8.73 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.055 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -106.3 22.42 15.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.291 0.567 . . . . 0.0 109.831 177.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -65.73 123.86 20.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.762 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -70.24 147.11 50.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.404 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 61.31 40.96 13.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.964 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 25.7 p . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.647 179.473 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 8.4 t70 . . . . . 0 N--CA 1.482 1.169 0 CA-C-O 120.979 0.418 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 57.6 mt -68.03 -33.95 64.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.63 -171.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -57.56 -45.71 84.81 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.469 0.652 . . . . 0.0 109.287 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 63.8 t60 -67.7 -55.87 11.51 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.499 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.455 ' O ' ' HB ' ' B' ' 469' ' ' VAL . 38.4 mt-10 -56.68 -46.5 81.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.588 -172.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -74.12 -28.47 61.36 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.363 -175.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -27.02 48.62 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . 0.455 ' HB ' ' O ' ' B' ' 466' ' ' GLU . 2.4 t -61.23 -33.96 58.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.606 173.01 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.42 HG12 ' O ' ' B' ' 466' ' ' GLU . 30.1 mm -65.4 -28.07 43.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.797 -178.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.81 -29.91 70.47 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.124 0.487 . . . . 0.0 110.344 177.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -81.27 -40.59 23.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.01 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 61.2 m -62.09 -56.85 14.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.816 -177.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . 0.67 ' O ' HG12 ' B' ' 478' ' ' ILE . 88.5 t -54.12 -50.57 54.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.402 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -64.69 -36.89 85.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.984 -171.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -43.78 88.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.24 0.543 . . . . 0.0 109.743 175.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . 0.492 ' O ' ' HD3' ' B' ' 480' ' ' LYS . 78.1 mt -65.91 -53.84 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.227 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.67 HG12 ' O ' ' B' ' 474' ' ' VAL . 8.0 mm -54.5 -31.64 23.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.702 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.508 ' HA ' ' CA ' ' B' ' 484' ' ' GLY . 45.6 tptt -55.08 -39.69 69.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.63 -174.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . 0.492 ' HD3' ' O ' ' B' ' 477' ' ' ILE . 0.0 OUTLIER -113.3 -9.15 13.44 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.019 178.501 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.66 -60.78 1.85 Allowed 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . 0.451 ' HB2' HG21 ' B' ' 478' ' ' ILE . 92.9 m-85 -115.41 -86.08 0.61 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 119.791 -0.763 . . . . 0.0 112.908 -174.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . 0.58 ' H ' HG22 ' B' ' 478' ' ' ILE . 73.6 m-85 -108.07 -50.77 2.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.517 0.199 . . . . 0.0 111.256 -171.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.519 ' H ' HG22 ' B' ' 478' ' ' ILE . . . 77.21 45.62 11.24 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.518 -0.849 . . . . 0.0 111.481 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 92.2 mt -70.45 162.38 28.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.246 0.546 . . . . 0.0 111.175 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . 0.436 ' C ' ' HG1' ' B' ' 487' ' ' THR . 3.6 p30 -121.62 -21.01 6.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.648 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 487' ' ' THR . . . . . 0.436 ' HG1' ' C ' ' B' ' 486' ' ' ASP . 54.1 p 52.03 25.1 2.97 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 114.869 -1.06 . . . . 0.0 112.886 177.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . 0.413 HD21 ' HA ' ' B' ' 488' ' ' ASN . 1.9 t-20 -95.21 5.72 51.01 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.108 0.48 . . . . 0.0 110.414 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 9.8 m -59.32 127.25 31.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.682 178.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -80.13 -14.01 58.82 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.268 0.556 . . . . 0.0 111.038 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -89.17 20.4 3.74 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.341 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 24.5 t -140.43 112.55 7.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.238 177.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -70.46 118.91 13.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.976 0.417 . . . . 0.0 110.552 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -75.23 -37.2 61.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.75 -178.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 6.0 m . . . . . 0 C--O 1.249 1.048 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.086 -179.21 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.767 0 N-CA-C 111.625 -0.59 . . . . 0.0 111.625 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.49 45.79 1.68 Allowed 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 122.917 2.412 . . . . 0.0 112.707 -177.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -131.27 17.55 4.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.436 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.571 ' O ' ' HE1' ' B' ' 465' ' ' HIS . 47.1 ttp 55.38 45.85 24.55 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.678 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -71.81 -24.06 61.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.403 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.506 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 7.4 ptp180 -111.82 155.21 23.93 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.144 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.606 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 26.0 t -110.12 145.26 16.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.109 -176.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.0 m -62.56 142.16 58.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.072 0.463 . . . . 0.0 110.819 178.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.441 HD22 HD13 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -59.29 -33.18 70.76 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.548 -176.416 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -58.13 -40.86 82.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.791 177.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -65.78 -42.92 90.21 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.47 ' O ' HD12 ' A' ' 95' ' ' LEU . 83.7 mt -66.61 -34.64 78.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.845 -175.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -56.23 -32.95 64.94 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -66.18 -24.59 66.66 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.813 0.339 . . . . 0.0 111.702 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.47 HD12 ' O ' ' A' ' 92' ' ' LEU . 7.5 mp -64.69 -38.03 89.61 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.768 0.318 . . . . 0.0 111.065 -175.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.56 -26.22 71.83 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.67 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -100.71 4.41 43.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.147 0.499 . . . . 0.0 110.856 -178.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.504 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 71.1 m -84.93 107.24 16.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.172 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.39 -29.95 69.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.242 -177.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.2 m -70.64 -39.73 73.49 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 -177.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.443 HD13 ' CD2' ' A' ' 139' ' ' PHE . 40.8 tp -74.73 -48.64 24.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.387 -176.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 98' ' ' SER . 4.5 ptp180 -61.39 -27.29 68.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.109 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.5 t -64.16 -23.91 67.49 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.13 0.491 . . . . 0.0 110.148 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.1 mt -87.51 -33.38 18.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.194 178.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.406 HD21 HD12 ' B' ' 477' ' ' ILE . 11.1 mp -69.86 -6.69 34.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.834 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 58.9 mt -67.93 -14.67 63.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.419 176.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -84.37 121.52 75.2 Favored Pre-proline 0 C--O 1.235 0.325 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.934 175.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.06 -29.91 90.3 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.884 2.389 . . . . 0.0 112.796 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 65.1 t60 -70.49 -44.61 67.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.736 0.303 . . . . 0.0 110.8 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.429 HD23 ' O ' ' A' ' 110' ' ' LEU . 4.3 tt -61.57 -42.14 98.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.221 0.534 . . . . 0.0 110.067 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -70.56 -32.73 70.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.281 -178.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.497 HE21 ' HA ' ' A' ' 112' ' ' GLN . 0.0 OUTLIER -66.47 -37.54 85.33 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.63 175.673 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 76.1 mt -55.06 -51.26 66.89 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.441 ' HB3' HD11 ' B' ' 478' ' ' ILE . 49.5 mtm -53.77 -54.62 35.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 71.7 t -57.03 -39.49 66.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.544 -178.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -65.21 -41.37 94.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.464 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.499 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 54.9 tp -71.19 -31.98 68.3 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.258 -178.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.488 ' OD1' ' HB2' ' B' ' 485' ' ' LEU . 14.1 t70 -61.07 -38.9 87.86 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.954 -178.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -60.35 -29.37 68.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.557 0.694 . . . . 0.0 111.165 -177.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 66.13 21.31 69.85 Favored Glycine 0 N--CA 1.451 -0.367 0 CA-C-N 114.647 -1.161 . . . . 0.0 113.448 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -72.36 -34.24 67.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.324 0.583 . . . . 0.0 110.297 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.426 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 22.1 p-10 -145.38 40.07 1.2 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.384 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.589 ' HD3' ' N ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.04 -33.91 5.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.471 -1.24 . . . . 0.0 112.144 177.735 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.7 -52.1 66.54 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.509 -175.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.503 ' HB3' ' HZ1' ' A' ' 125' ' ' LYS . 0.2 OUTLIER -76.24 -34.57 59.19 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.359 179.9 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 89.2 mt -58.32 -44.34 88.59 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.462 -178.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.58 -35.07 60.42 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.932 0.396 . . . . 0.0 111.103 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -84.21 -41.38 17.03 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.684 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.506 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -71.1 -17.07 62.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.027 -176.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.499 ' CE2' ' HB2' ' A' ' 117' ' ' LEU . 3.8 m-30 -87.58 -28.26 22.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.944 0.402 . . . . 0.0 110.857 179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.466 ' HE2' ' HA ' ' A' ' 131' ' ' MET . 4.0 mmt -80.89 5.2 16.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.322 -177.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 28.4 pt20 -104.03 -7.95 19.92 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 176.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -103.03 126.24 32.99 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.403 -176.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.662 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 30.4 Cg_endo -63.59 -14.28 41.65 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.904 2.403 . . . . 0.0 112.516 -178.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.2 mp -73.46 -44.08 58.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.771 0.32 . . . . 0.0 110.416 176.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.4 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 36.9 t80 -88.8 -29.87 19.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.111 0.481 . . . . 0.0 110.126 -170.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.662 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 18.6 m -59.7 -48.59 86.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.786 177.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.484 ' N ' HG22 ' A' ' 137' ' ' VAL . 36.7 mt-10 -62.24 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.367 176.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . 0.443 ' CD2' HD13 ' A' ' 101' ' ' LEU . 61.8 t80 -54.06 -49.18 69.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.695 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.66 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.72 -47.35 81.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.935 178.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -61.1 -31.25 70.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.506 0.67 . . . . 0.0 110.493 -176.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.424 ' O ' HG13 ' A' ' 146' ' ' ILE . 78.2 m -77.96 -50.14 12.74 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.532 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.508 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -65.88 -29.72 70.21 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.551 0.215 . . . . 0.0 111.298 -175.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.66 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 57.7 mt -66.57 -23.31 66.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.765 0.316 . . . . 0.0 110.745 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -86.55 -14.67 65.27 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.063 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 142' ' ' CYS . 25.4 mt -91.86 -31.62 4.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.858 0.361 . . . . 0.0 110.906 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.442 ' CG1' HD11 ' A' ' 95' ' ' LEU . 23.0 m -106.8 4.95 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -177.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.48 129.26 25.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.862 0.839 . . . . 0.0 113.202 -172.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -83.37 -2.1 10.46 Favored 'Trans proline' 0 N--CA 1.459 -0.548 0 C-N-CA 123.046 2.497 . . . . 0.0 111.294 174.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 43.3 t -138.72 112.11 8.14 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.867 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.66 6.56 17.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.734 0.778 . . . . 0.0 110.167 177.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -115.38 21.75 13.81 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.671 -1.149 . . . . 0.0 109.317 176.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 58.62 -171.23 0.11 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.035 -178.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -135.4 71.52 1.43 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.287 178.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 48.3 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.498 -0.763 . . . . 0.0 110.627 -178.292 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 12.0 t70 . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.805 0.336 . . . . 0.0 110.122 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . 0.558 ' O ' ' HB2' ' B' ' 467' ' ' ARG . 42.4 mm -63.14 -34.38 66.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.397 -174.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -60.66 -47.63 85.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.074 0.464 . . . . 0.0 110.3 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . 0.571 ' HE1' ' O ' ' A' ' 84' ' ' MET . 15.5 t60 -71.81 -43.51 65.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.187 177.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.537 ' O ' HG12 ' B' ' 470' ' ' ILE . 49.2 mt-10 -69.78 -22.96 63.29 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.016 -174.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . 0.558 ' HB2' ' O ' ' B' ' 463' ' ' ILE . 30.8 ttp180 -62.94 -42.74 99.91 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.188 0.595 . . . . 0.0 111.301 177.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -80.41 -18.38 49.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.405 0.621 . . . . 0.0 109.884 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . 0.486 ' HB ' ' HA ' ' B' ' 466' ' ' GLU . 2.1 t -67.35 -32.0 55.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.386 171.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.537 HG12 ' O ' ' B' ' 466' ' ' GLU . 32.5 mm -60.14 -31.87 49.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.565 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . 0.532 ' O ' ' HG3' ' B' ' 475' ' ' ARG . 85.9 mt -53.9 -44.13 70.24 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.823 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . 0.606 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.4 mp0 -64.8 -41.51 95.75 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.461 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 38.1 m -61.56 -53.28 58.46 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.226 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . 0.48 ' O ' HG13 ' B' ' 478' ' ' ILE . 78.6 t -51.78 -57.78 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.881 176.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' B' ' 471' ' ' LEU . 43.0 mtp180 -73.9 -20.24 60.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.326 -0.397 . . . . 0.0 112.039 -169.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.42 -46.16 70.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.033 0.444 . . . . 0.0 109.967 174.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . 0.475 ' O ' ' HB2' ' B' ' 481' ' ' ASP . 74.8 mt -65.36 -54.6 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.034 -178.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.541 HG21 ' H ' ' B' ' 484' ' ' GLY . 53.5 mt -53.43 -31.57 19.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.967 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.545 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 22.7 tptm -56.56 -48.43 77.37 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.275 -174.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.17 -10.91 13.83 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.77 -175.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' B' ' 477' ' ' ILE . 1.3 m-20 -89.6 -52.29 5.09 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 178.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -110.11 -88.38 0.5 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -172.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -111.65 -50.19 2.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.895 0.379 . . . . 0.0 111.217 -172.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.545 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 71.63 51.07 17.31 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.472 -0.87 . . . . 0.0 111.565 -174.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.488 ' HB2' ' OD1' ' A' ' 118' ' ' ASP . 85.4 mt -71.78 141.83 49.7 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.849 0.357 . . . . 0.0 110.431 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -143.41 -27.03 0.56 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.889 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 9.0 t -99.78 -6.59 26.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.713 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . 0.433 ' HA ' ' HD3' ' B' ' 491' ' ' LYS . 0.9 OUTLIER -95.74 -5.34 42.29 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.716 -0.394 . . . . 0.0 111.021 -178.298 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 16.1 p -108.29 133.95 51.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.259 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . 60.83 34.6 19.65 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.463 0.649 . . . . 0.0 110.455 -178.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . 0.433 ' HD3' ' HA ' ' B' ' 488' ' ' ASN . 21.6 pttm -85.53 37.56 0.7 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.331 -177.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 8.9 t -81.7 54.64 2.45 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.235 0.541 . . . . 0.0 110.169 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -83.42 67.21 9.24 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.057 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -81.18 88.73 6.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.853 -175.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 40.3 t . . . . . 0 C--O 1.25 1.097 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.411 177.951 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.675 0 N-CA-C 112.198 -0.361 . . . . 0.0 112.198 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.48 -28.09 83.07 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.004 2.469 . . . . 0.0 112.569 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.0 t-80 -101.1 89.14 3.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.029 0.443 . . . . 0.0 110.065 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 16.4 ptp -128.95 54.46 1.79 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.81 0.814 . . . . 0.0 109.878 177.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.428 ' HB2' ' HD1' ' B' ' 465' ' ' HIS . 3.0 p-10 -83.52 -6.5 59.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.85 -176.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -63.8 144.08 57.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.127 0.489 . . . . 0.0 110.478 177.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 24.2 t -75.26 132.01 34.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.416 -173.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.8 m -70.02 153.81 42.74 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.725 176.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.03 -41.49 87.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.867 0.365 . . . . 0.0 110.083 -175.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -55.06 -39.21 68.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.552 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -71.57 -38.35 70.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.907 0.384 . . . . 0.0 110.259 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.9 mt -65.14 -35.07 79.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.251 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.552 ' HB3' ' HZ3' ' A' ' 93' ' ' LYS . 3.0 mmmp? -53.73 -32.27 51.5 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.113 178.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -70.5 -18.38 62.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.741 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.08 -52.1 60.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.63 0.252 . . . . 0.0 111.047 -177.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.45 -16.21 62.58 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.129 -0.557 . . . . 0.0 112.932 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 32.8 mm-40 -83.11 -24.1 32.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.819 0.342 . . . . 0.0 110.687 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.51 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.9 t -74.61 113.33 11.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.323 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -24.55 65.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.469 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.5 m -72.7 -41.07 65.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.7 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.455 ' O ' HD13 ' A' ' 105' ' ' LEU . 61.3 tp -67.43 -54.39 20.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.414 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.598 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 6.8 ptp180 -60.55 -24.94 65.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.229 -179.341 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.3 t -58.85 -30.07 67.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.208 0.528 . . . . 0.0 110.2 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 mt -86.71 -32.74 20.3 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.005 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 101' ' ' LEU . 9.2 mp -61.59 -20.72 63.63 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.476 178.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 80.8 mt -68.14 -12.64 61.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.185 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -84.69 116.55 65.73 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.075 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.412 ' O ' ' HG2' ' A' ' 111' ' ' ARG . 67.5 Cg_exo -52.63 -36.18 70.74 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 123.802 3.002 . . . . 0.0 113.44 -176.187 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -67.34 -45.35 76.66 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.09 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 50.1 tp -65.85 -38.29 88.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.95 0.405 . . . . 0.0 111.046 -176.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 108' ' ' PRO . 30.1 ptt180 -69.93 -27.64 64.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.094 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -70.8 -37.81 73.29 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.549 174.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 88.1 mt -58.07 -46.28 85.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.326 176.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.413 ' HG2' HG22 ' B' ' 474' ' ' VAL . 59.0 mtm -58.1 -54.8 42.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.437 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.583 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 32.0 m -66.53 -23.31 31.23 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -175.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -76.47 -45.79 29.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.15 0.5 . . . . 0.0 110.792 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.471 HD12 ' CD2' ' A' ' 130' ' ' TYR . 0.7 OUTLIER -64.48 -49.97 69.28 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.414 -175.885 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' B' ' 488' ' ' ASN . 14.4 t70 -55.65 -21.4 17.84 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.393 -1.276 . . . . 0.0 111.014 -176.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.583 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 75.2 mt-30 -65.11 -29.67 70.55 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.499 0.666 . . . . 0.0 109.4 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.16 17.09 63.2 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 114.44 -1.254 . . . . 0.0 113.891 172.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -54.36 -54.94 33.81 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.582 ' OD2' ' HG2' ' A' ' 125' ' ' LYS . 27.3 t70 -143.48 65.92 1.31 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.791 0.805 . . . . 0.0 109.464 172.047 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.603 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -55.54 -23.36 26.13 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.92 179.381 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -53.12 -52.95 57.04 Favored 'General case' 0 C--O 1.231 0.131 0 O-C-N 123.319 0.387 . . . . 0.0 111.828 -177.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.582 ' HG2' ' OD2' ' A' ' 122' ' ' ASP . 18.5 pttm -85.38 -30.01 23.97 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.176 -0.61 . . . . 0.0 111.041 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.623 HD22 ' CE1' ' A' ' 130' ' ' TYR . 36.8 mt -60.52 -43.46 97.08 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.854 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' MET . . . . . 0.44 ' O ' ' HG2' ' A' ' 131' ' ' MET . 0.0 OUTLIER -55.61 -38.64 69.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.745 0.307 . . . . 0.0 111.546 179.782 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -84.08 -40.09 18.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.934 0.397 . . . . 0.0 110.873 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.503 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.81 -17.6 63.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.846 -176.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.623 ' CE1' HD22 ' A' ' 126' ' ' LEU . 5.2 m-30 -84.95 -28.41 25.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.066 0.46 . . . . 0.0 110.34 -179.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.44 ' HG2' ' O ' ' A' ' 127' ' ' MET . 54.9 mmm -78.59 4.35 13.72 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.357 -178.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 7.2 pt20 -94.31 -14.83 25.02 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.316 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -99.65 125.25 41.35 Favored Pre-proline 0 N--CA 1.449 -0.48 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.669 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.659 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 29.0 Cg_endo -63.14 -14.21 40.31 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.056 2.504 . . . . 0.0 112.842 -174.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.3 mp -75.52 -36.15 60.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.927 0.394 . . . . 0.0 110.264 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.51 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 35.8 t80 -89.97 -33.88 16.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.152 -173.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.659 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 21.0 m -58.19 -49.29 82.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.027 178.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.447 ' N ' HG23 ' A' ' 137' ' ' VAL . 72.7 mm-40 -62.58 -41.44 98.95 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.542 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -55.31 -49.8 71.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.659 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.781 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.61 -48.8 75.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.707 177.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -59.39 -30.73 68.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.363 0.601 . . . . 0.0 110.621 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.7 m -76.2 -52.68 9.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.398 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.528 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.4 p -64.5 -30.82 71.85 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 121.121 -0.232 . . . . 0.0 111.487 -174.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.781 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 82.6 mt -60.0 -44.96 94.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.779 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -72.19 -15.17 76.68 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.406 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 65.8 mt -91.19 -36.84 8.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 120.748 0.309 . . . . 0.0 111.315 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 27.7 m -94.55 5.93 7.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -173.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 6.7 mm-40 -62.87 116.19 22.45 Favored Pre-proline 0 C--N 1.326 -0.447 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 174.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -72.25 -6.31 18.83 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 122.646 2.23 . . . . 0.0 112.337 -178.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 14.2 t 69.19 101.51 0.06 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.012 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -80.22 114.29 19.02 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.368 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -126.46 164.24 21.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.243 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -65.25 143.39 57.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.876 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -136.71 102.77 5.0 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.218 -177.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 21.5 m . . . . . 0 C--O 1.251 1.178 0 CA-C-O 118.575 -0.726 . . . . 0.0 110.088 179.067 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 7.7 t70 . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 121.184 0.516 . . . . 0.0 110.427 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 72.6 mt -67.36 -35.49 73.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.773 -172.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -58.2 -44.46 88.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.438 0.637 . . . . 0.0 109.827 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . 0.428 ' HD1' ' HB2' ' A' ' 85' ' ' ASP . 62.9 t60 -65.49 -55.27 18.77 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.293 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.34 -38.0 82.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.133 -173.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -72.23 -42.98 65.1 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 111.642 0.238 . . . . 0.0 111.642 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -76.01 -23.56 55.21 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.8 t -58.34 -32.38 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.702 174.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.51 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 25.9 mm -62.98 -37.55 79.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.814 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 85.1 mt -53.55 -42.26 67.3 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.223 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -65.44 -43.31 90.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.396 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 53.3 m -62.04 -54.09 46.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.593 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . 0.431 HG21 ' O ' ' B' ' 470' ' ' ILE . 69.2 t -47.88 -54.33 3.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.762 176.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.437 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 26.7 ttm180 -67.93 -35.73 78.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.596 -173.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -43.17 95.35 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.051 0.453 . . . . 0.0 110.133 178.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . 0.427 HD13 HD23 ' A' ' 105' ' ' LEU . 97.5 mt -67.42 -55.28 17.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.638 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 56.9 mt -54.46 -23.44 10.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.025 0.441 . . . . 0.0 111.026 176.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.573 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 15.3 tppt? -69.99 -48.88 56.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.927 -175.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . 0.416 ' HD2' ' HB3' ' B' ' 479' ' ' LYS . 2.1 mptp? -103.53 -16.8 15.44 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.474 -177.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -90.32 -51.86 5.22 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.784 -175.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -100.43 -83.38 0.44 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -173.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -111.9 -48.63 3.04 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -167.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.573 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 95.98 15.08 43.5 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.344 -0.931 . . . . 0.0 112.008 -173.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 1.9 pp -75.9 175.52 8.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.362 0.601 . . . . 0.0 112.516 -174.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -143.38 51.48 1.37 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.017 177.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 2.6 t -57.06 -45.7 83.02 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -170.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.6 OUTLIER -92.81 84.76 5.02 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.207 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 29.2 m -144.7 130.77 19.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.943 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -93.5 3.19 55.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.93 0.395 . . . . 0.0 111.023 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 8.4 ptmm? -82.34 49.33 1.41 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.529 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 5.5 p -85.11 61.37 6.83 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.547 0.689 . . . . 0.0 110.481 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 54.5 pttt -132.53 33.88 3.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.677 -177.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -96.85 -4.68 39.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.402 178.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 4.1 m . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.521 177.866 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.661 0 N-CA-C 112.233 -0.347 . . . . 0.0 112.233 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.78 77.26 3.77 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 123.176 2.584 . . . . 0.0 112.306 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -78.76 67.76 4.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.609 0.718 . . . . 0.0 110.597 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 96.2 mmm -84.04 35.38 0.53 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.321 -176.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.444 ' HA ' ' CE1' ' B' ' 465' ' ' HIS . 13.7 m-20 -81.56 -29.12 33.55 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 171.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -81.94 136.32 35.31 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.139 175.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.498 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 27.7 t -99.8 133.69 41.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.295 -174.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.2 m -55.76 134.93 51.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.924 175.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -59.88 -32.86 71.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.263 -176.315 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -60.37 -40.95 92.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.696 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -64.46 -43.07 95.41 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.159 0.504 . . . . 0.0 110.149 177.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 76.8 mt -65.45 -33.91 77.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.409 -178.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 63.0 mttm -62.5 -24.7 67.62 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -74.36 -18.02 60.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.669 0.271 . . . . 0.0 110.791 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 91.0 mt -62.27 -42.31 99.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.957 0.408 . . . . 0.0 110.479 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -70.63 -19.01 76.16 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.723 -0.672 . . . . 0.0 112.379 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -86.5 -24.75 25.45 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.85 0.357 . . . . 0.0 110.435 -178.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.635 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.5 t -68.49 108.33 3.25 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.52 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.4 -24.67 66.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.051 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.5 m -75.43 -48.64 21.89 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.817 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.2 tp -67.36 -49.3 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.802 -174.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.635 ' HG2' ' O ' ' A' ' 98' ' ' SER . 8.2 ptp180 -60.14 -28.51 67.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.279 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.467 ' O ' ' HB2' ' A' ' 106' ' ' LEU . 22.7 t -66.9 -25.68 66.5 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.043 0.449 . . . . 0.0 110.096 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 27.3 mt -76.51 -33.22 58.62 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.59 -15.97 63.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.825 177.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 103' ' ' SER . 3.9 mm? -69.12 -13.83 62.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.645 175.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -78.63 116.32 58.59 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.804 175.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.62 -26.59 82.6 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.99 2.46 . . . . 0.0 112.514 -175.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.455 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 66.2 t60 -74.56 -46.14 40.86 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.776 178.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 51.8 tp -64.77 -39.11 93.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.899 0.381 . . . . 0.0 110.916 -176.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -67.14 -33.22 74.97 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 -70.17 -36.42 74.68 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.24 178.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 109' ' ' HIS . 95.3 mt -58.39 -54.31 48.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.908 175.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 70.7 mtp -55.83 -50.42 70.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.163 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.591 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 48.7 t -59.21 -40.24 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.284 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 16.7 m-20 -60.37 -47.23 86.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.171 0.51 . . . . 0.0 111.088 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 55.9 tp -64.2 -37.74 88.54 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.21 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.401 ' HB2' HD12 ' B' ' 478' ' ' ILE . 26.8 t70 -63.94 -35.63 81.32 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.119 -179.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 74.5 mt-30 -62.45 -28.92 70.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.582 0.706 . . . . 0.0 110.426 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 70.57 27.39 72.61 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 114.443 -1.253 . . . . 0.0 113.61 171.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -56.5 -55.18 37.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.95 0.405 . . . . 0.0 110.4 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.561 ' O ' HD11 ' A' ' 126' ' ' LEU . 27.5 t70 -151.57 77.22 1.23 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.542 0.687 . . . . 0.0 109.723 174.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.61 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.6 OUTLIER -53.68 -23.72 12.31 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.802 -1.09 . . . . 0.0 111.629 178.618 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.9 -51.76 67.92 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -175.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -71.06 -50.06 37.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.8 176.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.561 HD11 ' O ' ' A' ' 122' ' ' ASP . 11.1 mp -51.73 -45.65 63.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -175.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' MET . . . . . 0.445 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.1 OUTLIER -54.38 -45.63 72.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.835 0.35 . . . . 0.0 111.658 -179.556 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 42.5 mtm180 -83.44 -35.44 24.99 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.078 -176.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -73.16 -16.86 61.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.563 -177.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.494 ' HB3' ' CG ' ' A' ' 136' ' ' PHE . 13.1 m-30 -89.16 -27.08 20.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.088 0.471 . . . . 0.0 110.743 177.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.416 ' HE3' HG13 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -79.0 6.29 9.69 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.543 -177.563 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 30.0 pt20 -102.38 -22.85 14.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.845 0.355 . . . . 0.0 110.869 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -103.33 138.6 19.59 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 121.048 0.451 . . . . 0.0 111.37 -175.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.694 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 35.2 Cg_endo -63.42 -13.53 36.74 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.829 3.019 . . . . 0.0 114.043 -171.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.402 HD23 ' CD2' ' A' ' 109' ' ' HIS . 11.0 mp -77.15 -39.15 50.15 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.322 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.494 ' CG ' ' HB3' ' A' ' 130' ' ' TYR . 39.8 t80 -91.51 -33.77 15.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.0 0.428 . . . . 0.0 110.29 -174.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.694 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 15.5 m -56.72 -51.17 70.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.339 179.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.501 ' N ' HG21 ' A' ' 137' ' ' VAL . 39.5 mm-40 -66.48 -35.35 80.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.597 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -56.4 -51.11 69.56 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 173.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.739 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.01 -47.4 83.27 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.702 178.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.72 -33.16 71.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.29 0.567 . . . . 0.0 110.633 -176.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.4 m -76.12 -48.63 19.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.391 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.499 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 25.6 p -67.19 -30.7 70.72 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.91 -174.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 74.6 mt -58.95 -47.14 86.14 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.833 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.33 -27.82 73.57 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.248 -176.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 69.8 mt -76.62 -42.12 34.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.805 0.336 . . . . 0.0 110.726 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 23.4 m -90.2 3.55 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -174.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.637 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 7.4 mm-40 -53.64 114.44 6.27 Favored Pre-proline 0 N--CA 1.465 0.287 0 O-C-N 123.185 0.303 . . . . 0.0 110.473 176.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.74 -11.02 23.82 Favored 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 122.644 2.23 . . . . 0.0 112.077 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 42.7 m -98.27 176.58 5.67 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.794 -178.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 64.35 62.57 0.81 Allowed 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.629 0.58 . . . . 0.0 110.297 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 71.44 125.23 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.898 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -97.08 -2.19 43.76 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.691 -173.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -80.35 43.45 0.64 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.48 -177.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 9.4 p . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.586 179.611 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 N--CA 1.483 1.19 0 CA-C-O 120.498 0.189 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 82.4 mt -63.4 -35.08 70.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.363 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -54.99 -40.23 69.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.356 174.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . 0.444 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 57.5 t60 -74.97 -47.28 30.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.566 177.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.589 ' O ' HG12 ' B' ' 470' ' ' ILE . 40.5 mt-10 -57.29 -45.96 83.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.79 -176.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . 0.445 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 21.8 mtm180 -64.04 -29.57 70.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -177.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . 0.402 ' ND2' ' HB3' ' A' ' 85' ' ' ASP . 0.0 OUTLIER -76.13 -32.63 59.24 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.699 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.4 t -66.14 -35.7 75.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.388 176.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.589 HG12 ' O ' ' B' ' 466' ' ' GLU . 30.7 mm -63.06 -33.78 62.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.246 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . 0.438 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 90.1 mt -57.45 -48.67 78.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.357 177.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . 0.498 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.1 mp0 -58.88 -36.78 75.21 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.094 178.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 57.5 m -63.96 -58.82 5.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.987 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 94.2 t -50.45 -44.55 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.808 175.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 31.2 mmt180 -62.88 -44.04 97.19 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.015 -177.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . 0.407 ' CZ ' ' HA ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -67.56 -50.28 59.23 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.67 -179.348 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . 0.607 ' O ' ' HB2' ' B' ' 481' ' ' ASP . 83.9 mt -60.79 -59.27 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.746 -174.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.41 HG21 ' HB2' ' B' ' 482' ' ' PHE . 67.9 mt -58.81 -23.92 24.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.301 -177.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.487 ' HA ' ' CA ' ' B' ' 484' ' ' GLY . 5.6 tmtt? -64.57 -42.13 95.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.652 -177.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.72 -14.35 12.01 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . 0.607 ' HB2' ' O ' ' B' ' 477' ' ' ILE . 0.4 OUTLIER -89.41 -40.31 12.81 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -179.301 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . 0.41 ' HB2' HG21 ' B' ' 478' ' ' ILE . 89.4 m-85 -116.27 -91.81 0.53 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -174.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -112.81 -49.53 2.93 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.979 -0.289 . . . . 0.0 110.862 -173.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.487 ' CA ' ' HA ' ' B' ' 479' ' ' LYS . . . 64.94 45.93 90.9 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.002 -177.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.403 ' HB3' ' HB2' ' B' ' 488' ' ' ASN . 80.8 mt -70.59 139.44 51.43 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.478 -0.361 . . . . 0.0 110.6 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -113.57 -35.99 5.05 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.418 -177.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 13.6 t -129.39 24.17 5.5 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.43 0.633 . . . . 0.0 110.91 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . 0.403 ' HB2' ' HB3' ' B' ' 485' ' ' LEU . 13.7 m120 -117.93 104.43 10.9 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.7 -176.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 70.9 m -92.31 147.86 22.59 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.122 176.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -120.06 20.77 12.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.172 0.511 . . . . 0.0 110.828 -178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . 0.437 ' O ' ' HD3' ' B' ' 491' ' ' LYS . 0.1 OUTLIER -83.1 163.93 20.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.208 -179.588 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 6.8 p -161.64 168.63 23.07 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.069 176.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 89.8 mttt 54.93 64.46 1.8 Allowed 'General case' 0 C--O 1.232 0.177 0 O-C-N 123.64 0.587 . . . . 0.0 111.107 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -62.29 -40.24 95.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.625 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 44.0 t . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.79 -0.624 . . . . 0.0 109.863 -179.767 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.666 0 N-CA-C 112.106 -0.398 . . . . 0.0 112.106 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -61.75 -33.14 86.15 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.736 2.291 . . . . 0.0 112.546 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -127.48 115.18 18.49 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.829 0.347 . . . . 0.0 110.235 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 27.3 ttt -155.44 67.25 0.64 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.255 0.55 . . . . 0.0 109.572 177.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.611 ' HA ' ' HD1' ' B' ' 465' ' ' HIS . 14.6 p-10 -89.59 -27.34 20.28 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.315 -176.196 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.412 ' HA ' ' OE1' ' B' ' 472' ' ' GLN . 37.4 mmt180 -89.62 132.89 34.9 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.321 0.581 . . . . 0.0 110.368 179.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 85.2 t -106.7 137.29 38.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.712 -174.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.3 m -71.41 145.78 49.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.17 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.524 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.3 OUTLIER -58.8 -31.95 68.9 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.403 -176.469 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -56.61 -39.08 72.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.755 0.312 . . . . 0.0 110.703 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -70.45 -40.66 73.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.152 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.41 -31.36 70.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.254 -178.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 62.2 mtpt -60.81 -28.37 68.73 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 178.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 -72.32 -16.61 61.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.724 -0.217 . . . . 0.0 111.548 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.49 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 97.0 mt -55.74 -56.48 19.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.535 -176.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -66.01 -21.98 70.17 Favored Glycine 0 CA--C 1.52 0.379 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.691 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -79.62 -20.52 46.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.058 0.456 . . . . 0.0 110.818 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.457 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.9 m -78.8 123.18 26.94 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.364 -177.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.61 -27.85 69.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.929 -173.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.1 m -75.12 -39.66 60.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.039 0.447 . . . . 0.0 110.868 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.553 ' O ' HD13 ' A' ' 105' ' ' LEU . 29.4 tp -73.0 -49.09 30.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.521 -172.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.691 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 9.0 ptp180 -57.18 -33.52 67.55 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.919 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 73.6 m -63.08 -42.06 99.56 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.551 HD12 HD11 ' A' ' 101' ' ' LEU . 0.6 OUTLIER -87.94 -19.13 27.69 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.923 -0.711 . . . . 0.0 111.653 -179.192 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.553 HD13 ' O ' ' A' ' 101' ' ' LEU . 7.5 mp -64.82 -20.99 66.7 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.278 0.561 . . . . 0.0 110.622 170.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.691 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 97.7 mt -71.16 -12.71 61.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.965 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -78.61 118.49 72.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.868 175.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.94 -34.68 92.65 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.421 2.747 . . . . 0.0 112.86 -177.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.544 ' CD2' HD21 ' A' ' 135' ' ' LEU . 60.9 t60 -66.26 -48.76 69.43 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.694 0.283 . . . . 0.0 110.838 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.455 HD22 ' O ' ' A' ' 104' ' ' LEU . 48.7 tp -63.07 -41.79 99.51 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.101 -176.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -66.32 -34.57 78.28 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.193 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -67.67 -28.56 67.8 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 120.597 0.237 . . . . 0.0 111.086 176.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.93 -53.41 18.01 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.447 ' HG3' HG22 ' B' ' 474' ' ' VAL . 33.6 ttp -56.47 -42.91 79.0 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.021 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 20.5 t -62.94 -45.91 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 120.699 0.285 . . . . 0.0 111.22 177.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.452 ' HB2' ' HH ' ' A' ' 130' ' ' TYR . 69.8 m-20 -62.99 -40.95 99.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.02 0.438 . . . . 0.0 111.243 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 46.1 tp -62.63 -37.21 85.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.6 178.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -62.99 -34.63 77.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.412 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -58.91 -27.0 64.84 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.826 -178.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.535 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 65.78 16.93 64.38 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.33 -0.85 . . . . 0.0 113.856 170.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -72.68 -42.96 63.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.311 0.576 . . . . 0.0 109.584 -175.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.429 ' OD1' ' HG2' ' A' ' 125' ' ' LYS . 4.2 t70 -150.04 51.43 0.91 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 173.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.535 ' HG3' ' HA2' ' A' ' 120' ' ' GLY . 0.0 OUTLIER -56.55 -20.71 22.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.66 -1.155 . . . . 0.0 110.582 175.242 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.478 ' H ' ' HD2' ' A' ' 123' ' ' LYS . . . -57.01 -53.81 53.86 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.271 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.429 ' HG2' ' OD1' ' A' ' 122' ' ' ASP . 65.0 pttt -79.61 -28.42 41.0 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.554 178.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.415 ' HB2' ' HA ' ' A' ' 123' ' ' LYS . 95.8 mt -63.51 -40.37 96.88 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.589 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' MET . . . . . 0.461 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.4 OUTLIER -52.92 -34.28 54.44 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.915 0.388 . . . . 0.0 110.857 177.185 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -79.73 -48.79 13.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.786 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.581 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.35 -20.12 64.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.206 -175.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.51 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.3 m-30 -85.04 -36.44 21.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.106 0.479 . . . . 0.0 110.848 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.67 5.94 14.19 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.144 -176.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.581 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.1 pt20 -100.3 -24.09 14.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.905 0.383 . . . . 0.0 110.14 178.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.57 136.15 19.4 Favored Pre-proline 0 N--CA 1.452 -0.356 0 CA-C-O 121.149 0.499 . . . . 0.0 110.881 178.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.655 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 34.1 Cg_endo -64.04 -14.33 42.82 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 123.532 2.821 . . . . 0.0 114.0 -170.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.544 HD21 ' CD2' ' A' ' 109' ' ' HIS . 4.3 mp -69.54 -39.31 77.54 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.942 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.51 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 60.8 t80 -92.2 -30.82 15.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.086 0.47 . . . . 0.0 110.093 -173.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.655 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 35.9 m -59.0 -50.9 78.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.262 -178.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 11.7 pt-20 -72.24 -28.56 63.22 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.876 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -59.53 -49.0 79.47 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 172.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.804 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.57 -45.58 92.25 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.562 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.69 -32.66 73.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.518 -177.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.4 ' O ' HG13 ' A' ' 146' ' ' ILE . 69.0 m -70.76 -51.38 27.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.995 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.425 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.0 p -65.26 -27.42 68.64 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.966 -175.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.804 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.3 mt -60.36 -54.47 45.24 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 120.745 0.307 . . . . 0.0 110.23 177.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.76 -14.29 57.91 Favored Glycine 0 CA--C 1.516 0.127 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.833 -176.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 143' ' ' CYS . 64.5 mt -90.67 -30.48 4.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 120.808 0.337 . . . . 0.0 111.142 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 15.2 m -103.38 -18.35 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.546 -176.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -69.3 120.57 77.71 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 120.82 0.343 . . . . 0.0 110.307 177.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.26 -21.69 67.65 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 123.15 2.567 . . . . 0.0 112.029 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 26.9 t -79.39 90.05 5.01 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 174.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -75.1 128.63 35.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.996 0.427 . . . . 0.0 110.419 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -81.33 134.57 35.6 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 176.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -74.99 133.22 41.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.101 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -122.27 -161.87 0.96 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.372 -174.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 15.3 p . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.615 -0.707 . . . . 0.0 110.304 179.203 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 12.6 t70 . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 121.006 0.431 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 42.7 mt -65.87 -34.76 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.637 -171.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -65.13 -36.98 85.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.311 0.577 . . . . 0.0 109.823 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . 0.611 ' HD1' ' HA ' ' A' ' 85' ' ' ASP . 62.7 t60 -68.24 -55.72 11.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.019 173.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.52 ' O ' ' HB ' ' B' ' 469' ' ' VAL . 40.1 mt-10 -56.5 -51.44 68.49 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.503 -0.772 . . . . 0.0 112.493 -172.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . 0.461 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 96.7 mtt180 -67.59 -25.73 65.92 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -174.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -29.99 37.78 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 177.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . 0.52 ' HB ' ' O ' ' B' ' 466' ' ' GLU . 8.5 t -60.93 -38.53 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.921 174.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.474 HG23 ' CZ ' ' A' ' 136' ' ' PHE . 10.6 mm -63.21 -38.5 82.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.304 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . 0.486 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 80.3 mt -58.65 -46.06 87.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.119 177.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . 0.457 HE21 ' HA ' ' B' ' 469' ' ' VAL . 10.3 mt-30 -62.88 -33.2 74.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.581 177.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 63.0 m -69.66 -54.97 11.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.234 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . 0.459 HG21 ' O ' ' B' ' 470' ' ' ILE . 54.6 t -47.08 -50.02 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.19 175.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' B' ' 471' ' ' LEU . 35.8 mmt180 -63.61 -34.45 77.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.895 0.378 . . . . 0.0 111.171 -175.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -75.35 -49.34 19.39 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.569 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . 0.541 ' O ' ' HB2' ' B' ' 481' ' ' ASP . 95.5 mt -60.58 -58.37 7.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.572 -176.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.473 HG22 ' H ' ' B' ' 484' ' ' GLY . 50.2 mt -56.53 -23.6 17.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.585 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.57 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 40.9 ttmt -64.41 -48.65 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -178.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.24 -13.54 15.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.895 0.379 . . . . 0.0 111.256 -175.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' B' ' 477' ' ' ILE . 0.6 OUTLIER -88.5 -50.13 6.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.738 177.128 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . 0.407 ' HB2' HG21 ' B' ' 478' ' ' ILE . 97.2 m-85 -119.09 -87.02 0.64 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -171.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -112.47 -50.2 2.91 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -167.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.57 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 83.82 50.23 4.49 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.258 -173.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 73.6 mt -88.32 149.08 23.96 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.741 0.305 . . . . 0.0 110.823 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 60.86 21.0 11.21 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.792 -178.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 60.4 p -144.96 -41.91 0.24 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.175 -176.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -119.59 121.89 40.35 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.453 178.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 45.9 m -56.54 126.06 24.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.077 179.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -77.91 77.16 4.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.493 0.663 . . . . 0.0 111.254 -175.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.42 24.71 0.95 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.815 178.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 20.6 m -95.17 25.18 4.42 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.412 0.625 . . . . 0.0 110.333 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -118.14 136.05 53.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.188 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -83.16 -30.63 27.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.292 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 3.6 p . . . . . 0 C--O 1.25 1.104 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.818 -179.793 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.779 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -57.57 -48.52 16.8 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.735 2.29 . . . . 0.0 111.878 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 -98.08 74.47 2.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.917 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 16.0 tpt -84.88 -3.54 58.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.81 0.814 . . . . 0.0 109.779 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.507 ' HB3' ' ND2' ' B' ' 468' ' ' ASN . 23.2 m-20 -81.63 3.12 26.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.643 179.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.551 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 36.4 ptt180 -76.09 138.61 40.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.285 177.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 91.4 t -100.28 139.08 22.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.895 0.378 . . . . 0.0 110.651 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.1 m -65.42 138.96 58.47 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.341 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.442 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.75 -33.17 72.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.219 -176.608 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -63.17 -40.42 97.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.746 177.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.64 -41.82 98.21 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 93.3 mt -67.38 -32.21 72.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.839 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.442 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 94.3 mttt -61.35 -20.68 63.26 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -77.25 -17.9 58.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.589 0.233 . . . . 0.0 111.131 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 88.2 mt -62.63 -49.57 74.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.273 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -70.61 -14.86 72.81 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.418 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -91.02 -22.59 20.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.882 0.372 . . . . 0.0 110.961 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.654 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 33.0 t -68.49 116.64 9.27 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.386 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.69 -29.63 70.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.045 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 57.5 m -77.44 -37.46 51.53 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.813 -177.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.481 HD12 ' CD2' ' A' ' 139' ' ' PHE . 48.5 tp -75.28 -47.09 29.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.312 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.654 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -60.03 -31.43 69.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.906 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 21.3 t -66.26 -22.92 66.33 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.202 0.525 . . . . 0.0 110.228 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 28.0 mt -80.52 -32.55 36.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.687 178.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.7 mp -69.6 -10.52 58.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.96 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.52 -11.52 53.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.843 174.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -86.0 114.61 58.02 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 173.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -54.72 -30.04 64.85 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.947 2.431 . . . . 0.0 112.608 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -68.26 -45.08 74.15 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.901 178.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 55.3 tp -66.33 -38.61 88.06 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.75 0.31 . . . . 0.0 111.188 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -67.35 -30.99 70.95 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.656 -0.418 . . . . 0.0 109.959 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -73.9 -32.52 63.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.819 177.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.419 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 72.3 mt -59.02 -50.73 72.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.36 176.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 60.0 mtm -56.77 -49.83 74.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.559 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.646 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 60.1 t -59.59 -46.53 93.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.153 -178.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -60.29 -48.26 82.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.024 0.44 . . . . 0.0 111.476 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 61.9 tp -62.98 -36.63 84.15 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.663 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.417 ' OD1' ' HD2' ' B' ' 475' ' ' ARG . 19.3 t70 -66.11 -33.53 76.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.865 -177.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.646 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 60.5 mt-30 -60.27 -28.72 68.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.289 0.566 . . . . 0.0 110.628 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.39 29.37 71.78 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.089 -0.959 . . . . 0.0 114.211 169.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -76.28 -55.1 5.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 117.231 0.515 . . . . 0.0 110.026 176.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -131.25 41.12 3.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.357 0.599 . . . . 0.0 110.146 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.587 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.78 -31.62 5.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.607 -1.179 . . . . 0.0 112.109 177.756 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -54.19 -58.16 8.4 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -177.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -80.02 -26.42 39.82 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.01 -178.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.437 HD22 ' HH ' ' A' ' 130' ' ' TYR . 94.9 mt -62.53 -41.54 98.94 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.5 177.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' MET . . . . . 0.428 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -51.75 -39.15 58.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 0.0 111.12 178.208 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 54.2 mtp180 -81.6 -43.23 18.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.769 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.629 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.86 -26.95 68.84 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.52 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.438 ' HA ' ' HG3' ' A' ' 133' ' ' GLU . 3.4 m-30 -80.54 -19.45 45.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.791 0.329 . . . . 0.0 111.078 -178.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.44 ' HA ' ' HE1' ' A' ' 131' ' ' MET . 2.5 mmt -77.57 -4.92 48.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.348 -177.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.629 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.5 pt20 -100.99 -8.54 22.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.978 0.418 . . . . 0.0 110.472 178.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.525 ' O ' HG22 ' A' ' 137' ' ' VAL . 0.6 OUTLIER -94.35 118.48 67.04 Favored Pre-proline 0 N--CA 1.45 -0.472 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.74 -175.025 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.613 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 16.0 Cg_endo -56.39 -24.53 52.57 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.92 2.413 . . . . 0.0 112.168 -175.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.0 mp -71.04 -43.01 68.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.211 0.529 . . . . 0.0 109.993 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.467 ' CZ ' HG23 ' B' ' 470' ' ' ILE . 29.7 t80 -81.97 -31.33 31.24 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.105 -176.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.525 HG22 ' O ' ' A' ' 133' ' ' GLU . 86.9 t -61.98 -43.53 97.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.481 177.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 48.0 mt-10 -65.97 -42.71 89.56 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.08 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . 0.481 ' CD2' HD12 ' A' ' 101' ' ' LEU . 75.5 t80 -57.21 -48.91 77.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.158 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.776 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.79 -48.17 77.99 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.562 -177.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -66.75 -26.8 67.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.192 0.52 . . . . 0.0 110.416 -174.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 94.0 m -79.72 -48.44 13.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.106 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.9 p -64.31 -29.03 70.13 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.55 0.214 . . . . 0.0 111.02 -175.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.776 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 73.8 mt -59.61 -52.83 63.84 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.508 178.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.45 -15.23 63.45 Favored Glycine 0 C--N 1.329 0.188 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.533 -176.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 64.4 mt -88.4 -26.08 5.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 120.766 0.317 . . . . 0.0 111.082 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 13.6 m -103.67 -14.1 8.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.501 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.499 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 44.8 mt-10 -71.73 118.07 63.3 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.435 176.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -62.7 -20.85 72.14 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.818 2.346 . . . . 0.0 111.991 178.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 19.5 m -78.2 103.93 8.45 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.707 174.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . 0.467 ' HA ' ' OE1' ' A' ' 151' ' ' GLN . 10.8 mm-40 -66.62 137.91 57.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.745 0.307 . . . . 0.0 110.897 -179.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -66.19 126.59 29.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.288 177.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -71.05 129.22 38.43 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.523 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -143.07 93.45 2.5 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.001 -176.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 22.4 m . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.567 -0.73 . . . . 0.0 110.448 -179.74 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 54.9 mt -60.47 -36.22 68.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.683 -174.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -58.72 -42.41 88.66 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 110.218 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -70.25 -50.36 40.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.809 177.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.577 ' O ' HG12 ' B' ' 470' ' ' ILE . 37.5 mt-10 -61.25 -48.28 82.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.286 -172.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . 0.428 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 37.2 mtm180 -58.32 -36.43 73.38 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . 0.507 ' ND2' ' HB3' ' A' ' 85' ' ' ASP . 0.0 OUTLIER -76.73 -27.31 55.36 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -179.062 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . 0.481 ' HA ' ' CG ' ' B' ' 472' ' ' GLN . 2.4 t -72.56 -29.54 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 114.717 -1.129 . . . . 0.0 110.513 177.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.577 HG12 ' O ' ' B' ' 466' ' ' GLU . 17.2 mm -68.62 -34.5 65.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 174.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 91.0 mt -60.48 -41.89 95.17 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.362 176.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . 0.551 ' NE2' ' HA ' ' A' ' 86' ' ' ARG . 4.6 mm-40 -52.2 -48.38 65.1 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.61 0.719 . . . . 0.0 110.061 175.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . 0.434 ' O ' HG13 ' B' ' 477' ' ' ILE . 38.1 m -61.51 -54.06 48.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.684 -179.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 89.8 t -50.89 -49.87 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.684 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 24.1 mmm180 -67.1 -28.21 67.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.521 -176.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -76.33 -50.32 14.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.672 0.273 . . . . 0.0 110.672 178.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . 0.434 HG13 ' O ' ' B' ' 473' ' ' CYS . 70.4 mt -63.11 -62.73 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.125 -173.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 46.3 mt -54.83 -24.7 14.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.461 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 21.8 tptm -70.98 -39.43 72.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -175.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . 0.407 ' HD3' ' C ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER -114.72 -15.6 11.9 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.82 -178.076 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -91.68 -59.64 2.08 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.04 0.447 . . . . 0.0 111.694 -176.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -87.32 -85.29 0.17 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.303 -170.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -107.97 -50.12 3.1 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.367 -174.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.437 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 91.69 9.06 63.17 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.577 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 76.7 mt -75.65 140.06 42.34 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.372 0.606 . . . . 0.0 111.325 -176.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -148.7 -52.01 0.17 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.173 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 5.1 t -80.73 59.7 3.74 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.561 -1.2 . . . . 0.0 110.57 177.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -121.56 152.74 38.88 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.296 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 17.1 m -69.25 -3.79 15.2 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.495 -170.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -83.08 -22.94 33.32 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.417 0.627 . . . . 0.0 110.531 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -124.24 14.49 9.02 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.032 -177.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 57.0 m -113.71 87.96 2.73 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.071 0.462 . . . . 0.0 111.101 -176.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -94.21 17.99 11.7 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.99 -54.45 47.02 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.346 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.379 -0.819 . . . . 0.0 110.633 -179.598 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.516 ' H3 ' ' CD ' ' A' ' 153' ' ' GLU . . . . . . . . 0 N--CA 1.481 1.7 0 N-CA-C 112.369 -0.293 . . . . 0.0 112.369 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -67.27 -37.63 17.55 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.77 2.313 . . . . 0.0 111.564 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -93.26 -46.75 7.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.011 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 69.2 mtm -85.72 77.85 9.7 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 175.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -92.36 -15.39 27.35 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.303 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -54.86 127.77 30.13 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 121.084 0.469 . . . . 0.0 110.766 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.429 HG21 ' HB ' ' A' ' 147' ' ' VAL . 14.9 p -72.77 148.02 9.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.327 -0.852 . . . . 0.0 111.181 -174.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.4 m -68.41 144.84 54.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.281 -177.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -26.51 68.35 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.793 -175.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 24.2 pt20 -60.82 -35.3 76.18 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.135 0.493 . . . . 0.0 110.313 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -70.7 -37.57 73.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.144 177.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.0 mt -68.07 -37.58 81.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.149 178.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -61.7 -20.16 63.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.889 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -75.89 -17.75 59.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.965 0.412 . . . . 0.0 110.553 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.481 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 87.8 mt -65.94 -45.0 83.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.982 -178.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -68.9 -13.83 67.01 Favored Glycine 0 CA--C 1.52 0.344 0 CA-C-N 116.073 -0.512 . . . . 0.0 113.496 -176.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -107.31 5.9 27.96 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.122 0.487 . . . . 0.0 110.934 179.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 67.9 m -93.4 112.53 24.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.844 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.91 -26.24 68.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.543 -178.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 27.4 m -70.45 -42.24 71.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.532 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.481 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 24.0 tp -73.63 -44.83 55.96 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.889 -173.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.496 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 7.8 ptp180 -60.77 -28.32 68.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.233 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.5 t -61.66 -27.29 68.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.371 0.605 . . . . 0.0 109.861 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 21.0 mt -83.98 -32.54 24.94 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.132 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.5 mp -75.76 2.67 11.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.14 0.495 . . . . 0.0 110.648 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 73.9 mt -79.39 -9.2 59.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.088 174.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -90.4 117.45 68.02 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.824 176.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.53 -39.55 87.72 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.159 2.573 . . . . 0.0 113.033 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -68.8 -41.96 77.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.81 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.461 HD22 ' O ' ' A' ' 110' ' ' LEU . 4.4 tt -60.15 -40.05 88.53 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -179.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.517 ' O ' HG21 ' A' ' 115' ' ' VAL . 59.7 mtm-85 -66.03 -40.53 91.1 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.419 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -63.88 -36.57 84.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.997 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.405 HD12 ' HB2' ' A' ' 136' ' ' PHE . 90.6 mt -58.62 -47.18 85.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 74.4 mtp -58.66 -47.45 84.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.978 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.517 HG21 ' O ' ' A' ' 111' ' ' ARG . 98.6 t -58.15 -42.49 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 CA-C-O 120.963 0.411 . . . . 0.0 111.188 178.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -66.81 -44.55 80.91 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.134 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.548 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 50.7 tp -72.66 -31.09 64.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.415 -177.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.433 ' HB2' HG13 ' B' ' 478' ' ' ILE . 32.8 t70 -54.91 -44.05 73.84 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.027 0.441 . . . . 0.0 110.662 176.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.451 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 53.3 mt-30 -67.18 -30.7 70.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.008 -176.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.01 21.92 68.27 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.046 -0.979 . . . . 0.0 113.324 173.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -54.1 -50.09 67.63 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.834 0.35 . . . . 0.0 110.873 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.403 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 23.5 t0 -135.16 66.62 1.52 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.667 0.746 . . . . 0.0 109.367 172.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.572 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -52.74 -30.11 30.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.684 -1.143 . . . . 0.0 111.363 175.929 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.68 -40.3 96.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.807 0.337 . . . . 0.0 111.18 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -78.87 -47.92 15.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.739 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 82.3 mt -56.77 -47.1 80.87 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.635 -175.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' MET . . . . . 0.489 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.5 OUTLIER -56.03 -35.47 66.9 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -177.754 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -83.87 -44.16 14.58 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.114 0.483 . . . . 0.0 110.538 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.523 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.03 -21.17 65.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.025 -176.067 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.548 ' CE2' ' HB2' ' A' ' 117' ' ' LEU . 3.6 m-30 -81.66 -29.15 33.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.875 0.369 . . . . 0.0 111.006 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.454 ' HE2' ' HA ' ' A' ' 131' ' ' MET . 2.7 mmt -77.57 -4.33 45.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.349 -176.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.9 pt20 -100.89 0.2 38.02 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 176.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -105.89 118.42 55.24 Favored Pre-proline 0 N--CA 1.449 -0.516 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.366 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.662 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 19.2 Cg_endo -60.99 -13.24 26.34 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.985 2.456 . . . . 0.0 112.108 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.77 -48.2 48.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.769 173.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.54 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 37.0 t80 -88.62 -29.86 19.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.829 0.347 . . . . 0.0 110.731 -169.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.662 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.9 m -56.52 -45.75 82.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.985 176.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.472 ' N ' HG22 ' A' ' 137' ' ' VAL . 34.5 mm-40 -58.32 -49.31 77.62 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.352 176.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -54.14 -49.43 69.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.961 177.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.743 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.61 -52.73 59.6 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.28 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -62.45 -29.5 70.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.293 0.568 . . . . 0.0 110.44 -174.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 97.6 m -81.11 -46.76 14.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.605 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 29.5 p -65.28 -31.86 73.23 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.4 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.743 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 65.7 mt -59.11 -41.03 87.19 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.693 178.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.41 -28.23 72.71 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.123 -178.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 62.3 mt -80.16 -36.22 16.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-O 121.053 0.454 . . . . 0.0 110.485 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.444 ' O ' ' HD3' ' A' ' 149' ' ' PRO . 19.0 m -93.61 7.44 5.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.02 -176.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.618 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 37.1 mt-10 -60.45 110.97 3.35 Favored Pre-proline 0 C--O 1.233 0.229 0 CA-C-O 120.534 0.207 . . . . 0.0 110.461 174.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 69.4 Cg_endo -86.41 -2.21 8.48 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.852 2.368 . . . . 0.0 112.191 177.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 81.8 p 55.19 -169.48 0.08 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.172 -176.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 59.69 45.22 13.23 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.169 0.509 . . . . 0.0 110.416 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -57.75 130.85 48.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.041 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.516 ' CD ' ' H3 ' ' A' ' 81' ' ' GLY . 55.3 mt-10 -86.1 156.4 20.39 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.73 -176.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 57.75 37.8 27.28 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.965 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 25.9 p . . . . . 0 C--O 1.25 1.094 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.001 179.573 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 10.0 t70 . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.94 0.4 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.53 -30.46 47.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.775 -171.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 70.1 mtm180 -61.33 -46.82 88.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.605 0.717 . . . . 0.0 109.274 177.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -64.72 -48.12 75.8 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.382 177.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.599 ' O ' HG12 ' B' ' 470' ' ' ILE . 40.4 mt-10 -59.36 -47.8 84.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.595 -177.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . 0.489 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 19.8 mtm180 -63.22 -40.76 98.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.73 -25.49 53.57 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -178.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.13 -37.46 79.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.154 171.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.599 HG12 ' O ' ' B' ' 466' ' ' GLU . 36.2 mm -60.01 -36.87 69.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.125 177.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . 0.545 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 93.1 mt -53.24 -49.93 65.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.387 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -63.69 -40.61 97.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.922 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 61.6 m -59.04 -50.89 72.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.025 0.44 . . . . 0.0 110.035 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . 0.629 ' O ' HG12 ' B' ' 478' ' ' ILE . 85.3 t -56.05 -58.45 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.541 175.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' B' ' 471' ' ' LEU . 7.2 ptp180 -71.87 -20.2 61.84 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -169.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.53 -43.84 92.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 171.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 88.5 mt -70.14 -53.71 22.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.139 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.629 HG12 ' O ' ' B' ' 474' ' ' VAL . 10.1 mm -53.3 -31.88 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.664 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 11.7 tppt? -53.23 -38.06 62.62 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.134 -174.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.77 -12.23 12.17 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.367 177.628 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -88.47 -60.61 1.92 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.352 -176.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . 0.526 ' HB2' HG21 ' B' ' 478' ' ' ILE . 98.4 m-85 -107.27 -87.22 0.48 Allowed 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.107 -0.637 . . . . 0.0 112.18 -174.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . 0.431 ' H ' HG22 ' B' ' 478' ' ' ILE . 91.7 m-85 -112.41 -50.21 2.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.113 0.482 . . . . 0.0 111.199 -174.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.501 ' CA ' ' HA ' ' B' ' 479' ' ' LYS . . . 80.83 38.56 15.8 Favored Glycine 0 N--CA 1.444 -0.827 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.668 177.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.412 HD13 ' O ' ' B' ' 485' ' ' LEU . 3.3 pp -108.32 149.59 28.47 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.872 0.368 . . . . 0.0 110.28 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -114.54 -8.54 12.75 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.732 0.301 . . . . 0.0 110.825 -177.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 60.7 p 51.81 27.64 4.36 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.843 0.857 . . . . 0.0 111.843 -177.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -127.53 -59.56 1.21 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.368 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 16.3 m -72.73 103.8 3.75 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.227 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -100.12 43.09 1.07 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.601 0.715 . . . . 0.0 109.466 176.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -94.04 17.72 11.9 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.636 -175.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 8.4 t -71.95 139.36 48.65 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 21.8 ttmm -71.88 94.91 1.48 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.013 -174.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 67.69 -60.33 0.39 Allowed 'General case' 0 N--CA 1.463 0.177 0 O-C-N 124.268 0.98 . . . . 0.0 112.44 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 24.2 t . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.018 178.813 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.792 0 N-CA-C 112.002 -0.439 . . . . 0.0 112.002 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -70.6 165.89 30.42 Favored 'Trans proline' 0 C--O 1.233 0.236 0 C-N-CA 123.183 2.588 . . . . 0.0 111.935 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -108.86 69.76 0.72 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.886 0.374 . . . . 0.0 111.161 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 48.5 tpp -81.06 151.78 28.2 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 175.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.401 ' CB ' HD22 ' B' ' 468' ' ' ASN . 19.0 m-20 62.49 40.85 10.35 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.259 0.552 . . . . 0.0 110.315 -175.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.474 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 39.8 ptt180 -75.59 150.0 38.15 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.718 -179.26 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.405 ' CG2' HG22 ' B' ' 469' ' ' VAL . 88.7 t -109.28 138.02 38.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.5 m -63.57 140.14 58.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.268 0.556 . . . . 0.0 110.887 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.522 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 10.2 tp -58.54 -40.04 81.89 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.05 -177.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -56.71 -37.44 70.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.722 178.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -67.53 -41.73 83.88 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.23 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.458 ' O ' HD13 ' A' ' 95' ' ' LEU . 83.7 mt -69.69 -32.41 71.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.647 -176.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 9.2 mtpm? -62.82 -26.17 68.62 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -69.47 -21.5 63.7 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.734 0.302 . . . . 0.0 111.14 -177.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 92' ' ' LEU . 8.6 mp -64.54 -41.07 96.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.32 -174.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.69 -20.84 68.61 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.439 177.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -89.61 -22.9 22.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.72 0.295 . . . . 0.0 110.911 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.686 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 37.4 t -67.4 111.1 3.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.545 -177.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.31 -26.81 68.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.679 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.3 m -71.87 -48.04 48.63 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.049 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.3 tp -70.7 -46.72 62.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.793 -173.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.686 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -58.56 -29.83 66.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.876 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 33.7 t -67.16 -24.33 65.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.07 0.462 . . . . 0.0 110.049 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.5 mt -84.02 -36.11 23.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.678 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.449 HD21 HD12 ' B' ' 477' ' ' ILE . 11.2 mp -63.86 -22.53 66.96 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.433 177.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 76.7 mt -63.59 -16.86 62.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.971 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -79.47 120.26 79.73 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -62.41 -22.73 74.46 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 123.19 2.593 . . . . 0.0 113.013 -174.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.558 ' NE2' HD11 ' A' ' 113' ' ' LEU . 70.9 t60 -76.32 -48.9 18.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.009 178.099 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.5 tp -61.91 -37.18 83.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.911 0.386 . . . . 0.0 111.148 -175.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -67.83 -22.16 65.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.56 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.408 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 10.8 mm100 -74.98 -43.15 55.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.739 176.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.558 HD11 ' NE2' ' A' ' 109' ' ' HIS . 10.5 mp -52.19 -43.88 64.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.621 0.248 . . . . 0.0 111.352 176.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.416 ' HG2' HG23 ' B' ' 474' ' ' VAL . 55.8 mtm -59.91 -53.7 54.76 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.302 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 26.4 m -68.72 -23.98 28.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 111.518 -177.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -75.84 -51.71 11.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.169 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 60.7 tp -61.05 -34.5 74.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.454 -177.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.433 ' OD2' ' HG2' ' B' ' 475' ' ' ARG . 24.5 t70 -62.66 -35.55 79.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.415 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.563 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 69.0 mt-30 -63.27 -29.6 70.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.498 0.666 . . . . 0.0 111.169 -177.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.92 25.42 71.96 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 114.54 -1.209 . . . . 0.0 114.034 174.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -67.01 -46.47 74.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.295 0.548 . . . . 0.0 110.053 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.514 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 17.8 m-20 -141.63 46.4 1.69 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.697 176.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.61 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -48.32 -32.11 6.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.999 178.371 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.23 -49.89 75.82 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.468 0.175 . . . . 0.0 111.382 -177.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.445 ' HG2' ' HB3' ' A' ' 122' ' ' ASP . 58.6 pttt -75.76 -30.63 59.23 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.143 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 91.9 mt -63.58 -43.67 96.29 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.427 -179.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.6 mmt -50.61 -36.83 36.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.929 0.395 . . . . 0.0 111.169 177.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 30.0 mmm180 -81.74 -47.23 13.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.043 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.561 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.86 -24.34 66.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.972 -176.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.466 ' CE1' ' HB2' ' A' ' 117' ' ' LEU . 3.4 m-30 -78.86 -29.7 44.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.807 0.337 . . . . 0.0 111.098 -178.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.443 ' HE3' ' HA ' ' A' ' 131' ' ' MET . 4.7 mmt -73.51 -10.33 59.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.358 -176.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.3 pt20 -98.99 -15.3 19.13 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.104 -179.116 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.533 ' OE1' HD21 ' A' ' 113' ' ' LEU . 3.7 mt-10 -87.54 119.01 70.55 Favored Pre-proline 0 N--CA 1.451 -0.406 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.604 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 14.1 Cg_endo -56.25 -23.26 44.71 Favored 'Trans proline' 0 CA--C 1.52 -0.185 0 C-N-CA 123.066 2.511 . . . . 0.0 112.453 -173.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.5 mp -72.56 -42.09 65.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.324 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.454 ' CZ ' HG23 ' B' ' 470' ' ' ILE . 31.0 t80 -76.64 -29.97 56.67 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.189 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 133' ' ' GLU . 57.5 t -61.24 -44.7 98.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.048 176.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.604 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 42.0 mt-10 -67.63 -41.34 84.06 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.323 178.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -57.11 -50.93 71.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.11 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.702 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.71 -45.1 87.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.032 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -63.48 -29.77 71.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.381 0.61 . . . . 0.0 110.588 -174.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.446 ' O ' HG13 ' A' ' 146' ' ' ILE . 89.1 m -82.79 -47.86 11.45 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.359 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.514 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 29.1 p -62.92 -32.33 73.6 Favored 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 121.177 -0.209 . . . . 0.0 111.383 -174.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 79.3 mt -65.68 -26.87 67.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.809 0.338 . . . . 0.0 111.092 -178.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -85.87 -14.84 66.53 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.013 177.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 142' ' ' CYS . 32.5 mt -91.63 -42.96 13.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.867 0.365 . . . . 0.0 110.892 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.437 ' CG1' HD12 ' A' ' 95' ' ' LEU . 20.4 m -90.61 7.76 4.1 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.884 -174.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -58.75 119.72 39.6 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 121.128 0.49 . . . . 0.0 110.53 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -68.14 -28.73 34.08 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.734 2.289 . . . . 0.0 111.746 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 16.3 t 52.25 66.03 1.33 Allowed 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.745 0.653 . . . . 0.0 110.874 174.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . 0.458 ' HB2' ' HG3' ' A' ' 153' ' ' GLU . 44.7 mt-30 -110.12 31.96 5.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.141 -177.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 62.6 24.53 14.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.767 -177.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.458 ' HG3' ' HB2' ' A' ' 151' ' ' GLN . 0.0 OUTLIER -109.92 164.05 12.96 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.023 -179.113 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -98.12 120.63 38.86 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.519 -177.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 18.3 m . . . . . 0 C--O 1.249 1.049 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.11 176.964 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 3.5 t70 . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 121.111 0.481 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 47.9 mt -64.02 -36.18 75.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.459 -168.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . 0.48 ' HD3' ' N ' ' B' ' 465' ' ' HIS . 0.0 OUTLIER -75.19 -28.94 60.2 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.57 -176.21 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . 0.48 ' N ' ' HD3' ' B' ' 464' ' ' ARG . 13.4 t60 -76.24 -45.33 33.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.132 173.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -63.17 -30.48 71.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . 0.433 ' O ' HD21 ' B' ' 471' ' ' LEU . 32.8 mtp180 -63.31 -55.07 27.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.613 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . 0.475 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -70.93 -18.57 62.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.829 0.823 . . . . 0.0 109.997 -174.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . 0.405 HG22 ' CG2' ' A' ' 87' ' ' VAL . 1.3 t -73.08 -20.2 18.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.52 178.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.462 ' O ' HG22 ' B' ' 474' ' ' VAL . 35.8 mm -72.84 -37.35 54.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 122.188 0.994 . . . . 0.0 108.4 -178.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . 0.547 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.5 OUTLIER -51.28 -48.86 62.11 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 113.166 -1.834 . . . . 0.0 110.546 177.152 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . 0.474 ' NE2' ' HA ' ' A' ' 86' ' ' ARG . 3.6 mm-40 -46.74 -54.23 10.16 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.798 -1.092 . . . . 0.0 110.498 174.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 33.0 m -60.79 -54.11 49.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.668 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . 0.462 HG22 ' O ' ' B' ' 470' ' ' ILE . 75.7 t -48.61 -54.79 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.905 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.584 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 52.2 mtt180 -74.31 -19.8 60.35 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.883 -0.598 . . . . 0.0 112.402 -171.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -74.54 -45.7 43.91 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 172.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . 0.449 HD12 HD21 ' A' ' 105' ' ' LEU . 92.2 mt -64.46 -55.11 23.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.772 -177.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.423 HG13 ' O ' ' B' ' 474' ' ' VAL . 52.4 mt -54.06 -26.18 14.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.059 0.457 . . . . 0.0 111.084 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.584 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 1.6 tppp? -73.04 -42.11 63.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.926 -172.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . 0.424 ' HD3' ' N ' ' B' ' 481' ' ' ASP . 0.0 OUTLIER -111.84 -15.66 13.32 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.876 -176.636 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . 0.424 ' N ' ' HD3' ' B' ' 480' ' ' LYS . 13.3 t70 -92.96 -59.73 1.98 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.162 0.506 . . . . 0.0 111.437 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -85.97 -85.95 0.15 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.582 -169.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -110.8 -46.15 3.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.1 0.476 . . . . 0.0 111.741 -169.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.418 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 93.98 1.07 65.51 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.519 -177.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 2.7 pp -94.44 173.01 7.84 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.592 0.234 . . . . 0.0 110.507 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -144.38 68.21 1.26 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.787 0.803 . . . . 0.0 110.128 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 7.7 p -78.9 61.29 3.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.865 -175.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -117.31 -13.91 10.42 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.673 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 15.0 m -84.73 100.42 11.49 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.156 0.503 . . . . 0.0 110.794 -176.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -114.62 83.81 1.96 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.199 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -110.73 18.92 19.14 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.148 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 16.1 m -120.86 55.75 1.03 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.154 0.502 . . . . 0.0 110.019 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -98.02 45.73 1.02 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.425 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -91.51 -50.21 5.91 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 175.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 C--O 1.247 0.925 0 CA-C-O 118.566 -0.73 . . . . 0.0 109.935 178.144 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.695 0 N-CA-C 112.101 -0.4 . . . . 0.0 112.101 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -63.09 -12.3 29.2 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 123.197 2.598 . . . . 0.0 113.39 -176.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 56.2 p-80 -65.46 -24.13 67.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.811 0.338 . . . . 0.0 110.936 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 47.9 tpp -103.66 87.46 2.83 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 177.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -79.97 -39.46 30.06 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.358 -175.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 -84.87 142.19 29.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.222 0.534 . . . . 0.0 110.486 -178.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 39.7 t -81.84 131.67 33.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.614 -172.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.3 m -63.98 144.82 56.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.468 176.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.528 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.85 -34.22 74.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.705 -173.892 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -61.24 -40.93 95.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.711 -0.222 . . . . 0.0 110.742 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -63.34 -39.42 94.49 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.452 ' HA ' HD13 ' A' ' 95' ' ' LEU . 88.2 mt -69.06 -32.42 71.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.64 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.528 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 97.4 mttt -58.04 -27.32 63.48 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -178.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.42 ' HB2' HG21 ' A' ' 146' ' ' ILE . 24.0 m-80 -72.64 -18.63 61.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.797 0.332 . . . . 0.0 111.277 -178.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.452 HD13 ' HA ' ' A' ' 92' ' ' LEU . 7.4 mp -71.02 -40.58 71.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.113 -175.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -63.05 -21.07 63.33 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.693 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -108.71 6.51 25.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.064 0.459 . . . . 0.0 110.739 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.624 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.9 t -76.96 108.54 10.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.24 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.14 67.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.131 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.1 m -71.7 -43.87 65.18 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.185 0.517 . . . . 0.0 110.78 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.535 HD13 HD13 ' A' ' 104' ' ' LEU . 21.4 tp -71.09 -49.56 43.15 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.446 -171.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.0 ptp180 -57.72 -32.07 67.05 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.327 -179.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 67.5 m -62.95 -40.23 97.02 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.535 HD13 HD13 ' A' ' 101' ' ' LEU . 0.5 OUTLIER -88.56 -15.75 34.35 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.508 -0.877 . . . . 0.0 112.161 -178.965 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.498 HD12 ' O ' ' A' ' 101' ' ' LEU . 8.7 mp -68.74 -12.06 61.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.194 0.521 . . . . 0.0 110.591 171.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 80.1 mt -73.14 -13.42 61.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.021 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -74.03 123.7 89.47 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.865 176.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.5 -30.34 90.52 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.111 2.54 . . . . 0.0 112.763 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -78.77 -41.29 30.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.657 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.525 HD12 ' O ' ' A' ' 104' ' ' LEU . 5.0 tt -63.18 -42.48 99.39 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -68.06 -27.19 66.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.151 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -70.84 -43.07 69.3 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.187 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.443 HD12 ' HB2' ' A' ' 136' ' ' PHE . 85.8 mt -56.11 -51.77 66.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.315 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 59.7 mtp -54.28 -54.15 44.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.829 -179.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.646 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.8 m -65.89 -34.45 70.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.343 -176.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -62.86 -46.36 88.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.086 0.47 . . . . 0.0 110.61 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.436 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 62.7 tp -64.47 -36.39 84.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.621 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.41 -36.74 84.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.802 177.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.646 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 75.7 mt-30 -68.2 -32.15 72.17 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.868 0.842 . . . . 0.0 110.508 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 66.11 27.08 72.63 Favored Glycine 0 N--CA 1.447 -0.567 0 CA-C-N 114.145 -1.389 . . . . 0.0 113.18 175.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.67 -32.38 59.18 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.176 0.512 . . . . 0.0 110.806 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.48 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 15.4 t0 -160.52 69.23 0.37 Allowed 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 168.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.437 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -55.31 -26.77 42.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.007 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.75 -49.39 73.22 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.057 0.456 . . . . 0.0 110.596 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.0 -38.03 66.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.557 178.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 95.4 mt -61.65 -46.67 88.79 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.162 -177.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -54.88 -33.86 62.4 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.006 0.431 . . . . 0.0 111.187 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -79.34 -49.08 12.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.449 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.668 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.45 -27.03 67.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.057 -176.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.579 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.2 m-30 -79.26 -27.54 42.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.877 0.37 . . . . 0.0 111.436 -176.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.482 ' HA ' ' HE1' ' A' ' 131' ' ' MET . 3.3 mmt -86.13 3.42 42.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.821 0.344 . . . . 0.0 111.574 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.668 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.8 pt20 -100.56 -19.61 16.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.039 0.447 . . . . 0.0 109.965 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -105.36 137.45 19.27 Favored Pre-proline 0 N--CA 1.448 -0.548 0 CA-C-O 121.393 0.616 . . . . 0.0 111.688 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.609 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 56.4 Cg_endo -68.45 -11.87 33.19 Favored 'Trans proline' 0 CA--C 1.527 0.144 0 C-N-CA 123.904 3.069 . . . . 0.0 113.974 -173.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 45.5 mt -77.8 -37.62 48.33 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.427 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.579 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 45.5 t80 -88.98 -32.1 17.8 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.573 -173.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.609 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 10.5 m -54.87 -44.89 74.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.831 176.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 25.7 mm-40 -57.62 -50.29 73.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.433 176.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -54.94 -48.93 72.51 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.211 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.752 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.28 -49.55 71.37 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.052 -0.977 . . . . 0.0 111.019 -177.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.71 -31.11 72.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.218 0.532 . . . . 0.0 110.55 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.544 ' O ' HG13 ' A' ' 146' ' ' ILE . 65.4 m -70.61 -47.72 58.72 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.018 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 28.3 p -67.5 -30.98 70.8 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.526 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.752 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.8 mt -65.71 -27.95 68.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.708 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -83.24 -14.67 73.78 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.226 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.544 HG13 ' O ' ' A' ' 142' ' ' CYS . 21.1 mt -91.8 -40.83 12.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.199 0.523 . . . . 0.0 110.505 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.428 ' CG1' HD12 ' A' ' 95' ' ' LEU . 15.3 m -94.75 7.5 6.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.398 -177.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -53.9 126.82 51.89 Favored Pre-proline 0 C--O 1.234 0.252 0 CA-C-O 121.369 0.604 . . . . 0.0 112.112 -173.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.81 -3.17 13.51 Favored 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 122.936 2.424 . . . . 0.0 111.295 175.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 3.4 p -84.18 16.7 2.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.497 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . 0.471 HE21 ' HA ' ' A' ' 151' ' ' GLN . 0.0 OUTLIER -70.69 127.15 31.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.673 176.616 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -69.74 129.5 39.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.799 0.333 . . . . 0.0 110.203 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -77.6 129.94 36.25 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.854 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -71.29 96.51 1.44 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.143 0.497 . . . . 0.0 110.37 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 3.1 p . . . . . 0 C--O 1.248 1.017 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.394 179.355 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 . . . . . 0 N--CA 1.48 1.033 0 CA-C-O 121.066 0.46 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 29.4 mm -85.82 -19.89 8.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 -176.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -57.76 -35.46 70.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.915 0.388 . . . . 0.0 110.769 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -69.95 -48.9 56.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.962 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.461 ' O ' HG12 ' B' ' 470' ' ' ILE . 6.5 mm-40 -55.91 -50.42 70.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.93 -178.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -59.92 -40.86 90.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.396 -176.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -79.0 -23.46 44.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.382 0.61 . . . . 0.0 109.666 -178.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -65.32 -32.15 56.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.422 173.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.461 HG12 ' O ' ' B' ' 466' ' ' GLU . 26.3 mm -61.94 -29.87 47.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.391 179.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 83.7 mt -63.53 -31.86 73.15 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.881 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -71.7 -35.22 70.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.059 0.457 . . . . 0.0 110.092 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 45.4 m -72.7 -59.08 2.89 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.077 -177.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . 0.415 ' O ' HG13 ' B' ' 478' ' ' ILE . 11.5 p -54.95 -45.34 76.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.085 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.517 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 18.8 tpp85 -65.68 -35.17 80.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.634 0.254 . . . . 0.0 110.96 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.06 -47.88 78.42 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 120.687 0.28 . . . . 0.0 110.65 -179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 50.6 mt -67.55 -55.4 17.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.846 -174.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.473 HG22 ' HB2' ' B' ' 482' ' ' PHE . 46.3 mt -58.52 -25.55 28.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.156 -175.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.517 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 22.8 tptp -65.09 -34.6 78.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.219 -173.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . 0.419 ' H ' ' HD2' ' B' ' 480' ' ' LYS . 0.0 OUTLIER -116.46 -15.47 10.9 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.884 176.372 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -89.57 -57.17 2.97 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . 0.473 ' HB2' HG22 ' B' ' 478' ' ' ILE . 69.7 m-85 -89.64 -89.68 0.15 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.776 -172.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -100.91 -47.74 4.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.851 0.358 . . . . 0.0 111.093 -173.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.504 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 95.47 3.62 61.2 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.668 176.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 3.1 pp -94.8 159.71 14.93 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.407 0.622 . . . . 0.0 111.383 -174.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -153.49 -12.81 0.15 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.958 177.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 13.4 t -83.64 -11.49 57.2 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.823 178.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . 0.411 ' HB3' ' H ' ' B' ' 489' ' ' SER . 13.7 m120 -93.19 -160.12 0.73 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 -179.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 489' ' ' SER . . . . . 0.411 ' H ' ' HB3' ' B' ' 488' ' ' ASN . 42.3 m 64.51 18.38 11.33 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.814 0.696 . . . . 0.0 111.048 -178.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -95.79 3.44 53.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.835 177.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -83.1 19.13 1.49 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.158 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 17.0 t -79.61 134.45 36.45 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -78.1 92.5 4.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.988 0.423 . . . . 0.0 110.815 -175.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -107.59 -51.83 2.85 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.909 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 2.9 m . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.794 178.563 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.587 0 N-CA-C 111.655 -0.578 . . . . 0.0 111.655 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -69.57 124.17 10.89 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.4 2.067 . . . . 0.0 111.956 178.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -128.56 123.05 32.43 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.078 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 17.1 ptp -78.29 73.92 4.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.5 0.667 . . . . 0.0 110.676 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -67.22 -29.16 68.73 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -91.29 140.11 30.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.154 171.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 24.5 t -80.55 134.72 26.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.099 -173.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.1 m -67.58 144.34 55.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.981 176.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.513 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 1.6 tt -62.32 -33.38 74.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.994 -173.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -56.01 -43.66 77.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.665 174.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -68.66 -28.09 66.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.412 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 90.7 mt -78.68 -35.26 45.43 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.622 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 50.1 mtpt -57.72 -29.49 64.77 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -73.22 -18.66 61.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.606 0.241 . . . . 0.0 111.082 -176.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.507 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 82.1 mt -62.67 -47.16 84.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.032 -175.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.93 -15.36 81.03 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.259 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -95.5 -16.0 22.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.15 0.5 . . . . 0.0 110.397 -177.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.607 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 33.0 t -77.49 121.31 23.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.967 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.45 -27.62 67.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.629 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.6 m -69.24 -45.93 68.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.225 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.507 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 38.8 tp -71.11 -46.97 60.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.57 -173.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.607 ' HG2' ' O ' ' A' ' 98' ' ' SER . 8.9 ptp180 -60.29 -27.27 67.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.534 -178.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.6 m -62.99 -22.88 67.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.974 0.416 . . . . 0.0 110.662 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.5 mt -86.57 -34.38 19.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.32 0.581 . . . . 0.0 109.717 178.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.427 HD13 ' O ' ' A' ' 101' ' ' LEU . 9.3 mp -64.1 -18.37 64.34 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.612 178.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 63.7 mt -66.06 -21.02 66.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.293 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -78.39 118.1 70.24 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.265 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.4 -36.66 97.54 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.069 2.512 . . . . 0.0 112.589 178.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.3 t60 -68.29 -44.06 76.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.86 0.362 . . . . 0.0 110.558 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.4 tt -65.59 -46.01 81.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.277 -176.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.413 ' O ' HG22 ' A' ' 115' ' ' VAL . 13.5 ptp180 -64.47 -34.18 77.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.491 -179.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -66.65 -34.97 79.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.947 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.3 mt -59.47 -48.59 81.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.129 0.49 . . . . 0.0 109.717 174.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 68.6 mtp -55.75 -52.09 65.14 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.973 176.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.481 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 84.0 t -60.25 -38.83 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.542 -179.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -64.56 -43.01 95.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.07 0.462 . . . . 0.0 111.071 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 56.4 tp -67.55 -38.41 84.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.57 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -63.97 -27.83 69.4 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.084 0.469 . . . . 0.0 111.375 -175.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.481 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 70.9 mt-30 -63.19 -29.77 71.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.516 0.674 . . . . 0.0 110.785 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.5 29.3 72.93 Favored Glycine 0 CA--C 1.518 0.226 0 CA-C-N 114.551 -1.204 . . . . 0.0 114.239 172.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -73.1 -55.45 6.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.568 0.699 . . . . 0.0 109.526 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -135.16 50.85 2.12 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.502 176.349 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.551 ' HD3' ' N ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -48.68 -37.57 18.89 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 113.505 -1.679 . . . . 0.0 111.961 179.003 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.16 -46.53 77.1 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.908 0.385 . . . . 0.0 110.866 -176.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -65.57 -41.91 92.39 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.183 177.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.509 HD21 ' HH ' ' A' ' 130' ' ' TYR . 95.5 mt -62.63 -43.67 98.22 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.572 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -34.67 65.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.933 0.397 . . . . 0.0 111.142 -178.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.9 mmm180 -77.01 -46.09 25.04 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.007 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.93 -38.65 86.56 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.421 -178.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.509 ' HH ' HD21 ' A' ' 126' ' ' LEU . 3.2 m-30 -72.31 -21.78 61.28 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.865 -174.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.455 ' HA ' ' HE1' ' A' ' 131' ' ' MET . 3.6 mmt -79.43 -1.23 36.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.14 -179.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -98.79 -20.03 17.11 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 175.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -88.17 120.89 70.72 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.733 -175.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.636 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 27.9 Cg_endo -62.2 -14.11 36.13 Favored 'Trans proline' 0 N--CA 1.465 -0.157 0 C-N-CA 122.863 2.375 . . . . 0.0 112.671 -175.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.3 mp -77.32 -40.26 44.88 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.592 176.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.408 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 32.8 t80 -88.74 -31.01 18.63 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.066 -172.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.636 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 16.6 m -58.47 -49.11 83.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.246 177.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.517 ' N ' HG23 ' A' ' 137' ' ' VAL . 11.0 pt-20 -70.96 -36.64 72.64 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.558 179.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -56.29 -48.07 77.36 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 174.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.766 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.46 -49.78 74.07 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.726 178.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -62.09 -30.76 71.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.209 0.528 . . . . 0.0 110.627 -175.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 64.6 m -77.3 -45.29 26.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.537 -179.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.3 p -69.33 -28.11 65.96 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.861 0.362 . . . . 0.0 110.53 -177.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.766 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 83.3 mt -62.13 -31.3 71.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.69 178.163 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.517 ' HA2' ' OE2' ' A' ' 148' ' ' GLU . . . -79.87 -17.69 74.36 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.452 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 49.0 mt -91.16 -26.24 5.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.109 0.48 . . . . 0.0 110.569 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 17.3 m -104.05 -3.43 9.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.599 -177.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.517 ' OE2' ' HA2' ' A' ' 145' ' ' GLY . 12.7 pt-20 -71.66 124.32 90.73 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.255 0.55 . . . . 0.0 110.393 -178.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.9 -8.35 23.42 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.891 2.394 . . . . 0.0 111.452 177.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 5.4 p -86.82 57.48 4.53 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.307 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . 0.407 ' HA ' ' OE1' ' A' ' 151' ' ' GLN . 15.9 mm-40 -71.97 85.8 0.99 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.609 -179.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 67.68 109.64 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.168 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -88.62 -29.68 19.78 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.479 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -138.05 111.81 8.28 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.165 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.616 -0.706 . . . . 0.0 110.225 179.223 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 47.3 mm -57.83 -40.12 74.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.071 -173.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -58.56 -43.36 89.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.886 0.375 . . . . 0.0 110.772 178.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -64.12 -48.83 74.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.067 175.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.579 ' O ' HG12 ' B' ' 470' ' ' ILE . 43.4 mt-10 -60.14 -43.83 95.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.45 -176.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -58.78 -39.97 82.62 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -30.89 60.23 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.5 t -62.46 -35.51 70.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.584 176.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.579 HG12 ' O ' ' B' ' 466' ' ' GLU . 31.6 mm -63.41 -34.85 69.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.493 178.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 82.8 mt -57.44 -42.5 82.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.691 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -62.78 -43.11 99.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.441 177.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 56.1 m -63.65 -55.5 23.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.752 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . 0.458 ' O ' HG13 ' B' ' 478' ' ' ILE . 75.0 t -51.16 -55.7 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.868 178.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -68.85 -32.13 71.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.582 -172.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.14 -47.03 88.13 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 120.962 0.41 . . . . 0.0 109.941 177.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . 0.406 HD12 HD22 ' A' ' 105' ' ' LEU . 79.6 mt -63.54 -53.34 46.4 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.099 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.512 HG23 ' H ' ' B' ' 484' ' ' GLY . 49.9 mt -58.63 -26.76 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.868 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.509 ' HA ' ' CA ' ' B' ' 484' ' ' GLY . 27.0 tptp -57.7 -41.31 81.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.736 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.19 -16.8 14.5 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.872 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -89.55 -59.32 2.24 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.742 0.306 . . . . 0.0 111.523 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . 0.502 ' HB2' HG22 ' B' ' 478' ' ' ILE . 83.3 m-85 -107.63 -90.43 0.44 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.767 -172.266 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -113.48 -50.24 2.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.682 0.277 . . . . 0.0 111.1 -172.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.512 ' H ' HG23 ' B' ' 478' ' ' ILE . . . 79.43 51.19 5.35 Favored Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.305 -0.95 . . . . 0.0 111.404 -177.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 85.9 mt -72.78 169.35 16.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.276 0.56 . . . . 0.0 111.593 -176.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -140.26 23.34 2.36 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.155 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 44.5 p 51.42 35.88 15.22 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.971 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -113.08 92.11 3.89 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.776 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 489' ' ' SER . . . . . 0.405 ' OG ' ' HE2' ' B' ' 491' ' ' LYS . 6.2 p -87.13 145.43 26.44 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.679 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -81.58 56.62 3.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.191 0.52 . . . . 0.0 111.297 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . 0.405 ' HE2' ' OG ' ' B' ' 489' ' ' SER . 66.4 mttm -78.65 93.67 4.92 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.593 177.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 11.0 t 62.97 30.32 16.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.081 -176.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? -86.93 88.98 7.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.698 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -100.89 -57.5 2.09 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.993 0.425 . . . . 0.0 109.868 177.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 47.6 t . . . . . 0 C--O 1.251 1.133 0 CA-C-O 118.436 -0.792 . . . . 0.0 110.149 179.161 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.645 0 N-CA-C 111.475 -0.65 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -67.61 76.85 0.54 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 123.1 2.533 . . . . 0.0 112.142 177.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -141.81 46.29 1.67 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.283 0.563 . . . . 0.0 109.781 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 57.7 ttp -106.7 -23.42 12.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.959 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -71.47 -56.98 4.86 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.183 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -91.35 129.14 37.37 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 173.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.49 HG22 ' HB ' ' A' ' 147' ' ' VAL . 12.0 p -84.16 154.11 3.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.168 -173.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.7 m -59.36 141.33 54.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.467 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.2 tt -68.03 -30.97 70.32 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.865 -178.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -54.25 -43.97 71.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.48 173.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.442 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 2.8 m-20 -63.31 -35.63 81.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.137 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.401 HD21 ' HA ' ' B' ' 473' ' ' CYS . 44.6 mt -71.01 -34.47 71.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.194 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.561 ' HB3' ' HZ3' ' A' ' 93' ' ' LYS . 9.8 mtpm? -59.64 -24.13 63.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.317 -0.401 . . . . 0.0 112.053 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -77.42 -17.44 58.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.177 -179.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.552 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 91.8 mt -62.7 -46.02 90.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.438 -176.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.66 -18.32 69.99 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.622 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -84.67 -16.19 42.73 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.938 0.399 . . . . 0.0 110.608 -179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.641 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.7 t -78.27 122.07 25.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.084 -176.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.51 -25.2 63.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.428 177.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 97.2 m -72.78 -45.2 59.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.919 178.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.552 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 36.2 tp -69.45 -51.26 37.83 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.766 -172.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.641 ' HG2' ' O ' ' A' ' 98' ' ' SER . 6.2 ptp180 -58.45 -29.5 66.2 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.974 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 33.3 t -62.05 -42.67 99.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -178.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.672 HD23 ' SG ' ' A' ' 142' ' ' CYS . 0.5 OUTLIER -87.96 -16.2 34.46 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.261 -178.608 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.511 HD11 ' O ' ' A' ' 101' ' ' LEU . 9.4 mp -69.36 -12.22 61.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.179 0.514 . . . . 0.0 110.541 171.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 83.1 mt -73.09 -17.63 61.39 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.792 178.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -71.0 118.75 68.44 Favored Pre-proline 0 C--O 1.234 0.256 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.34 -32.37 71.71 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 123.063 2.509 . . . . 0.0 112.755 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -71.56 -49.86 36.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.534 0.206 . . . . 0.0 110.849 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.578 HD23 ' O ' ' A' ' 104' ' ' LEU . 33.2 tp -63.51 -43.17 97.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 120.774 0.321 . . . . 0.0 111.077 -176.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -66.15 -30.59 71.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.182 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.513 HE21 ' HA ' ' A' ' 112' ' ' GLN . 0.0 OUTLIER -72.33 -39.3 68.29 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.654 175.86 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 72.4 mt -56.72 -50.24 72.78 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 57.5 mtp -53.94 -55.51 26.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.904 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.611 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 34.5 m -67.21 -23.89 31.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -176.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 57.3 m-20 -72.22 -38.81 68.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.189 0.519 . . . . 0.0 110.69 177.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.27 -43.61 81.4 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.521 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -61.61 -16.55 49.31 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.604 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.611 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 77.6 mt-30 -74.43 -29.73 61.61 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.4 14.93 60.62 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 114.578 -1.192 . . . . 0.0 113.908 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -55.14 -55.03 35.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.475 0.655 . . . . 0.0 110.186 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -135.09 55.8 1.87 Allowed 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.909 175.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.563 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -49.96 -30.52 10.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.933 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.86 -53.06 61.08 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.724 0.297 . . . . 0.0 111.09 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -75.72 -28.75 58.67 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.494 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.455 HD21 ' CE2' ' A' ' 130' ' ' TYR . 94.6 mt -64.25 -48.71 74.74 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.41 178.016 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.95 -40.21 60.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.951 0.405 . . . . 0.0 111.403 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -79.26 -44.84 20.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.972 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.569 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.99 -26.88 65.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.693 -176.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.455 ' CE2' HD21 ' A' ' 126' ' ' LEU . 4.3 m-30 -76.85 -29.44 55.86 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.93 0.395 . . . . 0.0 110.992 -178.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.424 ' HA ' ' CE ' ' A' ' 131' ' ' MET . 1.4 mmt -76.33 -2.79 33.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.89 -175.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.3 pt20 -103.96 -8.11 19.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.085 0.469 . . . . 0.0 110.416 176.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.466 ' O ' HG23 ' A' ' 137' ' ' VAL . 7.3 mt-10 -95.08 118.85 66.48 Favored Pre-proline 0 N--CA 1.449 -0.522 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 -178.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.481 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 19.7 Cg_endo -58.47 -21.39 53.8 Favored 'Trans proline' 0 CA--C 1.519 -0.244 0 C-N-CA 122.826 2.351 . . . . 0.0 111.976 -177.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.37 -39.02 81.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.28 177.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -87.86 -29.15 21.13 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.225 -178.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 133' ' ' GLU . 86.4 t -62.82 -44.06 99.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.696 177.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 14.0 pt-20 -67.76 -32.88 73.79 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.404 179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . 0.421 ' HB2' HD22 ' A' ' 110' ' ' LEU . 30.6 t80 -61.91 -52.73 62.91 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.062 0.458 . . . . 0.0 109.948 174.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.688 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -59.6 -42.75 93.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.175 -178.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -62.72 -33.04 74.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.418 0.628 . . . . 0.0 110.427 -175.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.672 ' SG ' HD23 ' A' ' 104' ' ' LEU . 89.4 m -75.74 -47.93 23.94 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.167 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.526 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 22.4 p -67.58 -32.81 73.82 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.933 -176.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.688 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.3 mt -69.56 -27.16 64.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.063 -179.099 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -79.29 -20.64 69.09 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.465 -0.874 . . . . 0.0 111.807 177.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 65.5 mt -91.04 -35.89 7.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.84 0.352 . . . . 0.0 111.342 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.49 ' HB ' HG22 ' A' ' 87' ' ' VAL . 30.9 m -83.2 5.24 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.309 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -79.24 110.54 15.3 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 170.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -66.16 -37.08 26.43 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.957 2.438 . . . . 0.0 112.373 -177.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 18.0 m -117.4 99.39 6.97 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . 0.443 ' HA ' ' OE1' ' A' ' 151' ' ' GLN . 14.6 mm-40 -64.77 105.92 1.1 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.185 0.517 . . . . 0.0 110.861 -176.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 -115.99 125.51 52.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.624 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.21 129.01 38.26 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.829 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -82.1 43.1 0.77 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.563 0.696 . . . . 0.0 110.543 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.248 0.988 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.545 -179.536 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . 0.633 ' O ' ' HG2' ' B' ' 466' ' ' GLU . 10.9 t70 . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 121.474 0.654 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 43.0 mm -68.19 -37.98 78.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.354 -170.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -70.83 -25.28 62.77 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.198 -176.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . 0.513 ' HD2' ' OE1' ' B' ' 466' ' ' GLU . 49.8 t60 -74.17 -50.92 17.18 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.366 174.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.633 ' HG2' ' O ' ' B' ' 462' ' ' ASP . 54.7 mm-40 -54.86 -44.63 74.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.07 -175.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -59.0 -35.51 73.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.994 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -31.1 54.94 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -178.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.1 -36.67 78.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.722 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.575 HG12 ' O ' ' B' ' 466' ' ' GLU . 28.3 mm -60.99 -36.91 75.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.346 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 90.3 mt -57.13 -44.24 83.13 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.809 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -62.71 -38.9 92.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.663 177.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . 0.422 ' O ' HG13 ' B' ' 477' ' ' ILE . 60.5 m -66.72 -59.9 3.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.175 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 10.3 p -54.36 -43.78 63.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.04 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 73.6 mtp180 -67.65 -30.29 69.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.523 0.202 . . . . 0.0 111.373 -177.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . 0.407 ' CZ ' ' HE2' ' B' ' 480' ' ' LYS . 0.5 OUTLIER -68.77 -46.83 67.74 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.09 0.471 . . . . 0.0 109.929 176.42 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . 0.422 HG13 ' O ' ' B' ' 473' ' ' CYS . 56.5 mt -64.55 -51.82 62.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.257 -175.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.422 HG22 ' HB2' ' B' ' 482' ' ' PHE . 61.8 mt -56.59 -24.85 19.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.758 177.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.618 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 13.4 ttmm -71.23 -32.85 69.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.87 -173.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . 0.407 ' HE2' ' CZ ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER -115.86 -16.57 11.15 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.795 -0.762 . . . . 0.0 112.308 176.842 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -92.0 -57.39 2.74 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.005 0.431 . . . . 0.0 111.944 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . 0.422 ' HB2' HG22 ' B' ' 478' ' ' ILE . 96.4 m-85 -97.41 -92.86 0.23 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.168 -171.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -84.84 -48.66 9.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.272 0.558 . . . . 0.0 111.267 -172.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.618 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 89.24 11.47 64.63 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.362 -0.836 . . . . 0.0 113.436 177.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 3.4 pp -115.3 160.04 20.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.942 0.401 . . . . 0.0 111.476 -174.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . 0.406 ' CG ' ' HZ1' ' B' ' 479' ' ' LYS . 2.7 m-20 -125.39 -43.95 1.89 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.701 177.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 3.5 t -127.8 64.26 1.37 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.958 0.885 . . . . 0.0 110.387 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -122.64 -64.24 1.2 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.826 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 19.4 m -90.34 11.41 21.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.52 -173.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -91.57 16.45 10.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.573 -176.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -108.77 -168.45 1.35 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.254 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 55.4 m 68.19 36.32 3.23 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.509 173.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -97.72 13.83 28.95 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.337 0.589 . . . . 0.0 110.617 176.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -105.11 -3.77 22.66 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.848 -178.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 C--O 1.246 0.896 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.658 -178.002 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.933 0 N-CA-C 111.915 -0.474 . . . . 0.0 111.915 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.28 112.07 1.06 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.082 2.521 . . . . 0.0 112.115 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 62.23 25.66 15.35 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.831 0.824 . . . . 0.0 109.927 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 51.1 ttm -142.39 62.96 1.41 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.145 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -84.11 -20.13 33.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.206 -178.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.0 ptp180 -79.58 146.75 32.41 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 173.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.4 p -110.46 160.89 9.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.771 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.0 m -72.41 164.58 26.12 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.783 0.325 . . . . 0.0 111.593 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.424 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -69.82 -38.76 76.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.503 -176.652 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -53.1 -42.05 65.56 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.116 0.484 . . . . 0.0 110.877 177.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.449 ' O ' HG11 ' A' ' 147' ' ' VAL . 3.1 m-20 -67.02 -23.08 65.87 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.999 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.445 ' O ' HD12 ' A' ' 95' ' ' LEU . 81.2 mt -87.17 -34.37 19.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.098 0.475 . . . . 0.0 110.753 177.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 2.6 mmmp? -56.72 -36.51 69.8 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.76 -15.81 61.19 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -174.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 92' ' ' LEU . 8.3 mp -63.46 -42.9 98.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.81 0.338 . . . . 0.0 110.834 -178.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -71.08 -13.26 72.72 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.711 176.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -94.27 -11.3 30.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.238 0.542 . . . . 0.0 109.779 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.641 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.4 t -81.61 113.08 19.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.578 -176.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.83 -25.65 67.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.62 178.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 63.3 m -71.29 -46.06 61.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.054 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.404 HD13 ' CD2' ' A' ' 139' ' ' PHE . 61.1 tp -72.3 -45.98 57.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.563 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.641 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -58.59 -31.05 67.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.116 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 37.6 t -62.54 -22.5 66.36 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.228 0.537 . . . . 0.0 110.423 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.443 HD11 ' SG ' ' A' ' 142' ' ' CYS . 21.7 mt -84.44 -31.71 24.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.876 178.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.24 -2.1 17.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.203 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.28 -18.43 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.836 0.351 . . . . 0.0 110.235 172.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -84.84 115.41 60.78 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.902 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.36 -37.89 92.98 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.776 2.317 . . . . 0.0 111.879 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.469 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 66.7 t60 -60.28 -46.95 88.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.724 177.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.455 HD23 ' O ' ' A' ' 110' ' ' LEU . 4.4 tt -59.67 -40.72 88.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.176 0.512 . . . . 0.0 109.64 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -66.38 -40.32 89.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.447 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.63 -37.18 85.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.675 176.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 109' ' ' HIS . 86.1 mt -58.02 -52.22 66.41 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 175.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 65.5 mtp -53.41 -51.72 61.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.871 176.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.588 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 56.8 t -58.38 -46.65 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.351 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -60.48 -42.8 97.02 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.032 0.444 . . . . 0.0 111.488 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.491 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 54.3 tp -68.01 -36.02 79.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.887 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.12 -24.27 63.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.064 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.588 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 77.4 mt-30 -61.98 -30.65 71.08 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.725 0.774 . . . . 0.0 110.612 177.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.49 25.82 74.67 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 114.336 -1.302 . . . . 0.0 113.368 174.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.43 ' CD ' ' HB3' ' B' ' 488' ' ' ASN . 5.5 mm-40 -76.73 -55.39 5.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.208 0.527 . . . . 0.0 109.826 -178.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.504 ' OD2' ' HE2' ' A' ' 125' ' ' LYS . 4.5 p-10 -135.01 43.12 2.73 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.887 177.052 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.576 ' HD3' ' N ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.59 -35.68 9.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.974 177.054 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.41 -42.16 98.75 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.014 0.435 . . . . 0.0 110.97 -177.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.504 ' HE2' ' OD2' ' A' ' 122' ' ' ASP . 35.7 ttpt -72.79 -44.99 60.86 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.2 0.524 . . . . 0.0 110.059 175.708 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 95.1 mt -56.72 -38.72 72.73 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.326 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.7 mmt -51.2 -40.0 57.74 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 110.959 177.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 24.0 mmm180 -79.32 -40.41 30.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.826 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.573 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.76 -27.28 67.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.692 -177.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.491 ' CE1' ' HB2' ' A' ' 117' ' ' LEU . 3.3 m-30 -81.87 -29.32 32.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.977 0.418 . . . . 0.0 111.21 -176.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.497 ' HE3' ' HA ' ' A' ' 131' ' ' MET . 15.0 mmt -77.32 4.98 9.45 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.539 -177.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 20.7 pt20 -107.07 -9.54 16.16 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.189 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -99.27 120.08 58.95 Favored Pre-proline 0 N--CA 1.452 -0.362 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.769 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.646 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 27.7 Cg_endo -62.38 -13.76 34.75 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.797 2.332 . . . . 0.0 112.224 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.0 mp -72.84 -46.39 53.25 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.611 176.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.488 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 32.3 t80 -87.04 -31.4 20.55 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.493 -169.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.646 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.7 m -56.93 -48.29 81.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.879 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 37.4 mt-10 -65.56 -42.57 91.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.638 178.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . 0.404 ' CD2' HD13 ' A' ' 101' ' ' LEU . 60.0 t80 -53.89 -50.05 67.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.376 0.607 . . . . 0.0 109.609 176.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.748 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.35 -46.32 87.14 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.098 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.31 -28.93 69.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.31 0.576 . . . . 0.0 110.948 -174.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.443 ' SG ' HD11 ' A' ' 104' ' ' LEU . 91.5 m -80.84 -41.83 22.56 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.685 -177.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 27.9 p -69.79 -27.34 64.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.616 0.246 . . . . 0.0 111.151 -177.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.748 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 81.6 mt -59.64 -44.9 93.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.059 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -65.11 -17.66 63.81 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.615 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 20.6 mt -91.7 -31.56 4.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.765 0.316 . . . . 0.0 111.054 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.453 ' O ' ' HD3' ' A' ' 149' ' ' PRO . 13.6 m -98.48 -17.41 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -75.83 110.68 11.51 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-O 120.917 0.389 . . . . 0.0 110.286 178.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . 0.453 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 86.1 Cg_endo -80.81 -9.13 13.28 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.824 2.349 . . . . 0.0 112.741 -177.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 26.2 t 59.13 -154.29 0.37 Allowed 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -175.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.29 154.91 22.67 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.879 0.371 . . . . 0.0 110.016 172.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . 0.421 HD21 ' HA ' ' A' ' 152' ' ' ASN . 9.1 m120 -107.56 30.28 6.42 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.223 0.535 . . . . 0.0 110.324 178.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -77.59 -16.74 58.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.877 176.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -147.55 126.48 12.76 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.395 176.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 19.3 t . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.527 -0.749 . . . . 0.0 109.842 179.187 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . 0.414 ' OD2' ' HB2' ' B' ' 464' ' ' ARG . 14.2 t70 . . . . . 0 N--CA 1.482 1.154 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . 0.572 ' HA ' ' HG2' ' B' ' 466' ' ' GLU . 27.3 mt -72.1 -24.57 22.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.596 -170.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . 0.414 ' HB2' ' OD2' ' B' ' 462' ' ' ASP . 84.2 mtm180 -66.89 -35.3 79.7 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . 0.48 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 19.0 t60 -73.38 -47.67 40.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.672 -177.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.588 ' O ' HG12 ' B' ' 470' ' ' ILE . 12.3 pt-20 -63.21 -36.91 85.22 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.779 -176.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -61.77 -40.82 96.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.418 . . . . 0.0 112.039 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . 0.48 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.6 p-10 -81.8 -23.52 36.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -177.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.17 -36.82 77.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.679 173.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.588 HG12 ' O ' ' B' ' 466' ' ' GLU . 26.5 mm -60.58 -34.35 58.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.28 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 73.0 mt -59.61 -43.55 93.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.167 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -62.62 -41.31 98.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.876 177.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 55.1 m -63.42 -57.3 10.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.437 -178.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 98.3 t -51.22 -45.33 31.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.602 175.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.586 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 0.8 OUTLIER -60.74 -42.2 96.87 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.317 -178.17 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -67.07 -45.98 75.7 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.673 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.18 -57.22 10.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.93 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 44.9 mt -60.32 -21.13 21.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.782 0.325 . . . . 0.0 111.253 -177.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.586 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 19.3 tptm -67.91 -42.31 81.33 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.77 -177.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . 0.505 ' HD3' ' N ' ' B' ' 481' ' ' ASP . 0.0 OUTLIER -114.61 -14.35 12.08 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.43 0.529 . . . . 0.0 112.43 -178.211 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . 0.505 ' N ' ' HD3' ' B' ' 480' ' ' LYS . 13.3 t70 -90.65 -59.9 2.06 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.725 -175.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -85.13 -89.07 0.11 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.978 -171.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -112.1 -43.22 3.59 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.101 -171.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . . . . . . . . . . . 89.86 1.19 77.13 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.154 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 3.1 pp -123.34 179.65 4.65 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.742 0.306 . . . . 0.0 111.126 -176.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -129.29 107.69 9.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.449 0.643 . . . . 0.0 109.699 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 17.0 p -83.85 -13.29 54.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.079 -175.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . 0.43 ' HB3' ' CD ' ' A' ' 121' ' ' GLU . 15.1 m120 -127.9 -163.54 1.28 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.923 -172.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 22.0 t 66.61 15.35 10.1 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.746 0.784 . . . . 0.0 109.868 -173.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -88.65 -8.33 54.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.637 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.24 7.96 42.74 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.341 176.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 54.0 m -128.82 148.55 50.89 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.339 178.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -92.04 74.74 5.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.218 0.533 . . . . 0.0 110.386 -178.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -101.96 -62.61 1.24 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.324 -178.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 45.9 t . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.491 -0.766 . . . . 0.0 110.064 178.661 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.599 0 N-CA-C 111.89 -0.484 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -66.26 115.08 3.3 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.938 2.426 . . . . 0.0 112.088 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -86.26 -36.89 19.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.22 0.533 . . . . 0.0 110.121 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 46.8 tpp -142.33 84.08 1.85 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.294 176.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -85.25 -3.1 58.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.488 -176.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -63.23 134.57 56.12 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 175.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.4 HG23 ' HB ' ' A' ' 147' ' ' VAL . 11.2 p -81.35 148.79 5.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.772 -175.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 25.2 m -55.54 139.9 42.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.227 -176.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.502 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -61.43 -35.95 78.98 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.04 -179.235 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -60.62 -39.95 90.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.65 177.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.411 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 2.7 m-20 -60.71 -38.82 86.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.811 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.2 mt -69.96 -36.62 75.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.054 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 9.2 mtpm? -59.93 -17.79 40.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.21 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -83.29 -17.36 42.79 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.597 0.237 . . . . 0.0 111.378 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 84.8 mt -61.28 -44.22 97.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.83 0.348 . . . . 0.0 111.245 -176.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -71.1 -14.46 73.72 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.384 -179.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -87.94 -18.18 29.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.877 0.37 . . . . 0.0 110.503 -178.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.646 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 28.0 t -80.68 115.81 20.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.763 -177.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.72 -21.47 65.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.48 176.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 29.5 m -74.3 -43.71 55.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.927 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 63.2 tp -73.38 -48.38 34.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.424 -175.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.646 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.8 ptp180 -58.77 -29.6 66.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.072 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 28.9 t -63.11 -31.32 72.43 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-O 121.127 0.489 . . . . 0.0 109.956 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.1 mt -75.45 -38.14 59.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.898 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.8 -17.98 65.15 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.819 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 62.1 mt -65.81 -19.01 65.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.741 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -75.61 120.84 83.52 Favored Pre-proline 0 C--O 1.236 0.352 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 173.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.73 -25.55 79.47 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.674 2.249 . . . . 0.0 112.29 -178.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -71.24 -48.8 48.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.093 178.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 58.2 tp -65.77 -37.27 85.88 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 120.86 0.362 . . . . 0.0 111.103 -175.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -69.15 -27.94 65.99 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.161 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.444 ' HA ' HG22 ' A' ' 115' ' ' VAL . 8.6 mm100 -70.44 -38.85 74.6 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.391 174.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 94.5 mt -59.35 -47.21 86.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.194 0.521 . . . . 0.0 110.054 174.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 69.9 mtp -57.66 -51.95 67.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.668 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.618 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 32.9 m -65.79 -31.51 54.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.516 -177.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -64.69 -45.89 84.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.941 0.401 . . . . 0.0 110.635 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.9 tp -66.69 -40.3 88.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.21 -178.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -63.28 -41.38 98.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.76 -178.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.618 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 48.5 mt-30 -68.76 -29.09 67.4 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.521 0.677 . . . . 0.0 110.592 -177.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 83.15 29.84 32.79 Favored Glycine 0 C--N 1.318 -0.472 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.96 174.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -52.2 -54.62 28.74 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.218 0.533 . . . . 0.0 110.207 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.623 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 9.9 t0 -155.79 65.97 0.6 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 172.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.13 -27.23 53.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.211 -177.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.56 -47.3 86.8 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.105 0.479 . . . . 0.0 110.478 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -75.25 -42.14 55.83 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.662 177.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 87.7 mt -58.45 -44.24 89.15 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.485 -175.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' MET . . . . . 0.425 ' SD ' HD23 ' B' ' 471' ' ' LEU . 0.8 OUTLIER -52.25 -37.83 56.44 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.995 0.426 . . . . 0.0 111.421 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -84.06 -42.38 16.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.81 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.07 -21.64 64.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.983 -176.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.48 ' HH ' HD21 ' A' ' 126' ' ' LEU . 4.4 m-30 -82.77 -26.37 31.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.893 0.377 . . . . 0.0 111.203 -178.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.468 ' HE3' ' HA ' ' A' ' 131' ' ' MET . 2.7 mmt -81.58 3.2 25.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.04 0.448 . . . . 0.0 111.501 -175.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 24.7 pt20 -102.84 -7.15 21.81 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.851 174.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -99.49 122.66 50.88 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.324 -176.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.67 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 28.7 Cg_endo -62.01 -14.54 37.93 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.061 2.507 . . . . 0.0 112.867 -177.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 51.6 mt -82.75 -33.94 27.28 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.316 176.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.46 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 34.7 t80 -89.62 -31.14 17.68 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.107 -176.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.67 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 14.0 m -60.88 -48.44 88.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.08 177.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.459 ' N ' HG21 ' A' ' 137' ' ' VAL . 40.9 mm-40 -66.3 -36.5 83.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.849 176.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -56.46 -49.1 75.62 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 173.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.683 ' HA ' ' SG ' ' A' ' 143' ' ' CYS . . . -64.0 -43.0 96.98 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.507 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.46 -36.55 73.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.375 0.607 . . . . 0.0 110.292 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 65.1 m -77.05 -49.82 14.49 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.08 -0.963 . . . . 0.0 111.403 -179.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.683 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.5 p -64.21 -36.84 85.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.775 -176.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 46.2 mt -67.95 -34.58 76.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.409 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -73.92 -17.12 79.28 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.163 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 82.4 mt -90.97 -49.02 13.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.689 0.28 . . . . 0.0 110.775 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.411 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 16.3 m -86.62 1.8 5.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 -172.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -64.6 116.88 32.57 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-O 120.94 0.4 . . . . 0.0 111.266 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -71.4 -26.57 20.29 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.348 2.032 . . . . 0.0 111.219 175.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 23.2 t -162.0 143.29 10.84 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.184 -0.916 . . . . 0.0 108.76 176.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . 0.477 ' HB3' ' HB3' ' A' ' 154' ' ' GLU . 8.6 tp-100 -121.17 147.99 44.84 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -55.02 112.48 1.07 Allowed 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 176.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 38.52 91.7 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 O-C-N 124.395 1.059 . . . . 0.0 112.173 -166.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 151' ' ' GLN . 8.1 pt-20 -95.86 60.25 2.09 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 114.207 -1.361 . . . . 0.0 110.813 -174.308 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 12.1 t . . . . . 0 C--O 1.249 1.073 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.581 177.836 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 121.074 0.464 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 65.9 mt -70.69 -26.72 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.783 -175.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -56.37 -44.15 79.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.689 178.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . 0.557 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 58.7 t60 -67.71 -45.29 75.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.778 176.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -60.14 -38.45 83.11 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.566 -179.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 21.6 ttp180 -67.95 -42.92 80.22 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.713 -176.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . 0.557 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.6 p-10 -76.66 -16.51 59.52 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.675 0.75 . . . . 0.0 110.047 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . 0.485 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 1.4 t -74.67 -21.76 17.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.286 177.195 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . . . . . . . . . 36.8 mm -68.94 -32.82 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-O 122.338 1.066 . . . . 0.0 109.062 -175.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . 0.566 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.6 OUTLIER -50.96 -54.83 20.9 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 113.017 -1.901 . . . . 0.0 110.768 179.145 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . 0.485 ' NE2' ' HA ' ' B' ' 469' ' ' VAL . 2.4 mp0 -50.83 -44.81 59.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.938 176.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 50.6 m -62.81 -56.36 18.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.511 -179.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 92.4 t -52.01 -53.88 16.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.016 178.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.455 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 50.2 mtp180 -72.65 -27.33 62.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.623 -171.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -67.17 -46.63 73.38 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.053 0.454 . . . . 0.0 109.867 176.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 79.3 mt -63.03 -54.92 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.729 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.439 HG23 ' HB2' ' B' ' 482' ' ' PHE . 41.9 mt -56.33 -28.16 25.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.047 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.592 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 25.3 tptp -56.94 -39.46 74.55 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.976 -177.081 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.39 -14.09 12.22 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.029 -179.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -87.78 -59.6 2.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.477 -173.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . 0.439 ' HB2' HG23 ' B' ' 478' ' ' ILE . 95.8 m-85 -103.08 -83.55 0.48 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.141 0.422 . . . . 0.0 112.141 -172.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -111.87 -51.05 2.88 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 120.999 -0.281 . . . . 0.0 110.401 -174.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.592 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 61.82 36.66 93.09 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.748 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 3.3 pp -120.3 156.43 31.28 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.945 0.402 . . . . 0.0 110.686 176.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -138.08 -15.33 1.31 Allowed 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.519 0.676 . . . . 0.0 109.658 177.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 22.3 p -99.87 2.43 43.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.697 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -124.97 120.94 33.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.186 -175.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 44.5 m -148.2 88.83 1.68 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.315 0.579 . . . . 0.0 110.949 175.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -85.1 61.81 7.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.768 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -102.64 91.01 4.02 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.707 -176.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 16.7 t 52.28 57.26 6.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 0.0 110.437 178.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . 0.499 ' HA ' ' HE3' ' B' ' 493' ' ' LYS . 0.0 OUTLIER -95.19 27.49 3.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.577 0.703 . . . . 0.0 109.648 179.47 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -72.81 90.61 1.44 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.109 178.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 56.7 t . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.542 -0.742 . . . . 0.0 109.732 178.36 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 112.101 -0.4 . . . . 0.0 112.101 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -70.15 -28.29 23.57 Favored 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 122.913 2.409 . . . . 0.0 112.004 176.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 61.47 68.13 0.73 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.342 0.591 . . . . 0.0 110.425 -176.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 67.0 mtt -92.71 41.68 1.08 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.242 178.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.476 ' HB2' ' ND2' ' B' ' 468' ' ' ASN . 7.6 p-10 -70.44 -33.73 71.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.319 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 71.5 mtm180 -88.22 133.98 33.9 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.774 174.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.6 p -99.83 155.79 4.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.455 -174.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.0 m -69.29 151.82 45.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.244 0.545 . . . . 0.0 111.204 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.412 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -63.79 -33.38 75.53 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.905 -174.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -56.35 -39.66 73.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.864 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -68.6 -37.87 80.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.54 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.9 -36.95 78.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.983 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 98.4 mttt -58.76 -27.08 64.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.742 178.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -72.53 -18.02 61.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.162 -178.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.431 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 94.0 mt -61.98 -54.41 42.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.161 -177.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -63.02 -21.22 63.43 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 121.145 -0.55 . . . . 0.0 113.07 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -76.35 -20.72 56.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.02 0.438 . . . . 0.0 110.744 -178.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.45 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 15.0 m -89.0 117.13 27.8 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.706 -175.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.16 -27.68 68.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.584 -176.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 60.3 m -70.03 -42.67 72.65 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.092 -178.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.431 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 43.6 tp -69.84 -49.77 49.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.539 -176.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.612 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 8.1 ptp180 -60.35 -27.23 67.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.649 -177.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.5 t -61.36 -28.98 69.61 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.368 0.604 . . . . 0.0 109.858 176.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.6 mt -80.18 -32.02 38.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.965 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.433 HD23 HD12 ' B' ' 477' ' ' ILE . 9.5 mp -66.56 -22.56 66.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.551 0.691 . . . . 0.0 110.173 177.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 63.4 mt -72.97 -9.15 58.41 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.997 -179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -79.84 121.23 82.03 Favored Pre-proline 0 C--O 1.233 0.236 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 175.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -63.16 -19.9 69.76 Favored 'Trans proline' 0 CA--C 1.528 0.218 0 C-N-CA 122.777 2.318 . . . . 0.0 112.679 -179.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.51 ' O ' ' HB2' ' A' ' 112' ' ' GLN . 71.1 t60 -81.87 -49.89 9.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.717 0.294 . . . . 0.0 110.746 175.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.41 HD12 ' HB2' ' A' ' 139' ' ' PHE . 2.6 tt -62.93 -41.84 99.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.488 -174.366 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -61.77 -29.94 70.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.515 177.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.51 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 6.6 mm-40 -64.15 -49.19 73.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.262 175.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.558 HD22 ' OE2' ' A' ' 133' ' ' GLU . 8.9 mp -52.04 -44.97 64.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.948 0.404 . . . . 0.0 110.646 174.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 73.9 mtp -57.45 -59.28 5.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.199 178.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.653 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 26.4 m -66.49 -27.62 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.652 -175.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -71.2 -53.53 14.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.976 0.417 . . . . 0.0 110.986 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 59.7 tp -62.11 -39.56 92.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.011 -176.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -66.71 -27.94 68.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.66 -0.246 . . . . 0.0 111.653 -173.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.653 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 72.6 mt-30 -64.06 -29.66 70.78 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.682 0.754 . . . . 0.0 110.374 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.71 29.04 72.72 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.603 173.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.31 -49.5 27.19 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 5.4 m-20 -136.72 42.61 2.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.944 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.586 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.99 -33.05 7.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.576 -1.193 . . . . 0.0 112.377 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -56.26 -55.6 31.35 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.682 0.277 . . . . 0.0 111.667 -176.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -75.04 -29.98 60.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.782 0.325 . . . . 0.0 110.375 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.451 HD21 ' HH ' ' A' ' 130' ' ' TYR . 97.6 mt -65.73 -40.9 92.64 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.875 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -34.54 64.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.067 0.46 . . . . 0.0 110.64 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -78.87 -49.7 12.45 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.005 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.512 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.09 -16.54 64.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.345 -175.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.451 ' HH ' HD21 ' A' ' 126' ' ' LEU . 3.4 m-30 -88.75 -28.75 20.3 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.765 0.317 . . . . 0.0 111.059 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.416 ' HE2' ' HA ' ' A' ' 131' ' ' MET . 3.2 mmt -71.14 -4.95 28.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.407 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 28.3 pt20 -98.76 -18.44 17.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.258 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.558 ' OE2' HD22 ' A' ' 113' ' ' LEU . 4.2 mt-10 -88.86 123.06 68.49 Favored Pre-proline 0 CA--C 1.515 -0.387 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -176.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.403 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 12.6 Cg_endo -55.88 -25.1 50.91 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.169 2.58 . . . . 0.0 112.604 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.31 -45.22 66.69 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.201 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -73.74 -31.68 63.48 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -178.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 133' ' ' GLU . 82.9 t -62.54 -42.77 97.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.336 176.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 8.3 mm-40 -66.67 -45.91 77.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.341 175.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . 0.41 ' HB2' HD12 ' A' ' 110' ' ' LEU . 69.8 t80 -57.54 -48.64 78.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.646 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.773 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.76 -49.52 74.7 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.111 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -60.21 -33.84 72.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.413 0.625 . . . . 0.0 110.294 -176.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.448 ' O ' HG13 ' A' ' 146' ' ' ILE . 99.6 m -69.56 -50.3 46.04 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.723 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.0 p -69.49 -29.06 66.62 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.638 -176.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.773 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.6 mt -60.89 -40.32 92.59 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.061 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -74.05 -29.78 62.17 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.414 -0.898 . . . . 0.0 111.985 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 142' ' ' CYS . 62.6 mt -77.5 -37.05 24.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.67 -0.265 . . . . 0.0 111.234 -177.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 143' ' ' CYS . 23.0 m -87.33 2.92 5.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.399 -178.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.609 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 19.0 mm-40 -82.72 109.5 16.94 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 168.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.67 -0.82 10.88 Favored 'Trans proline' 0 C--N 1.334 -0.187 0 C-N-CA 122.957 2.438 . . . . 0.0 112.911 -176.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 14.6 t 63.78 36.16 10.7 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -177.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 41.5 tp60 -82.42 74.9 9.36 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.781 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -83.21 56.22 3.44 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.924 -173.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -97.18 -155.03 0.47 Allowed 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.955 -1.021 . . . . 0.0 108.768 177.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -87.46 56.27 3.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.25 0.547 . . . . 0.0 110.543 175.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 18.8 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.373 179.408 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . 0.452 ' OD2' ' HB2' ' B' ' 464' ' ' ARG . 8.0 t70 . . . . . 0 N--CA 1.478 0.943 0 CA-C-O 121.035 0.445 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . 0.426 ' HA ' ' HB2' ' B' ' 466' ' ' GLU . 65.7 mt -68.42 -28.96 42.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.465 -170.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . 0.452 ' HB2' ' OD2' ' B' ' 462' ' ' ASP . 20.2 mmm180 -55.25 -49.81 71.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.312 0.577 . . . . 0.0 109.444 174.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . 0.45 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 29.0 t60 -70.24 -45.45 66.46 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.165 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.426 ' HB2' ' HA ' ' B' ' 463' ' ' ILE . 39.5 mt-10 -64.19 -22.83 67.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.242 -174.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 38.9 ttt180 -80.15 -41.38 25.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 178.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . 0.476 ' ND2' ' HB2' ' A' ' 85' ' ' ASP . 2.5 p-10 -84.47 -17.48 38.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.534 0.683 . . . . 0.0 110.597 -174.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 3.4 p -78.3 -19.39 13.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.343 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . . . . . . . . . 39.4 mm -69.11 -31.07 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 122.427 1.108 . . . . 0.0 108.737 -175.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . 0.568 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.6 OUTLIER -54.81 -52.63 62.1 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 112.929 -1.941 . . . . 0.0 110.284 179.358 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -53.09 -44.5 67.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.932 174.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 50.7 m -61.28 -55.52 30.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.433 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 94.1 t -51.67 -51.58 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.908 176.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -64.6 -40.75 96.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.616 -173.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.47 -43.57 96.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 0.0 110.447 178.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . 0.433 HD12 HD23 ' A' ' 105' ' ' LEU . 78.2 mt -65.57 -55.42 19.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.274 -178.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 47.0 mt -56.97 -25.14 21.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.067 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.503 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 17.1 tppt? -58.89 -47.06 86.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.111 -176.07 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . 0.441 ' H ' ' HD2' ' B' ' 480' ' ' LYS . 0.0 OUTLIER -115.69 -9.2 11.98 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.903 -0.719 . . . . 0.0 112.073 -179.532 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -89.2 -60.22 2.01 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.629 -176.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -93.15 -86.95 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -172.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -107.48 -39.45 5.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.017 0.437 . . . . 0.0 111.522 -171.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.503 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 96.58 0.25 60.96 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.315 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 3.9 pp -140.97 153.47 45.62 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.835 0.35 . . . . 0.0 110.869 -177.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.23 1.62 18.76 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.518 0.675 . . . . 0.0 109.694 176.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 2.4 p -99.99 66.43 1.35 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.709 -177.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -83.16 81.22 8.78 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 121.219 0.533 . . . . 0.0 110.302 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 15.3 m -87.18 8.15 25.17 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.856 -177.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -78.07 1.12 22.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.76 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -97.97 8.02 45.41 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.513 -178.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 25.7 t -123.48 132.91 54.06 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.266 -177.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . 0.437 ' HD3' ' N ' ' B' ' 493' ' ' LYS . 0.4 OUTLIER -150.09 150.23 31.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.267 178.144 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -115.98 104.08 11.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.436 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.247 0.941 0 CA-C-O 118.123 -0.942 . . . . 0.0 111.506 -177.896 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.753 0 N-CA-C 111.956 -0.457 . . . . 0.0 111.956 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -61.43 -60.83 0.19 Allowed 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.75 2.3 . . . . 0.0 112.115 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -172.61 -51.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.225 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.411 ' O ' ' HG3' ' A' ' 84' ' ' MET . 27.0 ptt? -80.2 65.42 5.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.698 0.761 . . . . 0.0 111.249 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -88.06 -0.54 57.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.102 178.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -101.04 146.58 27.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 45.2 t -98.6 128.74 49.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.863 0.363 . . . . 0.0 110.502 -175.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.0 m -68.74 150.07 48.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.526 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.456 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.62 -34.41 74.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.374 -173.842 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -60.05 -39.89 87.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 0.0 110.296 178.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.41 -38.83 81.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.098 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.443 ' HA ' HD11 ' A' ' 95' ' ' LEU . 94.3 mt -69.46 -35.17 75.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.934 -177.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 96.6 mttt -59.31 -30.99 68.75 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -177.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -68.58 -19.59 64.48 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.513 0.196 . . . . 0.0 111.148 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.443 HD11 ' HA ' ' A' ' 92' ' ' LEU . 8.7 mp -64.1 -39.15 93.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.955 0.407 . . . . 0.0 110.623 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -72.48 -19.12 78.8 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.597 175.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -83.86 -24.6 30.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.032 0.444 . . . . 0.0 110.371 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.643 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 48.3 t -77.39 111.73 13.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.77 -177.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.2 -21.31 62.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.313 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 58.8 m -71.43 -46.79 59.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.96 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.5 HD13 ' CD1' ' A' ' 139' ' ' PHE . 59.5 tp -68.25 -51.08 49.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.968 -175.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.643 ' HG2' ' O ' ' A' ' 98' ' ' SER . 6.3 ptp180 -59.96 -28.19 67.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.682 -178.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.411 ' HA ' HD22 ' A' ' 106' ' ' LEU . 33.7 t -62.2 -23.62 66.73 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.095 0.474 . . . . 0.0 110.399 178.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.3 mt -82.38 -24.79 34.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.028 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' A' ' 102' ' ' ARG . 10.2 mp -75.74 -8.68 57.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.51 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 103' ' ' SER . 4.4 mm? -67.48 -22.92 65.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.889 172.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -71.25 113.88 23.02 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.858 177.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' A' ' 111' ' ' ARG . 25.1 Cg_endo -61.68 -24.29 77.48 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.938 2.425 . . . . 0.0 112.846 -175.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 47.1 t60 -78.47 -42.46 29.71 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.824 0.345 . . . . 0.0 110.376 177.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.413 HD23 ' O ' ' A' ' 110' ' ' LEU . 3.6 tt -65.36 -42.97 92.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.035 -176.544 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.436 ' HD3' ' HA ' ' A' ' 108' ' ' PRO . 12.7 ptm180 -67.56 -31.62 71.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.648 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.425 HE21 ' HA ' ' A' ' 112' ' ' GLN . 0.0 OUTLIER -63.52 -43.02 98.39 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.426 173.545 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 86.0 mt -57.34 -49.34 76.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 75.0 mtp -54.89 -49.32 71.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.073 177.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 45.8 t -60.56 -39.9 82.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.032 0.444 . . . . 0.0 111.343 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.485 ' HA ' ' NE2' ' A' ' 119' ' ' GLN . 74.4 m-20 -68.32 -38.61 81.73 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.268 -178.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.544 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 59.7 tp -73.66 -44.66 56.19 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.61 -178.194 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.437 ' OD1' ' HD3' ' B' ' 475' ' ' ARG . 30.9 t70 -71.0 -27.99 64.09 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -171.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.485 ' NE2' ' HA ' ' A' ' 116' ' ' ASN . 11.0 pt20 -68.29 -17.54 64.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.279 0.562 . . . . 0.0 110.675 178.26 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 67.39 29.42 74.16 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.442 -0.799 . . . . 0.0 113.864 170.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -76.87 -51.99 10.27 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.954 0.377 . . . . 0.0 111.167 179.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.44 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 17.6 m-20 -132.89 37.06 3.46 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.252 0.549 . . . . 0.0 110.518 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.574 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -46.11 -34.29 4.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.557 -1.201 . . . . 0.0 112.521 179.269 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.2 -46.9 88.14 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.834 0.349 . . . . 0.0 111.462 -176.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 122' ' ' ASP . 3.9 mppt? -81.44 -35.33 30.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.138 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 85.4 mt -59.8 -44.25 94.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.046 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' MET . . . . . 0.459 ' HB3' ' NH2' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -54.75 -29.85 54.92 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.796 0.331 . . . . 0.0 111.822 179.314 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -83.19 -50.32 8.56 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.98 0.419 . . . . 0.0 110.441 176.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.737 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.34 -29.97 71.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.104 -176.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.584 ' HB3' ' CD1' ' A' ' 136' ' ' PHE . 3.5 m-30 -73.37 -21.92 60.41 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 122.172 -0.33 . . . . 0.0 111.367 -177.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.485 ' HE3' ' HA ' ' A' ' 131' ' ' MET . 3.3 mmt -85.19 -5.26 59.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.899 0.38 . . . . 0.0 110.892 -177.125 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.737 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.6 pt20 -103.6 -6.63 21.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.896 0.379 . . . . 0.0 110.22 176.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.508 ' O ' HG22 ' A' ' 137' ' ' VAL . 4.1 mt-10 -92.31 120.3 67.68 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.184 -177.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.513 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 22.5 Cg_endo -60.74 -21.0 68.32 Favored 'Trans proline' 0 N--CA 1.464 -0.21 0 C-N-CA 122.754 2.303 . . . . 0.0 112.339 -175.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 63.4 mt -82.08 -43.96 17.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.706 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.584 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 47.1 t80 -73.48 -31.21 63.63 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.601 -0.44 . . . . 0.0 109.998 -177.018 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.508 HG22 ' O ' ' A' ' 133' ' ' GLU . 78.0 t -60.67 -39.98 83.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.483 176.627 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 17.7 mm-40 -63.18 -46.67 86.0 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.965 0.412 . . . . 0.0 110.129 177.373 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . 0.5 ' CD1' HD13 ' A' ' 101' ' ' LEU . 58.7 t80 -57.93 -50.23 74.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.376 178.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.754 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.45 -48.69 74.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.497 -176.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -63.99 -30.33 71.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.159 0.504 . . . . 0.0 110.295 -176.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 61.4 m -70.27 -51.07 33.28 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.819 178.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.431 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 24.3 p -66.7 -25.2 66.42 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.242 -176.222 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.754 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 79.1 mt -57.42 -44.0 84.27 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.913 0.387 . . . . 0.0 110.805 177.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.414 ' O ' ' HG2' ' A' ' 148' ' ' GLU . . . -76.75 -14.59 82.39 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.309 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 41.1 mt -91.46 -29.32 4.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.751 0.31 . . . . 0.0 111.026 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 23.0 m -100.64 5.3 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 CA-C-O 120.698 0.285 . . . . 0.0 110.559 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 145' ' ' GLY . 4.9 pt-20 -65.55 137.16 96.36 Favored Pre-proline 0 N--CA 1.441 -0.89 0 CA-C-O 121.321 0.582 . . . . 0.0 109.704 178.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . 0.417 ' C ' ' HG ' ' A' ' 150' ' ' SER . 11.2 Cg_endo -59.71 -15.0 29.21 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 123.678 2.919 . . . . 0.0 112.562 177.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' SER . . . . . 0.417 ' HG ' ' C ' ' A' ' 149' ' ' PRO . 51.3 p 47.6 68.72 0.61 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.605 0.762 . . . . 0.0 112.46 173.003 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 64.58 103.13 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.212 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -61.27 122.05 14.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.85 179.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -80.29 -16.12 55.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.645 0.736 . . . . 0.0 109.483 177.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.66 41.29 1.61 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.325 176.332 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 31.4 p . . . . . 0 C--O 1.25 1.087 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.487 179.317 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . 0.535 ' OD1' ' HG2' ' B' ' 464' ' ' ARG . 10.5 t70 . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 121.284 0.564 . . . . 0.0 110.329 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 77.6 mt -69.33 -34.66 63.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.109 -0.95 . . . . 0.0 112.165 -171.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . 0.535 ' HG2' ' OD1' ' B' ' 462' ' ' ASP . 0.0 OUTLIER -76.74 -29.43 56.17 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.608 -0.837 . . . . 0.0 109.901 -175.31 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . 0.568 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 45.2 t60 -65.55 -48.28 72.99 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.524 171.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.407 ' O ' HG12 ' B' ' 470' ' ' ILE . 37.8 mt-10 -62.48 -22.36 66.19 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.407 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . 0.465 ' HG2' ' SD ' ' A' ' 131' ' ' MET . 28.4 mtp-105 -79.0 -44.78 21.57 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 176.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . 0.568 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -78.53 -19.68 52.39 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.411 -175.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . 0.468 HG11 ' O ' ' B' ' 465' ' ' HIS . 31.4 m -71.28 -22.51 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.973 0.416 . . . . 0.0 110.523 176.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.407 HG12 ' O ' ' B' ' 466' ' ' GLU . 31.3 mm -66.42 -30.75 50.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.886 177.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 77.8 mt -60.3 -38.09 82.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.789 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . 0.423 ' NE2' ' HA ' ' B' ' 469' ' ' VAL . 2.2 mp0 -68.44 -40.0 81.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.067 0.461 . . . . 0.0 110.102 176.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.5 m -62.15 -57.29 12.09 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.509 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 96.3 t -53.08 -49.6 49.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.514 176.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.509 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 1.8 tpp180 -59.87 -44.27 94.26 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.689 0.281 . . . . 0.0 111.259 -175.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -62.49 -47.06 85.65 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.8 -177.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 72.1 mt -65.6 -54.5 27.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.146 -178.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.489 HG22 ' HB2' ' B' ' 482' ' ' PHE . 11.2 mt -57.02 -28.89 30.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.182 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 21.5 tptm -59.13 -40.25 84.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.053 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER -111.7 -17.41 13.0 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.258 -179.129 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -91.47 -55.86 3.34 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.812 -174.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . 0.489 ' HB2' HG22 ' B' ' 478' ' ' ILE . 94.3 m-85 -99.1 -94.54 0.24 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.534 -172.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -113.33 -48.9 2.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.2 0.524 . . . . 0.0 111.276 -173.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.504 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 79.75 15.45 79.36 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.549 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.4 HD11 ' HB3' ' B' ' 488' ' ' ASN . 3.2 pp -138.66 158.0 45.06 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.775 0.321 . . . . 0.0 111.033 -178.399 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -139.4 -16.51 1.04 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.059 175.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 39.8 p -90.99 -0.23 57.7 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.63 -176.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . 0.441 HD21 ' HA ' ' B' ' 488' ' ' ASN . 1.3 t-20 -86.35 56.83 4.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.324 0.583 . . . . 0.0 110.307 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 18.3 m -66.45 126.15 27.92 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.426 -0.807 . . . . 0.0 110.362 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -97.49 -14.59 21.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.085 0.469 . . . . 0.0 111.385 -176.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -86.04 74.95 10.01 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.584 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 34.1 t -81.62 157.45 24.69 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.971 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . 0.43 ' HD2' ' N ' ' B' ' 493' ' ' LYS . 11.9 mptt -110.88 89.6 3.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.766 0.317 . . . . 0.0 110.395 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -149.16 -41.79 0.15 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.13 -178.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 16.1 t . . . . . 0 C--O 1.248 1.015 0 CA-C-O 119.239 -0.41 . . . . 0.0 109.906 -179.231 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -61.98 127.15 20.52 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.845 2.364 . . . . 0.0 111.508 178.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 72.5 t60 70.39 110.22 0.06 Allowed 'General case' 0 N--CA 1.463 0.186 0 O-C-N 123.951 0.782 . . . . 0.0 109.741 -174.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 26.3 mmt -67.77 169.1 10.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.475 -175.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -84.43 39.02 0.71 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.739 0.781 . . . . 0.0 110.456 -176.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 -96.9 163.82 12.81 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.655 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.449 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 61.8 t -101.46 139.88 21.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.631 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.427 ' O ' ' HB2' ' A' ' 91' ' ' ASN . 30.1 m -59.82 134.77 57.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.998 0.427 . . . . 0.0 110.196 178.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.515 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 3.9 tt -65.02 -33.64 76.52 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.642 -173.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -58.51 -37.78 76.31 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.396 175.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.44 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 4.1 m-20 -65.49 -38.57 90.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.988 176.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 78.1 mt -68.89 -34.01 74.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.177 -178.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 56.7 mtpt -59.66 -24.47 63.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.081 -179.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -74.54 -19.28 60.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.215 -0.194 . . . . 0.0 111.206 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.36 -42.78 99.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.932 0.396 . . . . 0.0 110.915 -177.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.45 -9.84 81.96 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.441 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -103.06 -24.47 13.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.658 0.266 . . . . 0.0 111.34 -178.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.529 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 23.8 p -71.42 115.92 11.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.921 -176.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.07 -26.96 69.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.308 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 35.9 m -70.17 -44.34 68.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.887 0.375 . . . . 0.0 110.937 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 46.5 tp -72.23 -49.13 37.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.522 -174.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 98' ' ' SER . 2.4 ptp180 -58.43 -29.56 66.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.17 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 34.0 t -65.71 -22.82 66.65 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.918 0.39 . . . . 0.0 110.256 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 24.2 mt -84.2 -28.37 27.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.226 0.536 . . . . 0.0 109.65 178.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.534 ' O ' ' HD2' ' A' ' 111' ' ' ARG . 9.7 mp -74.03 2.64 8.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.154 178.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -75.7 -19.73 58.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.893 0.378 . . . . 0.0 110.056 171.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -80.17 114.36 46.22 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.572 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -55.82 -39.77 89.16 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.501 2.801 . . . . 0.0 113.137 -177.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -69.03 -41.42 77.71 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.762 0.315 . . . . 0.0 110.624 -178.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.426 ' O ' HD21 ' A' ' 110' ' ' LEU . 3.8 tt -60.45 -41.53 94.27 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.534 ' HD2' ' O ' ' A' ' 105' ' ' LEU . 57.1 mtp85 -62.78 -44.28 96.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.912 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.81 -24.81 67.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.497 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 65.7 mt -79.16 -51.58 9.33 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 121.646 0.736 . . . . 0.0 109.079 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.481 ' HG3' HG11 ' B' ' 474' ' ' VAL . 44.0 ttp -59.55 -43.86 93.41 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.39 -1.277 . . . . 0.0 111.211 -177.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.476 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.4 m -68.01 -23.98 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.88 0.372 . . . . 0.0 111.744 -178.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 28.2 m-20 -72.69 -42.35 64.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.282 0.563 . . . . 0.0 110.673 177.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 27.9 tp -60.42 -37.27 80.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.041 -177.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -67.53 -32.22 72.86 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.867 0.365 . . . . 0.0 110.979 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.476 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 68.8 mt-30 -60.75 -28.89 69.04 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.497 -178.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.526 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 70.51 20.54 77.16 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.039 -0.982 . . . . 0.0 114.06 169.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -69.01 -50.59 47.5 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.451 0.643 . . . . 0.0 109.691 -178.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.463 ' OD2' ' HE2' ' A' ' 125' ' ' LYS . 13.4 p-10 -141.01 40.21 1.8 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.648 179.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.615 ' HD2' ' H ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -52.78 -26.99 16.0 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.794 -1.094 . . . . 0.0 112.033 179.429 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.615 ' H ' ' HD2' ' A' ' 123' ' ' LYS . . . -67.6 -39.13 84.8 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.25 0.547 . . . . 0.0 110.137 -177.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.511 ' C ' ' HD2' ' A' ' 125' ' ' LYS . 5.1 tmmm? -79.45 -45.03 20.2 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.07 177.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.407 HD22 ' CE1' ' A' ' 130' ' ' TYR . 94.5 mt -56.25 -38.11 70.68 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.463 -178.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.58 -44.89 56.94 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.953 0.406 . . . . 0.0 111.385 177.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -84.18 -36.34 22.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.801 -178.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -70.24 -16.81 63.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.638 -178.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.463 ' HB3' ' CD1' ' A' ' 136' ' ' PHE . 7.3 m-30 -87.45 -22.1 25.16 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.934 0.397 . . . . 0.0 110.737 178.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.471 ' HE2' ' HA ' ' A' ' 131' ' ' MET . 5.8 mmt -77.85 -6.11 53.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.963 -177.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.9 pt20 -99.59 -4.23 31.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.948 0.404 . . . . 0.0 110.235 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.514 ' O ' HG21 ' A' ' 137' ' ' VAL . 3.9 mt-10 -104.65 119.89 52.15 Favored Pre-proline 0 N--CA 1.452 -0.356 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.461 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 16.1 Cg_endo -57.11 -24.53 58.9 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.976 2.451 . . . . 0.0 112.363 -175.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.419 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.1 mp -67.01 -51.66 52.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.347 -179.304 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.463 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 27.7 t80 -75.64 -28.04 58.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -174.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.514 HG21 ' O ' ' A' ' 133' ' ' GLU . 99.4 t -59.38 -43.26 89.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.331 175.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 44.8 mt-10 -64.74 -46.85 80.48 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.818 0.342 . . . . 0.0 110.173 178.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -56.98 -47.09 81.61 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.556 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.691 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -68.16 -45.55 73.21 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.72 -176.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.73 -32.47 73.79 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.996 0.427 . . . . 0.0 110.331 -176.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 91.2 m -77.01 -42.77 37.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.686 -176.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.417 ' HA ' HD12 ' A' ' 146' ' ' ILE . 27.8 p -64.95 -27.07 68.59 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.212 -177.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.691 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 82.2 mt -63.2 -39.34 94.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.767 0.318 . . . . 0.0 110.927 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -74.25 -14.76 80.43 Favored Glycine 0 C--O 1.225 -0.418 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.088 178.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.417 HD12 ' HA ' ' A' ' 143' ' ' CYS . 50.7 mt -90.78 -40.34 12.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.972 0.415 . . . . 0.0 110.493 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.44 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 29.7 m -87.15 12.57 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.883 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 7.7 pt-20 -42.32 112.51 1.1 Allowed Pre-proline 0 C--O 1.236 0.342 0 O-C-N 124.115 0.885 . . . . 0.0 112.146 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.97 -41.27 1.05 Allowed 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.441 2.094 . . . . 0.0 111.522 177.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 59.4 m -156.84 78.24 0.91 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.649 176.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -95.22 139.64 31.26 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.325 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -102.85 124.4 48.29 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.802 0.334 . . . . 0.0 110.105 175.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -107.62 150.29 27.06 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.609 176.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -153.78 158.35 40.78 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 17.8 m . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.913 -179.129 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . 0.709 ' OD2' ' HG3' ' B' ' 464' ' ' ARG . 7.5 t70 . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . 0.488 ' O ' ' HG3' ' B' ' 467' ' ' ARG . 71.5 mt -76.2 -32.81 23.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.329 -169.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . 0.709 ' HG3' ' OD2' ' B' ' 462' ' ' ASP . 1.4 ppt_? -70.63 -37.53 73.81 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -177.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . 0.538 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 49.8 t60 -65.88 -46.92 76.61 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.387 176.179 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.628 ' O ' HG12 ' B' ' 470' ' ' ILE . 39.7 mt-10 -58.91 -36.5 74.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.695 -179.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' B' ' 463' ' ' ILE . 19.1 mtm180 -66.67 -46.8 74.48 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . 0.538 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.9 p-10 -75.16 -19.01 60.07 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.934 -177.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.0 t -66.8 -34.88 72.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.347 170.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.628 HG12 ' O ' ' B' ' 466' ' ' GLU . 35.1 mm -65.12 -29.63 47.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 96.8 mt -56.05 -41.17 74.61 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.598 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . 0.449 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.4 mp0 -64.79 -44.11 91.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.76 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . 0.415 ' O ' HG13 ' B' ' 477' ' ' ILE . 42.6 m -63.01 -52.95 60.97 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.268 0.556 . . . . 0.0 110.626 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . 0.481 HG11 ' HG3' ' A' ' 114' ' ' MET . 24.5 t -56.45 -55.11 20.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.663 178.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.626 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 53.2 mtm180 -68.99 -20.18 64.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.232 -174.64 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -73.82 -55.28 6.41 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.193 176.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . 0.415 HG13 ' O ' ' B' ' 473' ' ' CYS . 62.2 mt -60.54 -59.15 4.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-O 120.917 0.389 . . . . 0.0 111.242 -173.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.45 ' CD1' ' HA ' ' A' ' 115' ' ' VAL . 46.3 mt -53.71 -30.49 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.872 -176.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.645 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 1.5 ttmm -81.65 -19.04 42.53 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -166.214 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.45 -17.22 8.21 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 118.946 -1.102 . . . . 0.0 112.659 167.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -91.22 -60.06 1.99 Allowed 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.621 -0.432 . . . . 0.0 112.117 -177.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -79.94 -90.43 0.05 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.081 -170.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -95.78 -35.05 11.67 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.587 0.708 . . . . 0.0 110.237 -175.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.645 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 78.61 13.19 83.45 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.373 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 57.8 mt -89.83 160.96 16.23 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.031 0.443 . . . . 0.0 111.164 -177.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -147.7 -6.17 0.46 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.374 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 6.2 p -83.22 55.76 3.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.492 -177.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -118.94 77.92 1.23 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.396 0.617 . . . . 0.0 110.301 178.396 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 20.0 m -148.31 -172.74 4.15 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.315 177.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -70.95 -55.83 7.53 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.41 0.624 . . . . 0.0 111.068 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -122.09 48.03 1.8 Allowed 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.4 -176.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 5.8 p -86.12 115.71 23.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.574 178.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -143.42 132.03 22.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.626 0.25 . . . . 0.0 111.093 -177.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 21.9 t70 57.28 84.27 0.1 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.763 178.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.385 -0.817 . . . . 0.0 110.222 177.463 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.869 -0.492 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.39 135.16 64.69 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.882 2.388 . . . . 0.0 112.227 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -163.73 -76.6 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -178.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.405 ' SD ' ' HG2' ' A' ' 86' ' ' ARG . 6.3 tmm? -126.49 97.06 4.89 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 171.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -109.57 4.48 22.2 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -166.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HG2' ' SD ' ' A' ' 84' ' ' MET . 30.2 ptt180 -90.46 163.73 14.54 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.28 178.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.581 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 48.8 t -109.72 136.0 46.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.58 -175.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.593 ' OG ' ' HG2' ' A' ' 90' ' ' GLN . 37.0 t -63.25 144.02 57.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.565 176.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.42 -21.36 66.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.846 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.593 ' HG2' ' OG ' ' A' ' 88' ' ' SER . 11.6 pt20 -66.5 -39.88 88.94 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 177.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -69.79 -35.24 74.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.11 177.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.3 mt -70.31 -37.94 74.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.763 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -61.73 -22.53 65.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.814 0.34 . . . . 0.0 111.849 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -78.69 -17.98 55.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.535 -178.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 95.9 mt -61.31 -47.07 87.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.698 -179.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -69.35 -12.21 65.87 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.744 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -86.44 -24.45 25.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.738 0.304 . . . . 0.0 110.899 -177.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.559 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 82.0 p -80.43 124.58 29.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.96 0.409 . . . . 0.0 110.432 -177.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.22 -26.65 65.82 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.075 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.7 m -68.22 -48.14 65.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.067 -178.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -67.8 -49.99 59.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.463 -175.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.559 ' HG2' ' O ' ' A' ' 98' ' ' SER . 7.9 ptp180 -60.63 -27.87 68.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.402 -178.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.3 t -68.62 -23.35 64.43 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.275 0.56 . . . . 0.0 110.001 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.1 mt -81.33 -32.51 32.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.811 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.8 mp -72.19 -5.29 34.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.349 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 57.1 mt -76.69 -8.31 57.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.229 176.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -87.48 117.84 69.08 Favored Pre-proline 0 C--N 1.332 -0.157 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 173.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -58.52 -32.15 95.88 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.825 2.35 . . . . 0.0 112.613 -178.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.8 t60 -66.86 -43.45 83.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.96 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 54.3 tp -63.3 -35.3 79.89 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.913 0.387 . . . . 0.0 110.008 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 -59.92 -42.97 95.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.075 177.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.543 HE21 ' HA ' ' A' ' 112' ' ' GLN . 0.0 OUTLIER -64.26 -45.61 87.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.13 178.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.409 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 91.9 mt -56.3 -47.04 79.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.155 0.502 . . . . 0.0 110.351 178.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.445 ' HB3' HG13 ' B' ' 474' ' ' VAL . 71.4 mtp -58.75 -50.82 72.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.926 177.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.592 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 52.2 t -59.27 -41.97 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 120.804 0.335 . . . . 0.0 111.301 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -64.28 -45.24 88.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.262 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 48.5 tp -67.02 -39.94 87.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.298 -177.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.465 ' CB ' HD11 ' B' ' 478' ' ' ILE . 16.9 t70 -62.39 -33.53 74.95 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.961 -175.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 63.1 mt-30 -60.26 -26.86 66.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.265 0.555 . . . . 0.0 110.501 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.474 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 68.2 23.67 74.74 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.096 -0.956 . . . . 0.0 114.075 170.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -78.9 -45.83 19.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.132 0.491 . . . . 0.0 110.029 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.472 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 10.4 m-20 -132.44 31.65 4.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.756 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.633 ' HD2' ' N ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -53.22 -28.02 24.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.184 -0.916 . . . . 0.0 112.099 -179.013 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.633 ' N ' ' HD2' ' A' ' 123' ' ' LYS . . . -64.11 -38.43 91.03 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.369 0.604 . . . . 0.0 110.753 -175.455 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -87.21 -42.02 13.28 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.004 179.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.519 HD21 ' HH ' ' A' ' 130' ' ' TYR . 86.2 mt -55.0 -42.04 72.02 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.404 -178.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.62 -41.53 55.04 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -82.34 -39.79 22.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.511 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.402 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.48 -32.28 73.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.251 -178.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.519 ' HH ' HD21 ' A' ' 126' ' ' LEU . 3.4 m-30 -78.34 -17.35 56.65 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.01 -177.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.451 ' HE2' ' HA ' ' A' ' 131' ' ' MET . 3.6 mmt -76.85 -4.22 42.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.251 -177.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 8.0 pt20 -88.38 -20.01 25.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.104 0.478 . . . . 0.0 109.854 175.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -92.2 121.66 66.23 Favored Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.658 -172.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.676 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 28.4 Cg_endo -63.17 -14.06 39.44 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.107 2.538 . . . . 0.0 112.502 -178.223 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 52.7 mt -80.04 -34.6 38.13 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.88 177.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -89.58 -35.01 16.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.227 -175.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.676 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.8 m -57.62 -48.68 82.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.223 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.459 ' N ' HG23 ' A' ' 137' ' ' VAL . 27.3 mm-40 -61.34 -42.15 98.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.423 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -57.19 -50.96 71.22 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.219 0.533 . . . . 0.0 109.665 176.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.766 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.06 -45.37 92.53 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.976 179.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -63.02 -32.86 74.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.286 0.565 . . . . 0.0 110.493 -175.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 90.9 m -79.69 -44.87 20.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.611 -177.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.45 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -66.4 -28.27 68.5 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.157 -175.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.766 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.9 mt -58.82 -51.03 71.74 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.688 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.12 -21.45 65.99 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.322 -176.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 52.3 mt -86.99 -35.15 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.676 0.274 . . . . 0.0 110.853 -179.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.407 ' O ' ' HD3' ' A' ' 149' ' ' PRO . 18.7 m -95.88 -5.75 10.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -175.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 25.0 mt-10 -85.03 113.05 47.72 Favored Pre-proline 0 C--N 1.327 -0.373 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.949 175.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . 0.407 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 72.0 Cg_endo -80.38 -11.16 13.26 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.806 2.338 . . . . 0.0 111.87 176.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 10.6 m -89.82 155.77 18.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.832 178.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -78.38 106.91 10.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.58 0.705 . . . . 0.0 110.451 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -96.08 141.42 29.49 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.692 -178.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.25 143.94 26.13 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.562 176.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 45.7 tt0 -70.27 91.51 0.73 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 0.0 110.348 -177.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.731 -0.652 . . . . 0.0 109.713 178.457 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . 0.548 ' O ' ' HG2' ' B' ' 466' ' ' GLU . 6.0 p-10 . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 121.368 0.604 . . . . 0.0 109.814 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . 0.456 ' O ' ' HD2' ' B' ' 467' ' ' ARG . 50.3 mm -67.08 -29.82 47.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.581 -173.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -58.87 -47.39 85.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.237 0.542 . . . . 0.0 110.398 177.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . 0.495 ' HD2' ' OE1' ' B' ' 466' ' ' GLU . 46.6 t60 -64.47 -43.11 95.23 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.051 178.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' B' ' 462' ' ' ASP . 7.9 mm-40 -63.59 -22.67 67.02 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.408 -178.448 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . 0.549 ' HA ' ' HE ' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -84.14 -41.19 17.32 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.155 176.649 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -31.09 71.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.689 0.281 . . . . 0.0 110.623 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 31.5 m -69.59 -21.82 24.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-O 120.791 0.329 . . . . 0.0 110.907 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.491 HG12 ' O ' ' B' ' 466' ' ' GLU . 42.8 mm -66.64 -32.77 59.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.224 178.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 71.6 mt -58.79 -45.05 90.74 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.291 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . 0.581 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.5 mp0 -62.24 -39.9 94.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.586 177.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . 0.578 ' O ' HG12 ' B' ' 477' ' ' ILE . 59.9 m -64.12 -57.71 8.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.356 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . 0.445 HG13 ' HB3' ' A' ' 114' ' ' MET . 85.4 t -52.02 -50.28 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.12 176.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -66.65 -33.16 75.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.225 -174.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -61.23 -45.57 94.01 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 175.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . 0.578 HG12 ' O ' ' B' ' 473' ' ' CYS . 9.2 mm -57.95 -63.5 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 121.765 0.793 . . . . 0.0 109.228 178.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.477 HG22 ' HB2' ' B' ' 482' ' ' PHE . 16.6 mt -56.32 -30.05 29.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.167 -1.379 . . . . 0.0 112.065 -174.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.536 ' HA ' ' CA ' ' B' ' 484' ' ' GLY . 80.7 tttt -60.31 -44.3 95.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . 0.49 ' HD3' ' N ' ' B' ' 481' ' ' ASP . 0.0 OUTLIER -108.19 -15.15 14.56 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.655 -177.276 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . 0.49 ' N ' ' HD3' ' B' ' 480' ' ' LYS . 11.9 t70 -91.3 -59.05 2.25 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.768 -178.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . 0.477 ' HB2' HG22 ' B' ' 478' ' ' ILE . 97.9 m-85 -100.42 -89.04 0.34 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -171.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -112.7 -51.0 2.86 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -171.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.536 ' CA ' ' HA ' ' B' ' 479' ' ' LYS . . . 66.04 28.4 73.64 Favored Glycine 0 N--CA 1.454 -0.165 0 C-N-CA 120.892 -0.671 . . . . 0.0 111.889 -175.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 58.5 mt -96.86 141.84 29.56 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.285 0.564 . . . . 0.0 111.383 -177.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -102.56 -7.04 22.17 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.907 175.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 2.4 p -74.21 7.22 2.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.161 -177.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . 0.446 ' N ' HD21 ' B' ' 488' ' ' ASN . 0.9 OUTLIER -84.24 -15.53 46.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.97 0.414 . . . . 0.0 110.479 179.085 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 44.5 t -156.39 139.87 15.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.247 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -88.49 13.24 12.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.042 176.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -125.32 34.12 5.01 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.831 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 20.5 t -81.95 81.66 7.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.574 0.702 . . . . 0.0 109.546 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -119.95 151.88 38.27 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.522 -176.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -76.02 -46.79 27.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.002 177.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.746 176.658 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.855 0 N-CA-C 111.834 -0.506 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -51.89 -62.21 0.41 Allowed 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.056 2.504 . . . . 0.0 112.558 -174.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -102.14 37.25 1.91 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.193 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 86.2 mtp 55.51 62.85 2.28 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.904 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.53 ' HA ' ' HD1' ' B' ' 465' ' ' HIS . 15.3 p-10 -88.98 -38.68 14.26 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.102 -176.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -74.79 115.73 14.72 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -88.58 146.95 5.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.545 -176.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.0 m -63.87 144.69 56.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.312 0.577 . . . . 0.0 111.249 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 tt -66.13 -30.39 70.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.107 -0.952 . . . . 0.0 110.156 -176.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -58.79 -36.91 75.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.347 176.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -68.09 -40.06 82.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.0 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 83.7 mt -65.14 -34.49 78.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.439 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.568 ' HZ2' ' HB3' ' A' ' 93' ' ' LYS . 10.4 mtpm? -59.1 -25.21 63.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.016 179.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -72.29 -16.81 61.91 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.442 ' HB2' ' CE1' ' B' ' 476' ' ' TYR . 93.1 mt -62.01 -51.93 66.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.769 0.318 . . . . 0.0 110.719 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -64.08 -19.3 63.56 Favored Glycine 0 CA--C 1.519 0.34 0 C-N-CA 121.02 -0.61 . . . . 0.0 112.47 176.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -79.3 -16.43 56.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.725 0.298 . . . . 0.0 110.751 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.525 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 31.0 t -83.23 120.07 25.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.06 0.457 . . . . 0.0 111.051 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.96 -27.95 67.04 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.401 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 77.3 m -70.33 -47.38 61.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.884 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' ' 105' ' ' LEU . 17.4 tp -65.72 -50.15 65.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.92 -174.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.525 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.8 ptp180 -58.09 -25.1 60.91 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.142 -0.223 . . . . 0.0 111.44 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 73.9 m -74.15 -39.35 63.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.518 HD13 HD12 ' A' ' 101' ' ' LEU . 0.7 OUTLIER -87.12 -15.51 38.23 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.908 177.94 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.586 HD12 ' O ' ' A' ' 101' ' ' LEU . 7.3 mp -68.95 -4.34 16.3 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.109 0.481 . . . . 0.0 110.774 168.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 97.1 mt -81.95 -11.73 58.73 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.774 177.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.576 ' O ' ' HG3' ' A' ' 111' ' ' ARG . 56.4 m-80 -75.88 115.21 44.29 Favored Pre-proline 0 N--CA 1.463 0.192 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 175.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.42 -26.3 82.41 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.556 2.171 . . . . 0.0 112.193 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -69.62 -47.09 64.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.261 177.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.403 HD21 ' O ' ' A' ' 104' ' ' LEU . 58.5 tp -64.01 -34.6 78.37 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.343 0.592 . . . . 0.0 110.145 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' A' ' 107' ' ' ASN . 70.5 mtp85 -65.05 -42.47 94.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.679 177.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -64.01 -39.79 94.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.062 177.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 84.0 mt -59.04 -48.45 81.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.828 178.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.451 ' HG2' HG21 ' B' ' 474' ' ' VAL . 44.2 mtm -57.77 -53.02 62.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.575 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.561 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.1 m -65.7 -28.86 45.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.714 -175.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -69.14 -46.77 66.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.084 0.469 . . . . 0.0 110.518 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.62 HD13 ' SD ' ' A' ' 127' ' ' MET . 33.8 tp -63.3 -38.94 93.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.861 -178.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.534 ' OD1' ' HG2' ' B' ' 475' ' ' ARG . 9.4 t70 -63.71 -30.34 71.45 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.851 -177.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 74.4 mt-30 -60.09 -29.63 68.71 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.503 0.668 . . . . 0.0 109.819 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.35 18.72 73.65 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 114.62 -1.173 . . . . 0.0 113.902 171.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -67.07 -55.36 14.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.202 0.501 . . . . 0.0 110.227 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -133.71 45.22 2.68 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.368 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.599 ' O ' ' HG2' ' A' ' 127' ' ' MET . 0.0 OUTLIER -56.92 -29.5 63.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.462 -178.037 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.45 -38.41 84.08 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.812 0.339 . . . . 0.0 111.412 -177.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.53 ' H ' ' HD2' ' A' ' 125' ' ' LYS . 0.0 OUTLIER -87.4 -33.9 18.95 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.477 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 97.4 mt -60.69 -36.02 77.74 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.729 -179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' MET . . . . . 0.62 ' SD ' HD13 ' A' ' 117' ' ' LEU . 73.9 mmm -53.6 -43.91 68.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.975 0.417 . . . . 0.0 110.454 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.8 mmm180 -72.44 -38.79 68.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.981 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.518 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.89 -24.55 63.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.419 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -88.82 -30.62 18.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.834 0.35 . . . . 0.0 110.699 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 1.3 mmt -68.75 -10.36 56.07 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.503 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.8 pt20 -95.65 -9.65 31.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.87 0.367 . . . . 0.0 110.499 -178.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.561 ' O ' HG21 ' A' ' 137' ' ' VAL . 3.4 mt-10 -91.97 121.88 66.13 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.749 -175.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.497 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 18.3 Cg_endo -59.31 -20.19 54.33 Favored 'Trans proline' 0 C--O 1.226 -0.113 0 C-N-CA 122.963 2.442 . . . . 0.0 112.585 -177.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.1 mt -80.33 -41.18 25.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.99 0.424 . . . . 0.0 110.535 178.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -78.59 -32.38 47.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.087 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.561 HG21 ' O ' ' A' ' 133' ' ' GLU . 79.6 t -59.91 -42.01 87.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.781 177.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 17.5 mm-40 -69.25 -42.97 74.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.106 178.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -58.35 -49.22 77.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.695 178.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.786 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -61.64 -47.43 85.42 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.98 -177.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -63.91 -33.21 75.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.163 0.506 . . . . 0.0 110.263 -178.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.45 ' O ' HG13 ' A' ' 146' ' ' ILE . 65.3 m -67.4 -51.46 51.59 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.761 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.442 ' O ' HG23 ' A' ' 147' ' ' VAL . 26.1 p -64.64 -33.15 75.26 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.704 -0.225 . . . . 0.0 111.203 -177.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.5 mt -62.71 -36.92 84.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.934 0.397 . . . . 0.0 110.825 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -77.19 -15.32 81.68 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.355 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 142' ' ' CYS . 67.6 mt -91.71 -38.9 11.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.069 0.462 . . . . 0.0 110.964 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 143' ' ' CYS . 19.3 m -95.57 11.35 4.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.108 -177.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.421 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 2.8 pt-20 -47.62 126.8 10.53 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.456 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -69.05 -40.0 7.06 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.289 1.992 . . . . 0.0 111.464 176.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 26.0 t -178.23 36.69 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.624 177.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 51.17 52.76 14.23 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -175.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -89.19 140.88 29.02 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.057 -175.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -96.34 142.06 28.93 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.035 176.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 60.21 27.37 16.87 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.257 0.551 . . . . 0.0 111.299 -176.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 41.1 p . . . . . 0 C--O 1.255 1.394 0 CA-C-O 117.819 -1.086 . . . . 0.0 109.133 173.498 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 14.3 t70 . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 121.154 0.502 . . . . 0.0 110.099 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . 0.458 ' H ' HD11 ' B' ' 463' ' ' ILE . 4.2 mp -61.5 -35.42 66.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.612 -170.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -70.5 -39.71 74.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.17 0.51 . . . . 0.0 109.768 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . 0.53 ' HD1' ' HA ' ' A' ' 85' ' ' ASP . 47.6 t60 -62.48 -51.19 68.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.083 174.17 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.663 ' O ' HG12 ' B' ' 470' ' ' ILE . 34.5 mt-10 -61.59 -43.67 98.43 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.198 -175.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -55.46 -40.08 71.16 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 177.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -31.49 52.85 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -177.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.4 t -63.66 -36.0 74.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.266 175.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.663 HG12 ' O ' ' B' ' 466' ' ' GLU . 34.0 mm -60.86 -38.57 79.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.879 176.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 87.2 mt -59.29 -37.06 76.75 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -68.12 -44.23 76.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.689 176.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 60.4 m -63.15 -56.1 19.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.104 -177.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . 0.451 HG21 ' HG2' ' A' ' 114' ' ' MET . 73.9 t -48.85 -52.66 9.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.762 176.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.534 ' HG2' ' OD1' ' A' ' 118' ' ' ASP . 88.4 mtm180 -69.68 -23.05 63.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.918 -174.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . 0.442 ' CE1' ' HB2' ' A' ' 95' ' ' LEU . 0.8 OUTLIER -71.17 -47.36 58.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.969 0.414 . . . . 0.0 110.013 176.559 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . 0.465 HD11 HD21 ' A' ' 105' ' ' LEU . 74.5 mt -64.89 -54.16 33.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.513 -177.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . 0.416 HG13 ' O ' ' B' ' 474' ' ' VAL . 50.5 mt -54.39 -26.45 15.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.694 178.35 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.576 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 3.6 ttmp? -70.81 -31.15 67.8 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.908 -173.325 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.46 -17.54 10.64 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.785 -0.766 . . . . 0.0 112.581 175.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -91.54 -58.82 2.31 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.967 0.413 . . . . 0.0 112.062 -174.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . 0.411 ' HB2' HG21 ' B' ' 478' ' ' ILE . 73.5 m-85 -86.91 -90.23 0.11 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.436 -169.033 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -102.06 -31.09 10.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.191 0.52 . . . . 0.0 110.681 -174.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.576 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 86.96 8.51 75.73 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.911 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 73.5 mt -84.55 140.03 31.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.24 0.543 . . . . 0.0 111.387 -176.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . 0.426 ' HB3' ' HE3' ' B' ' 479' ' ' LYS . 5.6 p-10 -128.13 -4.7 5.58 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.013 174.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 11.9 t -84.13 29.21 0.57 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.85 -178.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -88.41 107.57 18.92 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.64 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 57.2 m 71.34 167.36 0.31 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.431 -175.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . 62.13 34.7 16.13 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.204 0.526 . . . . 0.0 110.809 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -82.55 123.35 29.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.7 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 63.8 m -146.95 95.28 2.55 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.106 0.479 . . . . 0.0 110.147 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -82.01 15.83 2.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.719 -174.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -81.09 -18.16 47.5 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.229 177.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.246 0.918 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.956 176.736 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.819 0 N-CA-C 111.786 -0.526 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.412 ' O ' ' HB2' ' A' ' 83' ' ' HIS . 79.0 Cg_exo -48.59 115.83 1.8 Allowed 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.231 2.621 . . . . 0.0 112.46 -179.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 82' ' ' PRO . 69.0 m-70 72.3 -47.47 0.67 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.711 0.804 . . . . 0.0 111.567 -177.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 24.9 mmt -86.3 71.96 10.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.205 0.526 . . . . 0.0 111.482 -178.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -115.49 25.66 10.64 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 170.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.9 160.59 29.75 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.847 -173.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.9 p -107.3 157.82 7.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.467 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.8 m -64.07 147.59 51.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.224 0.535 . . . . 0.0 111.251 -176.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.421 HD21 HD11 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -67.68 -31.68 71.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.218 -174.846 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -57.97 -41.13 82.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.369 176.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.444 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 5.3 m-20 -64.41 -40.27 95.46 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.227 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.421 HD11 HD21 ' A' ' 89' ' ' LEU . 83.3 mt -67.71 -36.62 80.96 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.889 -178.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -62.81 -19.06 63.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -79.02 -17.76 54.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.61 0.243 . . . . 0.0 111.034 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.402 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 95.4 mt -61.82 -52.69 63.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.816 0.341 . . . . 0.0 111.327 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -64.27 -22.81 67.63 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.794 -176.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -97.38 -15.31 20.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.275 0.537 . . . . 0.0 111.576 -175.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 68.3 m -71.8 116.11 11.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.51 -29.06 65.99 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.707 -174.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 18.7 m -68.79 -48.54 63.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.958 0.409 . . . . 0.0 110.902 -178.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.413 ' O ' HD11 ' A' ' 105' ' ' LEU . 41.9 tp -68.88 -48.05 64.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.668 -172.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.567 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 7.8 ptp180 -60.3 -28.38 68.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.479 -178.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 71.1 m -66.69 -25.63 66.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.99 0.424 . . . . 0.0 110.789 177.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.442 ' O ' HD23 ' A' ' 110' ' ' LEU . 22.6 mt -81.48 -33.26 32.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.413 HD11 ' O ' ' A' ' 101' ' ' LEU . 11.0 mp -67.48 -12.68 60.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.531 177.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 70.3 mt -77.54 -8.0 57.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.348 177.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -84.21 115.01 58.17 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.705 176.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.33 -36.65 87.6 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.451 2.767 . . . . 0.0 113.373 -175.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 60.3 t60 -69.15 -45.01 71.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.594 0.235 . . . . 0.0 110.866 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.442 HD23 ' O ' ' A' ' 104' ' ' LEU . 49.8 tp -62.12 -38.2 88.03 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.132 0.491 . . . . 0.0 109.999 -178.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.407 ' O ' HG21 ' A' ' 115' ' ' VAL . 58.7 mtp180 -56.11 -49.79 72.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.048 174.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.419 ' HA ' ' NE2' ' A' ' 112' ' ' GLN . 6.7 mm-40 -63.04 -24.16 67.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.924 -179.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 77.4 mt -78.6 -53.24 7.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -177.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' MET . . . . . 0.464 ' HG3' HG13 ' B' ' 474' ' ' VAL . 42.0 ttp -61.28 -42.21 98.27 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.367 -1.288 . . . . 0.0 111.58 -177.29 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.407 HG21 ' O ' ' A' ' 111' ' ' ARG . 26.3 m -72.95 -28.88 27.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.38 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -62.59 -46.2 89.37 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.145 0.497 . . . . 0.0 110.652 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.1 tp -56.46 -33.89 66.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.399 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -65.92 -32.27 73.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.564 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.66 -29.04 69.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.54 0.686 . . . . 0.0 110.553 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 71.94 19.04 78.06 Favored Glycine 0 C--N 1.322 -0.248 0 CA-C-N 114.89 -1.05 . . . . 0.0 113.775 172.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -70.07 -56.01 8.02 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.988 0.423 . . . . 0.0 110.076 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.578 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 20.4 m-20 -123.52 41.37 3.49 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.468 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.85 -33.16 48.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.026 -177.138 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.55 -38.99 65.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.156 0.503 . . . . 0.0 110.896 -177.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.6 mtpt -79.08 -38.84 35.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.502 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 89.6 mt -61.79 -39.09 90.48 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.962 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.88 -35.85 58.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.872 0.368 . . . . 0.0 111.326 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -84.1 -45.43 13.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.227 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.695 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -64.09 -31.96 73.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.749 -177.403 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.54 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 5.2 m-30 -72.39 -22.49 61.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.151 0.5 . . . . 0.0 110.411 -178.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.468 ' HE2' ' HA ' ' A' ' 131' ' ' MET . 1.6 mmt -85.74 1.39 49.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.995 -178.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.695 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 17.7 pt20 -101.19 -14.13 17.84 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 175.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -91.13 120.03 68.64 Favored Pre-proline 0 N--CA 1.451 -0.388 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.331 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.658 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 29.0 Cg_endo -62.6 -13.61 34.71 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.98 2.453 . . . . 0.0 112.32 -179.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 86.9 mt -83.52 -32.29 25.98 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.07 178.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.54 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 47.4 t80 -90.43 -34.36 15.65 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.303 -177.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.658 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 8.6 m -57.11 -46.16 84.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.414 178.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.456 ' N ' HG23 ' A' ' 137' ' ' VAL . 5.7 mm-40 -62.31 -43.93 97.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.45 177.07 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -55.1 -49.74 70.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.818 175.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.743 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.81 -47.99 81.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.946 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -61.82 -33.45 74.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.4 0.619 . . . . 0.0 110.524 -176.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.6 m -76.8 -40.92 46.45 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.49 -177.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.493 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -73.07 -29.47 62.98 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.607 -177.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.743 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.4 mt -60.52 -44.09 96.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.604 178.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.38 -20.68 69.78 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.333 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 56.6 mt -87.85 -30.48 5.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.842 0.353 . . . . 0.0 110.568 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.444 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 23.2 m -102.31 8.98 9.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -176.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 42.6 mm-40 -56.95 117.79 19.78 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 120.644 0.259 . . . . 0.0 110.725 176.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -74.92 -7.22 19.03 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.563 2.175 . . . . 0.0 112.167 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 18.6 t 68.47 82.71 0.17 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.55 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -84.21 27.72 0.67 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.882 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -131.09 129.01 41.36 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.413 176.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -65.47 144.51 56.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.244 -176.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -161.19 157.91 26.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.981 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 42.6 m . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.182 176.178 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 462' ' ' ASP . . . . . 0.588 ' O ' ' HG2' ' B' ' 466' ' ' GLU . 14.1 t70 . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 120.985 0.422 . . . . 0.0 110.724 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 59.8 mt -68.53 -32.25 54.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.47 -173.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 464' ' ' ARG . . . . . 0.439 ' HB2' ' OD1' ' B' ' 462' ' ' ASP . 11.5 mmm180 -58.66 -42.12 87.67 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 175.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 70.8 t60 -65.96 -46.78 76.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.06 177.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 466' ' ' GLU . . . . . 0.599 ' O ' HG12 ' B' ' 470' ' ' ILE . 6.1 mm-40 -56.01 -50.22 71.5 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.059 -178.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 36.2 mtm180 -65.26 -33.08 75.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.618 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.05 -31.44 62.87 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.4 t -66.13 -36.32 77.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.223 174.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 470' ' ' ILE . . . . . 0.599 HG12 ' O ' ' B' ' 466' ' ' GLU . 43.2 mm -61.1 -35.96 69.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.201 176.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 471' ' ' LEU . . . . . 0.478 ' O ' ' HG3' ' B' ' 475' ' ' ARG . 93.3 mt -56.44 -48.48 76.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.12 176.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -59.46 -40.47 86.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.039 177.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.0 m -61.84 -55.47 29.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.976 0.417 . . . . 0.0 110.055 178.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 474' ' ' VAL . . . . . 0.464 HG13 ' HG3' ' A' ' 114' ' ' MET . 45.8 t -51.75 -50.42 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.597 177.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 475' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' B' ' 471' ' ' LEU . 82.8 mtp180 -64.47 -39.0 92.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.286 -175.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 476' ' ' TYR . . . . . 0.404 ' O ' ' HG3' ' B' ' 480' ' ' LYS . 0.9 OUTLIER -67.72 -45.84 73.88 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 120.867 0.365 . . . . 0.0 110.502 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.97 -60.54 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.434 -175.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 56.3 mt -53.65 -28.1 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.763 0.316 . . . . 0.0 111.326 -178.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 479' ' ' LYS . . . . . 0.617 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 27.4 ttpp -76.45 -32.55 58.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.078 -173.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 480' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER -114.39 -15.8 12.05 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.02 -0.672 . . . . 0.0 112.108 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -91.36 -60.24 1.94 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.041 0.448 . . . . 0.0 111.748 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -99.23 -91.63 0.28 Allowed 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -168.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -90.84 -35.71 14.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.326 -169.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 484' ' ' GLY . . . . . 0.617 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 93.67 6.96 61.95 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.138 -178.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 43.2 mt -86.13 162.9 18.16 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.811 0.339 . . . . 0.0 110.781 -178.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -175.45 -43.82 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.742 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 11.3 t -104.32 28.3 7.01 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.992 -179.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -116.39 107.9 15.37 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.99 -171.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 47.9 m -153.26 100.93 2.5 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.267 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -141.33 52.12 1.56 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.525 0.679 . . . . 0.0 110.052 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -120.22 18.8 12.26 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.242 -176.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 23.8 t -124.68 136.59 54.03 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.107 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -97.78 10.83 39.12 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.195 0.522 . . . . 0.0 110.518 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -99.46 -16.9 18.19 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.025 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 42.4 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.946 -179.651 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 . . . . . 0 N--CA 1.451 -0.417 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.508 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 38.3 t -89.01 143.59 10.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.069 -173.045 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.0 m -75.84 142.98 42.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.929 176.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.9 mt -55.24 -31.56 61.6 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.208 -0.906 . . . . 0.0 113.138 -173.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -53.31 -51.05 63.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.946 0.403 . . . . 0.0 110.816 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.485 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 6.2 m-20 -63.81 -35.83 81.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.717 -178.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 84.7 mt -72.66 -39.37 67.18 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.448 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.522 ' HA ' ' CZ ' ' B' ' 476' ' ' TYR . 97.3 mttt -66.94 -26.34 66.79 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.929 0.395 . . . . 0.0 110.985 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -69.99 -17.69 63.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.994 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.496 HD21 HG13 ' A' ' 147' ' ' VAL . 73.4 mt -65.14 -46.88 79.12 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.917 0.389 . . . . 0.0 110.409 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.39 -20.12 71.26 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.578 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -84.59 -23.87 29.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.849 0.357 . . . . 0.0 110.434 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.624 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 43.7 t -70.91 115.42 10.03 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.095 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.11 -30.05 67.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.173 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.9 m -72.99 -45.18 59.38 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.984 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.2 tt -74.3 -44.4 52.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.899 -172.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 98' ' ' SER . 2.8 ptp180 -56.99 -32.27 65.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.95 178.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.502 ' HA ' HD23 ' A' ' 106' ' ' LEU . 71.3 m -68.89 -18.06 64.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.864 0.364 . . . . 0.0 111.275 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 139' ' ' PHE . 17.2 mt -78.08 -33.7 50.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.105 0.479 . . . . 0.0 109.718 178.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -63.2 -18.05 63.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.193 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.502 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.4 mm? -68.94 -10.79 59.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.358 178.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -86.13 118.86 71.15 Favored Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -62.08 -26.64 78.37 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.98 2.453 . . . . 0.0 112.615 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -76.29 -46.65 26.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.913 0.387 . . . . 0.0 110.165 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.427 HD11 ' HB2' ' A' ' 139' ' ' PHE . 3.9 tt -62.04 -42.81 99.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.267 -176.638 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 8.9 ptp180 -67.21 -31.04 71.15 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.828 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -70.37 -38.61 74.8 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.659 -0.246 . . . . 0.0 110.366 176.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.437 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 81.3 mt -57.36 -50.92 71.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.159 0.504 . . . . 0.0 109.929 174.196 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.451 ' HG2' HG22 ' B' ' 474' ' ' VAL . 62.2 mtp -52.01 -57.0 10.81 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.72 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.715 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 27.4 m -64.04 -36.28 76.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.729 -176.277 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -64.6 -47.69 77.68 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.018 0.437 . . . . 0.0 110.927 178.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 62.3 tp -60.93 -40.35 92.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.058 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -66.4 -41.07 89.87 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.685 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.715 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 71.8 mt-30 -64.1 -28.31 69.69 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.595 0.712 . . . . 0.0 110.27 -178.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 75.69 31.45 56.21 Favored Glycine 0 N--CA 1.444 -0.815 0 CA-C-N 114.687 -1.142 . . . . 0.0 113.703 168.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -51.43 -42.25 61.39 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.059 0.457 . . . . 0.0 109.958 178.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.496 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 10.1 t70 -162.72 72.81 0.34 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 170.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.708 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.6 OUTLIER -53.76 -26.53 23.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.99 178.903 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.31 -54.69 43.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.411 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -25.95 27.25 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.291 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.55 HD22 ' CE2' ' A' ' 130' ' ' TYR . 95.4 mt -62.48 -43.36 99.01 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.438 178.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.575 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.4 OUTLIER -57.2 -28.49 62.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.921 0.391 . . . . 0.0 111.432 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -84.42 -49.16 8.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.922 0.391 . . . . 0.0 110.509 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.475 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -67.96 -16.35 64.02 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.302 -176.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.55 ' CE2' HD22 ' A' ' 126' ' ' LEU . 3.0 m-30 -88.78 -23.26 22.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.734 0.302 . . . . 0.0 111.722 -179.293 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -84.09 -0.18 50.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.085 0.469 . . . . 0.0 111.03 -176.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.475 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.5 pt20 -101.81 -16.22 16.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.963 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.43 ' O ' HG23 ' A' ' 137' ' ' VAL . 2.4 mt-10 -93.65 118.77 67.51 Favored Pre-proline 0 N--CA 1.449 -0.505 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.713 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 12.1 Cg_endo -55.54 -25.87 51.72 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.072 2.515 . . . . 0.0 112.658 -173.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.6 mt -66.64 -45.23 79.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.964 0.411 . . . . 0.0 110.658 -178.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.425 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 37.0 t80 -76.88 -29.06 55.63 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 -177.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 133' ' ' GLU . 75.2 t -62.9 -42.56 96.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.292 176.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.713 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 33.8 mm-40 -60.64 -46.66 89.47 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.895 0.379 . . . . 0.0 110.016 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' PHE . . . . . 0.509 ' HA ' ' CD1' ' A' ' 104' ' ' LEU . 77.1 t80 -59.57 -47.39 85.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.771 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.775 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.74 -47.22 84.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.185 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -67.94 -27.37 66.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.12 0.486 . . . . 0.0 110.395 -176.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 69.7 m -75.71 -44.17 43.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.407 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 27.6 p -69.74 -30.61 68.25 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.816 -176.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 86.1 mt -59.27 -48.12 82.82 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.966 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.42 -21.65 66.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.634 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 54.6 mt -91.02 -32.66 5.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.568 0.223 . . . . 0.0 111.361 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.496 HG13 HD21 ' A' ' 95' ' ' LEU . 14.9 m -102.53 -16.88 7.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -174.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 . . . . . 0 C--N 1.324 -0.524 0 CA-C-O 120.737 0.303 . . . . 0.0 111.571 -178.569 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 41.0 mm . . . . . 0 C--O 1.233 0.188 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -60.72 -41.36 95.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.572 0.701 . . . . 0.0 109.448 177.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -75.71 -49.38 18.46 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.805 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.548 ' O ' HG12 ' B' ' 470' ' ' ILE . 45.6 mt-10 -57.66 -47.93 80.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.171 -173.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 467' ' ' ARG . . . . . 0.575 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 78.3 mtm180 -60.37 -35.49 75.83 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -177.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.98 -31.22 58.88 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.99 -35.37 73.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.323 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.548 HG12 ' O ' ' B' ' 466' ' ' GLU . 24.6 mm -61.84 -35.92 70.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.101 177.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 86.8 mt -60.46 -38.02 82.85 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.829 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.508 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 1.8 mp0 -68.15 -41.11 82.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.877 0.37 . . . . 0.0 110.579 177.24 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.1 m -63.96 -56.11 17.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.806 -178.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.451 HG22 ' HG2' ' A' ' 114' ' ' MET . 82.7 t -52.3 -51.06 34.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.971 178.182 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 32.3 ttm180 -66.37 -33.33 75.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.492 -172.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 476' ' ' TYR . . . . . 0.522 ' CZ ' ' HA ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -63.72 -46.89 83.37 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.097 0.475 . . . . 0.0 109.948 176.91 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 75.6 mt -64.12 -51.02 74.17 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.511 -176.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 478' ' ' ILE . . . . . 0.447 HG13 ' O ' ' B' ' 474' ' ' VAL . 40.5 mt -58.21 -23.68 22.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.96 0.41 . . . . 0.0 110.918 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 20.7 tptp -74.73 -35.31 62.66 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.254 -175.205 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.602 0 C-N-CA 119.916 -0.714 . . . . 0.0 112.406 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.971 0.415 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.423 HG21 HG13 ' B' ' 469' ' ' VAL . 46.5 t -68.99 130.53 34.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.059 -176.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.5 m -67.89 156.8 36.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.049 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.617 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -59.48 -42.07 91.24 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 -176.671 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 28.5 pt20 -52.94 -38.29 61.84 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.99 0.424 . . . . 0.0 111.249 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -80.46 -17.76 50.72 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.176 -177.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.416 ' HA ' HD13 ' A' ' 95' ' ' LEU . 84.2 mt -86.8 -35.35 19.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.316 176.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.617 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 53.2 mtpt -54.47 -37.1 64.84 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -175.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -17.07 62.17 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -175.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 92' ' ' LEU . 9.6 mp -60.3 -48.7 80.63 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -66.81 -21.46 71.26 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.263 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -85.09 -23.25 28.59 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.97 0.414 . . . . 0.0 110.609 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.646 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 42.6 t -65.68 118.21 9.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.259 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.62 -27.24 68.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.265 -177.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 80.2 m -75.12 -43.2 54.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.062 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 20.0 tp -75.64 -44.29 43.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.763 -171.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.646 ' HG2' ' O ' ' A' ' 98' ' ' SER . 7.6 ptp180 -58.91 -30.68 67.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.062 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.1 m -65.47 -24.86 67.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.029 0.443 . . . . 0.0 110.876 177.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.9 mt -83.63 -32.63 25.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.824 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.48 -21.96 66.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.457 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 74.6 mt -71.63 -13.15 61.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.848 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -81.37 113.94 45.53 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.928 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.504 ' HA ' ' NE ' ' A' ' 111' ' ' ARG . 48.9 Cg_exo -56.06 -37.02 96.92 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.088 2.526 . . . . 0.0 113.388 -177.012 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.503 ' CD2' HD22 ' A' ' 135' ' ' LEU . 47.7 t60 -69.27 -41.39 76.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.044 0.449 . . . . 0.0 110.384 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.515 HD11 ' HB2' ' A' ' 139' ' ' PHE . 2.5 tt -64.71 -46.64 81.45 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.985 -177.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.504 ' NE ' ' HA ' ' A' ' 108' ' ' PRO . 16.3 ptt180 -68.15 -28.47 67.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.872 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -44.32 95.85 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.168 0.508 . . . . 0.0 109.737 173.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.86 -47.25 85.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.183 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.472 ' HG2' HG22 ' B' ' 474' ' ' VAL . 51.1 mtp -56.7 -50.79 71.11 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.208 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.61 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.2 m -65.4 -32.27 57.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.861 -0.335 . . . . 0.0 111.136 -178.066 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -65.94 -41.27 91.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.054 0.454 . . . . 0.0 110.704 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.447 HD11 ' SD ' ' A' ' 127' ' ' MET . 32.9 tp -68.14 -37.38 80.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.759 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.446 ' OD1' HG21 ' B' ' 478' ' ' ILE . 36.7 t70 -64.29 -29.57 70.65 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.778 0.323 . . . . 0.0 111.472 -177.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.61 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 68.4 mt-30 -63.53 -28.37 69.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.375 0.607 . . . . 0.0 110.721 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.27 27.78 72.8 Favored Glycine 0 CA--C 1.516 0.154 0 CA-C-N 114.832 -1.076 . . . . 0.0 114.106 170.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -85.0 -53.79 5.06 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.177 0.513 . . . . 0.0 110.29 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -124.04 33.45 5.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.527 -176.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.676 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -45.77 -38.27 6.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.847 -1.069 . . . . 0.0 112.08 177.023 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.16 -41.5 79.33 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 121.01 0.433 . . . . 0.0 111.527 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -85.4 -36.36 20.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.523 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.44 HD22 ' CE1' ' A' ' 130' ' ' TYR . 96.2 mt -57.48 -42.48 82.69 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.63 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.62 ' HG2' ' O ' ' A' ' 123' ' ' LYS . 69.4 mmm -53.16 -39.63 63.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.902 0.382 . . . . 0.0 110.768 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 -70.74 -48.9 52.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.307 0.575 . . . . 0.0 110.208 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.605 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -70.64 -19.45 62.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.221 -0.9 . . . . 0.0 112.328 -174.23 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.57 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.5 m-30 -85.47 -26.22 26.43 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.84 0.352 . . . . 0.0 110.618 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' MET . . . . . 0.466 ' HE2' HG12 ' A' ' 137' ' ' VAL . 19.2 mmt -80.75 0.54 34.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.202 -179.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.605 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.6 pt20 -105.73 -5.15 20.17 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.864 0.364 . . . . 0.0 110.296 177.503 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.401 ' O ' HG22 ' A' ' 137' ' ' VAL . 2.3 mt-10 -106.23 121.41 45.56 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.481 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.705 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 23.8 Cg_endo -61.42 -13.12 27.29 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.298 2.665 . . . . 0.0 113.085 -176.498 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.503 HD22 ' CD2' ' A' ' 109' ' ' HIS . 6.8 mp -77.3 -40.34 44.69 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.135 177.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.57 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 40.4 t80 -89.06 -33.16 17.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.105 0.479 . . . . 0.0 110.229 -172.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.705 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 9.5 m -58.31 -47.73 86.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.385 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.465 ' N ' HG23 ' A' ' 137' ' ' VAL . 10.8 pt-20 -67.63 -34.96 78.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.775 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' PHE . . . . . 0.515 ' HB2' HD11 ' A' ' 110' ' ' LEU . 45.3 t80 -58.06 -49.6 76.33 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 173.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.764 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -61.23 -46.42 90.48 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.73 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.49 -32.24 72.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.379 0.609 . . . . 0.0 110.885 -176.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 95.2 m -82.71 -38.42 23.35 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.093 -176.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.476 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 25.7 p -73.65 -27.02 61.04 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.246 -176.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.764 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 93.6 mt -60.06 -38.23 82.21 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.098 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -71.87 -16.81 76.52 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.387 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 25.1 mt -91.26 -28.77 4.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.729 0.299 . . . . 0.0 110.896 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 31.0 m -96.7 2.61 10.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 . . . . . 0 N--CA 1.465 0.296 0 C-N-CA 121.127 -0.229 . . . . 0.0 110.484 175.895 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 57.6 mt . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -57.56 -45.71 84.81 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.469 0.652 . . . . 0.0 109.287 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 63.8 t60 -67.7 -55.87 11.51 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.499 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.479 ' O ' ' HB ' ' B' ' 469' ' ' VAL . 38.4 mt-10 -56.68 -46.5 81.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.588 -172.589 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -74.12 -28.47 61.36 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.363 -175.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -27.02 48.62 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 469' ' ' VAL . . . . . 0.479 ' HB ' ' O ' ' B' ' 466' ' ' GLU . 2.4 t -61.23 -33.96 58.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.606 173.01 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.418 HG12 ' O ' ' B' ' 466' ' ' GLU . 30.1 mm -65.4 -28.07 43.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.797 -178.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.81 -29.91 70.47 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.124 0.487 . . . . 0.0 110.344 177.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -81.27 -40.59 23.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.01 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 61.2 m -62.09 -56.85 14.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.816 -177.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.687 ' O ' HG12 ' B' ' 478' ' ' ILE . 88.5 t -54.12 -50.57 54.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.402 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -64.69 -36.89 85.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.984 -171.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -43.78 88.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.24 0.543 . . . . 0.0 109.743 175.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.504 ' O ' ' HD3' ' B' ' 480' ' ' LYS . 78.1 mt -65.91 -53.84 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.227 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 478' ' ' ILE . . . . . 0.687 HG12 ' O ' ' B' ' 474' ' ' VAL . 8.0 mm -54.5 -31.64 23.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.702 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -55.08 -39.69 69.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.63 -174.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 480' ' ' LYS . . . . . 0.504 ' HD3' ' O ' ' B' ' 477' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.465 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.019 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 121.222 0.534 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.655 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 26.0 t -110.12 145.26 16.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.109 -176.241 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.0 m -62.56 142.16 58.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.072 0.463 . . . . 0.0 110.819 178.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.452 HD22 HD12 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -59.29 -33.18 70.76 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.548 -176.416 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -58.13 -40.86 82.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.791 177.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.423 ' HB2' HG12 ' A' ' 87' ' ' VAL . 3.5 m-20 -65.78 -42.92 90.21 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.589 ' HA ' HD13 ' A' ' 95' ' ' LEU . 83.7 mt -66.61 -34.64 78.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.845 -175.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -56.23 -32.95 64.94 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -66.18 -24.59 66.66 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.813 0.339 . . . . 0.0 111.702 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.589 HD13 ' HA ' ' A' ' 92' ' ' LEU . 7.5 mp -64.69 -38.03 89.61 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.768 0.318 . . . . 0.0 111.065 -175.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.56 -26.22 71.83 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.67 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -100.71 4.41 43.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.147 0.499 . . . . 0.0 110.856 -178.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.512 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 71.1 m -84.93 107.24 16.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.172 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.39 -29.95 69.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.242 -177.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.2 m -70.64 -39.73 73.49 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 -177.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.465 HD11 ' CD2' ' A' ' 139' ' ' PHE . 40.8 tp -74.73 -48.64 24.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.387 -176.226 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.512 ' HG2' ' O ' ' A' ' 98' ' ' SER . 4.5 ptp180 -61.39 -27.29 68.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.109 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.5 t -64.16 -23.91 67.49 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.13 0.491 . . . . 0.0 110.148 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.1 mt -87.51 -33.38 18.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.194 178.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.506 HD21 HD13 ' B' ' 477' ' ' ILE . 11.1 mp -69.86 -6.69 34.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.834 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 58.9 mt -67.93 -14.67 63.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.419 176.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -84.37 121.52 75.2 Favored Pre-proline 0 C--O 1.235 0.325 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.934 175.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.06 -29.91 90.3 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.884 2.389 . . . . 0.0 112.796 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 65.1 t60 -70.49 -44.61 67.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.736 0.303 . . . . 0.0 110.8 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.44 ' O ' HD23 ' A' ' 110' ' ' LEU . 4.3 tt -61.57 -42.14 98.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.221 0.534 . . . . 0.0 110.067 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -70.56 -32.73 70.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.281 -178.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -66.47 -37.54 85.33 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.63 175.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 76.1 mt -55.06 -51.26 66.89 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.47 ' HB3' HD11 ' B' ' 478' ' ' ILE . 49.5 mtm -53.77 -54.62 35.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 71.7 t -57.03 -39.49 66.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.544 -178.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -65.21 -41.37 94.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.464 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.515 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 54.9 tp -71.19 -31.98 68.3 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.258 -178.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.446 ' HB2' ' CD1' ' B' ' 478' ' ' ILE . 14.1 t70 -61.07 -38.9 87.86 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.954 -178.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -60.35 -29.37 68.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.557 0.694 . . . . 0.0 111.165 -177.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 66.13 21.31 69.85 Favored Glycine 0 N--CA 1.451 -0.367 0 CA-C-N 114.647 -1.161 . . . . 0.0 113.448 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -72.36 -34.24 67.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.324 0.583 . . . . 0.0 110.297 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.441 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 22.1 p-10 -145.38 40.07 1.2 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.384 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.599 ' N ' ' HD3' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.04 -33.91 5.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.471 -1.24 . . . . 0.0 112.144 177.735 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.7 -52.1 66.54 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.509 -175.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 122' ' ' ASP . 0.2 OUTLIER -76.24 -34.57 59.19 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.359 179.9 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.527 HD22 ' CE1' ' A' ' 130' ' ' TYR . 89.2 mt -58.32 -44.34 88.59 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.462 -178.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.58 -35.07 60.42 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.932 0.396 . . . . 0.0 111.103 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -84.21 -41.38 17.03 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.684 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -71.1 -17.07 62.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.027 -176.186 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.527 ' CE1' HD22 ' A' ' 126' ' ' LEU . 3.8 m-30 -87.58 -28.26 22.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.944 0.402 . . . . 0.0 110.857 179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' MET . . . . . 0.545 ' HE2' HG12 ' A' ' 137' ' ' VAL . 4.0 mmt -80.89 5.2 16.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.322 -177.018 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.517 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 28.4 pt20 -104.03 -7.95 19.92 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 176.084 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -103.03 126.24 32.99 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.403 -176.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.711 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 30.4 Cg_endo -63.59 -14.28 41.65 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.904 2.403 . . . . 0.0 112.516 -178.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.2 mp -73.46 -44.08 58.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.771 0.32 . . . . 0.0 110.416 176.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.418 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 36.9 t80 -88.8 -29.87 19.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.111 0.481 . . . . 0.0 110.126 -170.198 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.711 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 18.6 m -59.7 -48.59 86.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.786 177.32 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.511 ' N ' HG23 ' A' ' 137' ' ' VAL . 36.7 mt-10 -62.24 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.367 176.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' PHE . . . . . 0.465 ' CD2' HD11 ' A' ' 101' ' ' LEU . 61.8 t80 -54.06 -49.18 69.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.695 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.672 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.72 -47.35 81.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.935 178.023 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -61.1 -31.25 70.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.506 0.67 . . . . 0.0 110.493 -176.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' CYS . . . . . 0.426 ' O ' HG13 ' A' ' 146' ' ' ILE . 78.2 m -77.96 -50.14 12.74 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.532 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -65.88 -29.72 70.21 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.551 0.215 . . . . 0.0 111.298 -175.013 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 57.7 mt -66.57 -23.31 66.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.765 0.316 . . . . 0.0 110.745 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -86.55 -14.67 65.27 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.063 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 142' ' ' CYS . 25.4 mt -91.86 -31.62 4.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.858 0.361 . . . . 0.0 110.906 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.458 ' HB ' HG11 ' A' ' 87' ' ' VAL . 23.0 m -106.8 4.95 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -177.231 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.402 ' HG3' ' H ' ' A' ' 148' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 121.862 0.839 . . . . 0.0 113.202 -172.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 463' ' ' ILE . . . . . 0.574 ' O ' ' HB2' ' B' ' 467' ' ' ARG . 42.4 mm . . . . . 0 C--O 1.223 -0.303 0 N-CA-C 111.397 0.147 . . . . 0.0 111.397 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -60.66 -47.63 85.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.074 0.464 . . . . 0.0 110.3 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 15.5 t60 -71.81 -43.51 65.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.187 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.533 ' O ' HG12 ' B' ' 470' ' ' ILE . 49.2 mt-10 -69.78 -22.96 63.29 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.016 -174.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 467' ' ' ARG . . . . . 0.574 ' HB2' ' O ' ' B' ' 463' ' ' ILE . 30.8 ttp180 -62.94 -42.74 99.91 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.188 0.595 . . . . 0.0 111.301 177.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -80.41 -18.38 49.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.405 0.621 . . . . 0.0 109.884 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 469' ' ' VAL . . . . . 0.515 ' HB ' ' HA ' ' B' ' 466' ' ' GLU . 2.1 t -67.35 -32.0 55.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.386 171.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.533 HG12 ' O ' ' B' ' 466' ' ' GLU . 32.5 mm -60.14 -31.87 49.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.565 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 471' ' ' LEU . . . . . 0.539 ' O ' ' HG3' ' B' ' 475' ' ' ARG . 85.9 mt -53.9 -44.13 70.24 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.823 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.655 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.8 mp0 -64.8 -41.51 95.75 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.461 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 38.1 m -61.56 -53.28 58.46 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.226 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.476 ' O ' HG13 ' B' ' 478' ' ' ILE . 78.6 t -51.78 -57.78 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.881 176.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.539 ' HG3' ' O ' ' B' ' 471' ' ' LEU . 43.0 mtp180 -73.9 -20.24 60.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.326 -0.397 . . . . 0.0 112.039 -169.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.42 -46.16 70.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.033 0.444 . . . . 0.0 109.967 174.438 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.506 HD13 HD21 ' A' ' 105' ' ' LEU . 74.8 mt -65.36 -54.6 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.034 -178.381 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 478' ' ' ILE . . . . . 0.476 HG13 ' O ' ' B' ' 474' ' ' VAL . 53.5 mt -53.43 -31.57 19.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.967 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 22.7 tptm -56.56 -48.43 77.37 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.275 -174.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.855 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.77 -175.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 . . . . . 0 C--O 1.233 0.216 0 CA-C-O 121.127 0.489 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 24.2 t -75.26 132.01 34.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.416 -173.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.8 m -70.02 153.81 42.74 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.725 176.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.03 -41.49 87.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.867 0.365 . . . . 0.0 110.083 -175.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -55.06 -39.21 68.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.552 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -71.57 -38.35 70.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.907 0.384 . . . . 0.0 110.259 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.9 mt -65.14 -35.07 79.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.251 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -53.73 -32.27 51.5 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.113 178.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -70.5 -18.38 62.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.741 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.08 -52.1 60.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.63 0.252 . . . . 0.0 111.047 -177.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.45 -16.21 62.58 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.129 -0.557 . . . . 0.0 112.932 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 32.8 mm-40 -83.11 -24.1 32.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.819 0.342 . . . . 0.0 110.687 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.525 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.9 t -74.61 113.33 11.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.323 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -24.55 65.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.469 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.5 m -72.7 -41.07 65.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.7 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.437 ' O ' HD13 ' A' ' 105' ' ' LEU . 61.3 tp -67.43 -54.39 20.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.414 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.607 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 6.8 ptp180 -60.55 -24.94 65.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.229 -179.341 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.3 t -58.85 -30.07 67.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.208 0.528 . . . . 0.0 110.2 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 mt -86.71 -32.74 20.3 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.005 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.547 HD21 HD13 ' B' ' 477' ' ' ILE . 9.2 mp -61.59 -20.72 63.63 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.476 178.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 80.8 mt -68.14 -12.64 61.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.185 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -84.69 116.55 65.73 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.075 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.434 ' O ' ' HG2' ' A' ' 111' ' ' ARG . 67.5 Cg_exo -52.63 -36.18 70.74 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 123.802 3.002 . . . . 0.0 113.44 -176.187 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -67.34 -45.35 76.66 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.09 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 50.1 tp -65.85 -38.29 88.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.95 0.405 . . . . 0.0 111.046 -176.079 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 108' ' ' PRO . 30.1 ptt180 -69.93 -27.64 64.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.094 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 65.3 mm-40 -70.8 -37.81 73.29 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.549 174.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 88.1 mt -58.07 -46.28 85.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.326 176.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.44 ' HG2' HG22 ' B' ' 474' ' ' VAL . 59.0 mtm -58.1 -54.8 42.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.437 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.592 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 32.0 m -66.53 -23.31 31.23 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -175.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -76.47 -45.79 29.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.15 0.5 . . . . 0.0 110.792 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.541 HD12 ' CD2' ' A' ' 130' ' ' TYR . 0.7 OUTLIER -64.48 -49.97 69.28 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.414 -175.885 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -55.65 -21.4 17.84 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.393 -1.276 . . . . 0.0 111.014 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 75.2 mt-30 -65.11 -29.67 70.55 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.499 0.666 . . . . 0.0 109.4 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.16 17.09 63.2 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 114.44 -1.254 . . . . 0.0 113.891 172.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -54.36 -54.94 33.81 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.585 ' OD2' ' HG2' ' A' ' 125' ' ' LYS . 27.3 t70 -143.48 65.92 1.31 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.791 0.805 . . . . 0.0 109.464 172.047 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.68 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -55.54 -23.36 26.13 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.92 179.381 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -53.12 -52.95 57.04 Favored 'General case' 0 C--O 1.231 0.131 0 O-C-N 123.319 0.387 . . . . 0.0 111.828 -177.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.585 ' HG2' ' OD2' ' A' ' 122' ' ' ASP . 18.5 pttm -85.38 -30.01 23.97 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.176 -0.61 . . . . 0.0 111.041 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.639 HD22 ' CE1' ' A' ' 130' ' ' TYR . 36.8 mt -60.52 -43.46 97.08 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.854 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.462 ' O ' ' HG2' ' A' ' 131' ' ' MET . 0.0 OUTLIER -55.61 -38.64 69.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.745 0.307 . . . . 0.0 111.546 179.782 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -84.08 -40.09 18.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.934 0.397 . . . . 0.0 110.873 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.501 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.81 -17.6 63.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.846 -176.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.639 ' CE1' HD22 ' A' ' 126' ' ' LEU . 5.2 m-30 -84.95 -28.41 25.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.066 0.46 . . . . 0.0 110.34 -179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' MET . . . . . 0.496 ' HE3' HG12 ' A' ' 137' ' ' VAL . 54.9 mmm -78.59 4.35 13.72 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.357 -178.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.501 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 7.2 pt20 -94.31 -14.83 25.02 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.316 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -99.65 125.25 41.35 Favored Pre-proline 0 N--CA 1.449 -0.48 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.669 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.707 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 29.0 Cg_endo -63.14 -14.21 40.31 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.056 2.504 . . . . 0.0 112.842 -174.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.401 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.3 mp -75.52 -36.15 60.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.927 0.394 . . . . 0.0 110.264 176.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.541 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 35.8 t80 -89.97 -33.88 16.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.152 -173.285 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.707 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 21.0 m -58.19 -49.29 82.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.027 178.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.527 ' N ' HG23 ' A' ' 137' ' ' VAL . 72.7 mm-40 -62.58 -41.44 98.95 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.542 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -55.31 -49.8 71.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.659 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.792 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.61 -48.8 75.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.707 177.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -59.39 -30.73 68.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.363 0.601 . . . . 0.0 110.621 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.7 m -76.2 -52.68 9.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.398 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.545 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.4 p -64.5 -30.82 71.85 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 121.121 -0.232 . . . . 0.0 111.487 -174.062 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.792 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 82.6 mt -60.0 -44.96 94.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.779 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -72.19 -15.17 76.68 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.406 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 65.8 mt -91.19 -36.84 8.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 120.748 0.309 . . . . 0.0 111.315 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 27.7 m -94.55 5.93 7.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -173.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 6.7 mm-40 . . . . . 0 C--N 1.326 -0.447 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 174.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 72.6 mt . . . . . 0 C--O 1.226 -0.147 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -58.2 -44.46 88.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.438 0.637 . . . . 0.0 109.827 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 465' ' ' HIS . . . . . 0.402 ' HA ' ' ND2' ' B' ' 468' ' ' ASN . 62.9 t60 -65.49 -55.27 18.77 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.293 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.34 -38.0 82.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.133 -173.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -72.23 -42.98 65.1 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 111.642 0.238 . . . . 0.0 111.642 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 468' ' ' ASN . . . . . 0.402 ' ND2' ' HA ' ' B' ' 465' ' ' HIS . 2.1 p30 -76.01 -23.56 55.21 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.8 t -58.34 -32.38 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.702 174.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.541 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 25.9 mm -62.98 -37.55 79.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.814 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 85.1 mt -53.55 -42.26 67.3 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.223 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -65.44 -43.31 90.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.396 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 53.3 m -62.04 -54.09 46.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.593 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.44 HG22 ' HG2' ' A' ' 114' ' ' MET . 69.2 t -47.88 -54.33 3.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.762 176.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.456 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 26.7 ttm180 -67.93 -35.73 78.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.596 -173.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -43.17 95.35 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.051 0.453 . . . . 0.0 110.133 178.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.547 HD13 HD21 ' A' ' 105' ' ' LEU . 97.5 mt -67.42 -55.28 17.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.638 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 56.9 mt -54.46 -23.44 10.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.025 0.441 . . . . 0.0 111.026 176.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 15.3 tppt? -69.99 -48.88 56.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.927 -175.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 480' ' ' LYS . . . . . 0.432 ' HD2' ' HB3' ' B' ' 479' ' ' LYS . 2.1 mptp? . . . . . 0 C--N 1.328 -0.363 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.474 -177.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 . . . . . 0 N--CA 1.446 -0.65 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.556 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 27.7 t -99.8 133.69 41.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.295 -174.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.2 m -55.76 134.93 51.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.924 175.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -59.88 -32.86 71.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.263 -176.315 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -60.37 -40.95 92.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.696 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -64.46 -43.07 95.41 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.159 0.504 . . . . 0.0 110.149 177.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 76.8 mt -65.45 -33.91 77.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.409 -178.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 63.0 mttm -62.5 -24.7 67.62 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -74.36 -18.02 60.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.669 0.271 . . . . 0.0 110.791 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.437 HD21 HG13 ' A' ' 147' ' ' VAL . 91.0 mt -62.27 -42.31 99.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.957 0.408 . . . . 0.0 110.479 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -70.63 -19.01 76.16 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.723 -0.672 . . . . 0.0 112.379 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -86.5 -24.75 25.45 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.85 0.357 . . . . 0.0 110.435 -178.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.656 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.5 t -68.49 108.33 3.25 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.52 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.4 -24.67 66.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.051 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.5 m -75.43 -48.64 21.89 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.817 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.2 tp -67.36 -49.3 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.802 -174.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.656 ' HG2' ' O ' ' A' ' 98' ' ' SER . 8.2 ptp180 -60.14 -28.51 67.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.279 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.477 ' O ' ' HB2' ' A' ' 106' ' ' LEU . 22.7 t -66.9 -25.68 66.5 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.043 0.449 . . . . 0.0 110.096 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 27.3 mt -76.51 -33.22 58.62 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.404 HD21 HD13 ' B' ' 477' ' ' ILE . 10.1 mp -66.59 -15.97 63.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.825 177.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 103' ' ' SER . 3.9 mm? -69.12 -13.83 62.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.645 175.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -78.63 116.32 58.59 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.804 175.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.62 -26.59 82.6 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.99 2.46 . . . . 0.0 112.514 -175.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.464 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 66.2 t60 -74.56 -46.14 40.86 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.776 178.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.402 ' HA ' HD12 ' A' ' 113' ' ' LEU . 51.8 tp -64.77 -39.11 93.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.899 0.381 . . . . 0.0 110.916 -176.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -67.14 -33.22 74.97 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 -70.17 -36.42 74.68 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.24 178.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 109' ' ' HIS . 95.3 mt -58.39 -54.31 48.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.908 175.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.443 ' HG2' HG22 ' B' ' 474' ' ' VAL . 70.7 mtp -55.83 -50.42 70.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.163 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.599 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 48.7 t -59.21 -40.24 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.284 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 16.7 m-20 -60.37 -47.23 86.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.171 0.51 . . . . 0.0 111.088 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 55.9 tp -64.2 -37.74 88.54 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.21 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.474 ' HB2' HD12 ' B' ' 478' ' ' ILE . 26.8 t70 -63.94 -35.63 81.32 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.119 -179.221 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.599 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 23.6 mt-30 -62.45 -28.92 70.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.582 0.706 . . . . 0.0 110.426 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 70.57 27.39 72.61 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 114.443 -1.253 . . . . 0.0 113.61 171.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -56.5 -55.18 37.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.95 0.405 . . . . 0.0 110.4 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.57 ' O ' HD13 ' A' ' 126' ' ' LEU . 27.5 t70 -151.57 77.22 1.23 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.542 0.687 . . . . 0.0 109.723 174.079 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.677 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.6 OUTLIER -53.68 -23.72 12.31 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.802 -1.09 . . . . 0.0 111.629 178.618 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.9 -51.76 67.92 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -175.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -71.06 -50.06 37.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.8 176.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 122' ' ' ASP . 11.1 mp -51.73 -45.65 63.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -175.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.455 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.1 OUTLIER -54.38 -45.63 72.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.835 0.35 . . . . 0.0 111.658 -179.556 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 42.5 mtm180 -83.44 -35.44 24.99 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.078 -176.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.51 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -73.16 -16.86 61.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.563 -177.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.507 ' HB3' ' CG ' ' A' ' 136' ' ' PHE . 13.1 m-30 -89.16 -27.08 20.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.088 0.471 . . . . 0.0 110.743 177.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' MET . . . . . 0.501 ' HE2' HG12 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -79.0 6.29 9.69 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.543 -177.563 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 30.0 pt20 -102.38 -22.85 14.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.845 0.355 . . . . 0.0 110.869 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -103.33 138.6 19.59 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 121.048 0.451 . . . . 0.0 111.37 -175.581 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.756 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 35.2 Cg_endo -63.42 -13.53 36.74 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.829 3.019 . . . . 0.0 114.043 -171.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.452 HD22 ' CD2' ' A' ' 109' ' ' HIS . 11.0 mp -77.15 -39.15 50.15 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.322 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.507 ' CG ' ' HB3' ' A' ' 130' ' ' TYR . 39.8 t80 -91.51 -33.77 15.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.0 0.428 . . . . 0.0 110.29 -174.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.756 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 15.5 m -56.72 -51.17 70.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.339 179.15 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.524 ' N ' HG23 ' A' ' 137' ' ' VAL . 39.5 mm-40 -66.48 -35.35 80.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.597 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -56.4 -51.11 69.56 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 173.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.75 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.01 -47.4 83.27 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.702 178.088 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.72 -33.16 71.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.29 0.567 . . . . 0.0 110.633 -176.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.4 m -76.12 -48.63 19.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.391 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.519 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 25.6 p -67.19 -30.7 70.72 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.91 -174.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.75 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 74.6 mt -58.95 -47.14 86.14 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.833 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.33 -27.82 73.57 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.248 -176.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 69.8 mt -76.62 -42.12 34.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.805 0.336 . . . . 0.0 110.726 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.437 HG13 HD21 ' A' ' 95' ' ' LEU . 23.4 m -90.2 3.55 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -174.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.651 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 7.4 mm-40 . . . . . 0 N--CA 1.465 0.287 0 O-C-N 123.185 0.303 . . . . 0.0 110.473 176.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 82.4 mt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.802 0.334 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -54.99 -40.23 69.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.356 174.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -74.97 -47.28 30.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.566 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.588 ' O ' HG12 ' B' ' 470' ' ' ILE . 40.5 mt-10 -57.29 -45.96 83.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.79 -176.024 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 467' ' ' ARG . . . . . 0.455 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 21.8 mtm180 -64.04 -29.57 70.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -177.084 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -32.63 59.24 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.4 t -66.14 -35.7 75.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.388 176.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.588 HG12 ' O ' ' B' ' 466' ' ' GLU . 30.7 mm -63.06 -33.78 62.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.246 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 471' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 90.1 mt -57.45 -48.67 78.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.357 177.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.556 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.1 mp0 -58.88 -36.78 75.21 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.094 178.387 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 57.5 m -63.96 -58.82 5.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.987 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.443 HG22 ' HG2' ' A' ' 114' ' ' MET . 94.2 t -50.45 -44.55 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.808 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 31.2 mmt180 -62.88 -44.04 97.19 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.015 -177.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 476' ' ' TYR . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -67.56 -50.28 59.23 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.67 -179.348 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.404 HD13 HD21 ' A' ' 105' ' ' LEU . 83.9 mt -60.79 -59.27 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.746 -174.189 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 478' ' ' ILE . . . . . 0.474 HD12 ' HB2' ' A' ' 118' ' ' ASP . 67.9 mt -58.81 -23.92 24.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.301 -177.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 5.6 tmtt? -64.57 -42.13 95.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.652 -177.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.655 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.424 ' HA ' ' OE1' ' B' ' 472' ' ' GLN . 37.4 mmt180 . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 121.321 0.581 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.45 HG11 ' HB ' ' A' ' 147' ' ' VAL . 85.2 t -106.7 137.29 38.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.712 -174.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.3 m -71.41 145.78 49.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.17 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.523 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.3 OUTLIER -58.8 -31.95 68.9 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.403 -176.469 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -56.61 -39.08 72.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.755 0.312 . . . . 0.0 110.703 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -70.45 -40.66 73.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.152 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.415 HD12 HD22 ' A' ' 89' ' ' LEU . 62.0 mt -68.41 -31.36 70.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.254 -178.184 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 62.2 mtpt -60.81 -28.37 68.73 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 178.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -72.32 -16.61 61.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.724 -0.217 . . . . 0.0 111.548 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.491 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 97.0 mt -55.74 -56.48 19.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.535 -176.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -66.01 -21.98 70.17 Favored Glycine 0 CA--C 1.52 0.379 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.691 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -79.62 -20.52 46.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.058 0.456 . . . . 0.0 110.818 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.9 m -78.8 123.18 26.94 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.364 -177.457 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.61 -27.85 69.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.929 -173.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.1 m -75.12 -39.66 60.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.039 0.447 . . . . 0.0 110.868 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.552 HD12 HD11 ' A' ' 104' ' ' LEU . 29.4 tp -73.0 -49.09 30.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.521 -172.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.701 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 9.0 ptp180 -57.18 -33.52 67.55 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.919 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 73.6 m -63.08 -42.06 99.56 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.552 HD11 HD12 ' A' ' 101' ' ' LEU . 0.6 OUTLIER -87.94 -19.13 27.69 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.923 -0.711 . . . . 0.0 111.653 -179.192 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 101' ' ' LEU . 7.5 mp -64.82 -20.99 66.7 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.278 0.561 . . . . 0.0 110.622 170.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 97.7 mt -71.16 -12.71 61.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.965 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -78.61 118.49 72.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.868 175.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.94 -34.68 92.65 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.421 2.747 . . . . 0.0 112.86 -177.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.554 ' CD2' HD22 ' A' ' 135' ' ' LEU . 60.9 t60 -66.26 -48.76 69.43 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.694 0.283 . . . . 0.0 110.838 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 104' ' ' LEU . 48.7 tp -63.07 -41.79 99.51 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.101 -176.16 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -66.32 -34.57 78.28 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.193 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 65.8 mm-40 -67.67 -28.56 67.8 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 120.597 0.237 . . . . 0.0 111.086 176.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.93 -53.41 18.01 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.562 ' HG3' HG22 ' B' ' 474' ' ' VAL . 33.6 ttp -56.47 -42.91 79.0 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.021 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.411 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 20.5 t -62.94 -45.91 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 120.699 0.285 . . . . 0.0 111.22 177.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -62.99 -40.95 99.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.02 0.438 . . . . 0.0 111.243 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.416 HD23 HG21 ' B' ' 474' ' ' VAL . 46.1 tp -62.63 -37.21 85.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.6 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.401 ' HB2' HD12 ' B' ' 478' ' ' ILE . 6.9 t70 -62.99 -34.63 77.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.412 -178.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 60.7 mt-30 -58.91 -27.0 64.84 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.826 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLY . . . . . 0.573 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 65.78 16.93 64.38 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.33 -0.85 . . . . 0.0 113.856 170.287 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -72.68 -42.96 63.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.311 0.576 . . . . 0.0 109.584 -175.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.42 ' OD1' ' HG2' ' A' ' 125' ' ' LYS . 4.2 t70 -150.04 51.43 0.91 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 173.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.573 ' HG3' ' HA2' ' A' ' 120' ' ' GLY . 0.0 OUTLIER -56.55 -20.71 22.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.66 -1.155 . . . . 0.0 110.582 175.242 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.477 ' N ' ' HD2' ' A' ' 123' ' ' LYS . . . -57.01 -53.81 53.86 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.271 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.42 ' HG2' ' OD1' ' A' ' 122' ' ' ASP . 65.0 pttt -79.61 -28.42 41.0 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.554 178.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.469 HD22 ' CE1' ' A' ' 130' ' ' TYR . 95.8 mt -63.51 -40.37 96.88 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.589 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.473 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.4 OUTLIER -52.92 -34.28 54.44 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.915 0.388 . . . . 0.0 110.857 177.185 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -79.73 -48.79 13.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.786 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.595 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.35 -20.12 64.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.206 -175.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.528 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.3 m-30 -85.04 -36.44 21.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.106 0.479 . . . . 0.0 110.848 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.67 5.94 14.19 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.144 -176.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.595 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.1 pt20 -100.3 -24.09 14.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.905 0.383 . . . . 0.0 110.14 178.447 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.57 136.15 19.4 Favored Pre-proline 0 N--CA 1.452 -0.356 0 CA-C-O 121.149 0.499 . . . . 0.0 110.881 178.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.759 ' HA ' HG22 ' A' ' 137' ' ' VAL . 34.1 Cg_endo -64.04 -14.33 42.82 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 123.532 2.821 . . . . 0.0 114.0 -170.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.554 HD22 ' CD2' ' A' ' 109' ' ' HIS . 4.3 mp -69.54 -39.31 77.54 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.942 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.528 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 60.8 t80 -92.2 -30.82 15.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.086 0.47 . . . . 0.0 110.093 -173.744 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.759 HG22 ' HA ' ' A' ' 134' ' ' PRO . 35.9 m -59.0 -50.9 78.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.262 -178.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.547 ' N ' HG23 ' A' ' 137' ' ' VAL . 11.7 pt-20 -72.24 -28.56 63.22 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.876 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -59.53 -49.0 79.47 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 172.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.813 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.57 -45.58 92.25 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.562 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.69 -32.66 73.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.518 -177.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 69.0 m -70.76 -51.38 27.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.995 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.0 p -65.26 -27.42 68.64 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.966 -175.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.813 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.3 mt -60.36 -54.47 45.24 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 120.745 0.307 . . . . 0.0 110.23 177.146 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.76 -14.29 57.91 Favored Glycine 0 CA--C 1.516 0.127 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.833 -176.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.419 HD12 ' HA ' ' A' ' 143' ' ' CYS . 64.5 mt -90.67 -30.48 4.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 120.808 0.337 . . . . 0.0 111.142 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.45 ' HB ' HG11 ' A' ' 87' ' ' VAL . 15.2 m -103.38 -18.35 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.546 -176.141 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 . . . . . 0 C--N 1.325 -0.484 0 CA-C-O 120.82 0.343 . . . . 0.0 110.307 177.411 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 42.7 mt . . . . . 0 C--O 1.231 0.115 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -65.13 -36.98 85.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.311 0.577 . . . . 0.0 109.823 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -68.24 -55.72 11.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.019 173.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.539 ' O ' ' HB ' ' B' ' 469' ' ' VAL . 40.1 mt-10 -56.5 -51.44 68.49 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.503 -0.772 . . . . 0.0 112.493 -172.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 467' ' ' ARG . . . . . 0.473 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 96.7 mtt180 -67.59 -25.73 65.92 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -174.198 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -29.99 37.78 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 177.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 469' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' B' ' 466' ' ' GLU . 8.5 t -60.93 -38.53 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.921 174.146 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.524 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 10.6 mm -63.21 -38.5 82.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.304 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 471' ' ' LEU . . . . . 0.497 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 80.3 mt -58.65 -46.06 87.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.119 177.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.508 HE21 ' HA ' ' B' ' 469' ' ' VAL . 10.3 mt-30 -62.88 -33.2 74.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.581 177.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 63.0 m -69.66 -54.97 11.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.234 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.562 HG22 ' HG3' ' A' ' 114' ' ' MET . 54.6 t -47.08 -50.02 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.19 175.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' B' ' 471' ' ' LEU . 35.8 mmt180 -63.61 -34.45 77.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.895 0.378 . . . . 0.0 111.171 -175.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -75.35 -49.34 19.39 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.569 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.444 HD13 HD21 ' A' ' 105' ' ' LEU . 95.5 mt -60.58 -58.37 7.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.572 -176.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 478' ' ' ILE . . . . . 0.401 HD12 ' HB2' ' A' ' 118' ' ' ASP . 50.2 mt -56.53 -23.6 17.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.585 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -64.41 -48.65 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -178.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.708 0 CA-C-O 120.895 0.379 . . . . 0.0 111.256 -175.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.561 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 36.4 ptt180 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 91.4 t -100.28 139.08 22.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.895 0.378 . . . . 0.0 110.651 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.1 m -65.42 138.96 58.47 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.341 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.75 -33.17 72.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.219 -176.608 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -63.17 -40.42 97.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.746 177.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.64 -41.82 98.21 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 93.3 mt -67.38 -32.21 72.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.839 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 94.3 mttt -61.35 -20.68 63.26 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -77.25 -17.9 58.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.589 0.233 . . . . 0.0 111.131 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 88.2 mt -62.63 -49.57 74.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.273 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -70.61 -14.86 72.81 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.418 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -91.02 -22.59 20.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.882 0.372 . . . . 0.0 110.961 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.657 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 33.0 t -68.49 116.64 9.27 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.386 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.69 -29.63 70.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.045 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.402 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 57.5 m -77.44 -37.46 51.53 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.813 -177.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.503 HD11 ' CD2' ' A' ' 139' ' ' PHE . 48.5 tp -75.28 -47.09 29.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.312 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -60.03 -31.43 69.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.906 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 21.3 t -66.26 -22.92 66.33 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.202 0.525 . . . . 0.0 110.228 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 100' ' ' THR . 28.0 mt -80.52 -32.55 36.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.687 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.7 mp -69.6 -10.52 58.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.96 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.52 -11.52 53.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.843 174.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -86.0 114.61 58.02 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 173.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.41 ' O ' ' HG2' ' A' ' 111' ' ' ARG . 50.4 Cg_exo -54.72 -30.04 64.85 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.947 2.431 . . . . 0.0 112.608 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -68.26 -45.08 74.15 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.901 178.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 55.3 tp -66.33 -38.61 88.06 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.75 0.31 . . . . 0.0 111.188 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 108' ' ' PRO . 5.5 ptp180 -67.35 -30.99 70.95 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.656 -0.418 . . . . 0.0 109.959 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -73.9 -32.52 63.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.819 177.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.42 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 72.3 mt -59.02 -50.73 72.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.36 176.344 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 60.0 mtm -56.77 -49.83 74.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.559 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.662 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 60.1 t -59.59 -46.53 93.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.153 -178.6 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -60.29 -48.26 82.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.024 0.44 . . . . 0.0 111.476 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 61.9 tp -62.98 -36.63 84.15 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.663 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.437 ' OD1' ' HD2' ' B' ' 475' ' ' ARG . 19.3 t70 -66.11 -33.53 76.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.865 -177.131 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 60.5 mt-30 -60.27 -28.72 68.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.289 0.566 . . . . 0.0 110.628 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.39 29.37 71.78 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.089 -0.959 . . . . 0.0 114.211 169.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -76.28 -55.1 5.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 117.231 0.515 . . . . 0.0 110.026 176.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -131.25 41.12 3.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.357 0.599 . . . . 0.0 110.146 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.658 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.78 -31.62 5.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.607 -1.179 . . . . 0.0 112.109 177.756 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -54.19 -58.16 8.4 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -177.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -80.02 -26.42 39.82 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.01 -178.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.471 HD22 ' CE2' ' A' ' 130' ' ' TYR . 94.9 mt -62.53 -41.54 98.94 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.5 177.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.436 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -51.75 -39.15 58.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 0.0 111.12 178.208 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 54.2 mtp180 -81.6 -43.23 18.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.769 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.64 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.86 -26.95 68.84 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.52 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.471 ' CE2' HD22 ' A' ' 126' ' ' LEU . 3.4 m-30 -80.54 -19.45 45.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.791 0.329 . . . . 0.0 111.078 -178.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 2.5 mmt -77.57 -4.92 48.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.348 -177.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.64 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.5 pt20 -100.99 -8.54 22.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.978 0.418 . . . . 0.0 110.472 178.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.54 ' O ' HG23 ' A' ' 137' ' ' VAL . 0.6 OUTLIER -94.35 118.48 67.04 Favored Pre-proline 0 N--CA 1.45 -0.472 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.74 -175.025 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.613 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 16.0 Cg_endo -56.39 -24.53 52.57 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.92 2.413 . . . . 0.0 112.168 -175.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.474 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.0 mp -71.04 -43.01 68.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.211 0.529 . . . . 0.0 109.993 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.487 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 29.7 t80 -81.97 -31.33 31.24 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.105 -176.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 133' ' ' GLU . 86.9 t -61.98 -43.53 97.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.481 177.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 48.0 mt-10 -65.97 -42.71 89.56 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.08 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' PHE . . . . . 0.503 ' CD2' HD11 ' A' ' 101' ' ' LEU . 75.5 t80 -57.21 -48.91 77.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.158 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.787 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.79 -48.17 77.99 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.562 -177.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -66.75 -26.8 67.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.192 0.52 . . . . 0.0 110.416 -174.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 94.0 m -79.72 -48.44 13.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.106 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.9 p -64.31 -29.03 70.13 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.55 0.214 . . . . 0.0 111.02 -175.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.787 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 73.8 mt -59.61 -52.83 63.84 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.508 178.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.45 -15.23 63.45 Favored Glycine 0 C--N 1.329 0.188 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.533 -176.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 64.4 mt -88.4 -26.08 5.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 120.766 0.317 . . . . 0.0 111.082 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 13.6 m -103.67 -14.1 8.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.501 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 44.8 mt-10 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.435 176.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 54.9 mt . . . . . 0 CA--C 1.528 0.126 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -58.72 -42.41 88.66 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 110.218 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -70.25 -50.36 40.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.809 177.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.571 ' O ' HG12 ' B' ' 470' ' ' ILE . 37.5 mt-10 -61.25 -48.28 82.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.286 -172.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 467' ' ' ARG . . . . . 0.436 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 37.2 mtm180 -58.32 -36.43 73.38 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.73 -27.31 55.36 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -179.062 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 469' ' ' VAL . . . . . 0.499 ' HA ' ' CG ' ' B' ' 472' ' ' GLN . 2.4 t -72.56 -29.54 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 114.717 -1.129 . . . . 0.0 110.513 177.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.571 HG12 ' O ' ' B' ' 466' ' ' GLU . 17.2 mm -68.62 -34.5 65.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 174.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 91.0 mt -60.48 -41.89 95.17 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.362 176.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.561 ' NE2' ' HA ' ' A' ' 86' ' ' ARG . 4.6 mm-40 -52.2 -48.38 65.1 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.61 0.719 . . . . 0.0 110.061 175.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 473' ' ' CYS . . . . . 0.429 ' O ' HG13 ' B' ' 477' ' ' ILE . 38.1 m -61.51 -54.06 48.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.684 -179.546 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 89.8 t -50.89 -49.87 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.684 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 24.1 mmm180 -67.1 -28.21 67.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.521 -176.257 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -76.33 -50.32 14.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.672 0.273 . . . . 0.0 110.672 178.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.429 HG13 ' O ' ' B' ' 473' ' ' CYS . 70.4 mt -63.11 -62.73 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.125 -173.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 46.3 mt -54.83 -24.7 14.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 21.8 tptm -70.98 -39.43 72.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -175.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.733 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.82 -178.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 . . . . . 0 CA--C 1.521 -0.143 0 CA-C-O 121.084 0.469 . . . . 0.0 110.766 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.471 HG21 ' HB ' ' A' ' 147' ' ' VAL . 14.9 p -72.77 148.02 9.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.327 -0.852 . . . . 0.0 111.181 -174.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.4 m -68.41 144.84 54.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.281 -177.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -26.51 68.35 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.793 -175.145 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 24.2 pt20 -60.82 -35.3 76.18 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.135 0.493 . . . . 0.0 110.313 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -70.7 -37.57 73.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.144 177.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' B' ' 472' ' ' GLN . 61.0 mt -68.07 -37.58 81.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.149 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -61.7 -20.16 63.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.889 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -75.89 -17.75 59.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.965 0.412 . . . . 0.0 110.553 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.49 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 87.8 mt -65.94 -45.0 83.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.982 -178.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -68.9 -13.83 67.01 Favored Glycine 0 CA--C 1.52 0.344 0 CA-C-N 116.073 -0.512 . . . . 0.0 113.496 -176.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -107.31 5.9 27.96 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.122 0.487 . . . . 0.0 110.934 179.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 67.9 m -93.4 112.53 24.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.844 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.91 -26.24 68.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.543 -178.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 27.4 m -70.45 -42.24 71.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.532 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.49 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 24.0 tp -73.63 -44.83 55.96 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.889 -173.003 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.505 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 7.8 ptp180 -60.77 -28.32 68.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.233 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.5 t -61.66 -27.29 68.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.371 0.605 . . . . 0.0 109.861 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.448 ' O ' HD13 ' A' ' 110' ' ' LEU . 21.0 mt -83.98 -32.54 24.94 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.132 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.5 mp -75.76 2.67 11.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.14 0.495 . . . . 0.0 110.648 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 73.9 mt -79.39 -9.2 59.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.088 174.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -90.4 117.45 68.02 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.824 176.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.53 -39.55 87.72 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.159 2.573 . . . . 0.0 113.033 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -68.8 -41.96 77.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.81 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.451 ' O ' HD23 ' A' ' 110' ' ' LEU . 4.4 tt -60.15 -40.05 88.53 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -179.197 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.524 ' O ' HG23 ' A' ' 115' ' ' VAL . 59.7 mtm-85 -66.03 -40.53 91.1 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.419 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -63.88 -36.57 84.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.997 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.444 HD13 ' HB2' ' A' ' 136' ' ' PHE . 90.6 mt -58.62 -47.18 85.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.276 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.474 ' HB3' HD11 ' B' ' 478' ' ' ILE . 74.4 mtp -58.66 -47.45 84.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.978 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 111' ' ' ARG . 98.6 t -58.15 -42.49 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 CA-C-O 120.963 0.411 . . . . 0.0 111.188 178.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.413 ' HB2' ' OH ' ' A' ' 130' ' ' TYR . 92.3 m-20 -66.81 -44.55 80.91 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.134 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.566 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 50.7 tp -72.66 -31.09 64.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.415 -177.078 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.427 ' HB2' HG13 ' B' ' 478' ' ' ILE . 32.8 t70 -54.91 -44.05 73.84 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.027 0.441 . . . . 0.0 110.662 176.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 53.3 mt-30 -67.18 -30.7 70.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.008 -176.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.01 21.92 68.27 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.046 -0.979 . . . . 0.0 113.324 173.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -54.1 -50.09 67.63 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.834 0.35 . . . . 0.0 110.873 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.421 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 23.5 t0 -135.16 66.62 1.52 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.667 0.746 . . . . 0.0 109.367 172.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.648 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -52.74 -30.11 30.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.684 -1.143 . . . . 0.0 111.363 175.929 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.68 -40.3 96.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.807 0.337 . . . . 0.0 111.18 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -78.87 -47.92 15.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.739 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 82.3 mt -56.77 -47.1 80.87 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.635 -175.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.5 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.5 OUTLIER -56.03 -35.47 66.9 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -177.754 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -83.87 -44.16 14.58 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.114 0.483 . . . . 0.0 110.538 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.543 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.03 -21.17 65.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.025 -176.067 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.566 ' CE2' ' HB2' ' A' ' 117' ' ' LEU . 3.6 m-30 -81.66 -29.15 33.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.875 0.369 . . . . 0.0 111.006 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' MET . . . . . 0.591 ' HE2' HG12 ' A' ' 137' ' ' VAL . 2.7 mmt -77.57 -4.33 45.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.349 -176.069 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.543 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.9 pt20 -100.89 0.2 38.02 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 176.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -105.89 118.42 55.24 Favored Pre-proline 0 N--CA 1.449 -0.516 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.366 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.706 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 19.2 Cg_endo -60.99 -13.24 26.34 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.985 2.456 . . . . 0.0 112.108 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.77 -48.2 48.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.769 173.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.549 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 37.0 t80 -88.62 -29.86 19.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.829 0.347 . . . . 0.0 110.731 -169.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.706 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.9 m -56.52 -45.75 82.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.985 176.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.468 ' N ' HG23 ' A' ' 137' ' ' VAL . 34.5 mm-40 -58.32 -49.31 77.62 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.352 176.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' PHE . . . . . 0.421 ' HB2' HD11 ' A' ' 110' ' ' LEU . 76.4 t80 -54.14 -49.43 69.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.961 177.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.754 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.61 -52.73 59.6 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.28 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -62.45 -29.5 70.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.293 0.568 . . . . 0.0 110.44 -174.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 97.6 m -81.11 -46.76 14.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.605 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.418 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 29.5 p -65.28 -31.86 73.23 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.4 -177.405 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.754 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 65.7 mt -59.11 -41.03 87.19 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.693 178.549 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' GLY . . . . . 0.411 ' HA2' ' OE2' ' A' ' 148' ' ' GLU . . . -69.41 -28.23 72.71 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.123 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 62.3 mt -80.16 -36.22 16.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-O 121.053 0.454 . . . . 0.0 110.485 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.471 ' HB ' HG21 ' A' ' 87' ' ' VAL . 19.0 m -93.61 7.44 5.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.02 -176.616 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.635 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 37.1 mt-10 . . . . . 0 C--O 1.233 0.229 0 CA-C-O 120.534 0.207 . . . . 0.0 110.461 174.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 60.5 mt . . . . . 0 CA--C 1.53 0.199 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 70.1 mtm180 -61.33 -46.82 88.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.605 0.717 . . . . 0.0 109.274 177.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -64.72 -48.12 75.8 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.382 177.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.595 ' O ' HG12 ' B' ' 470' ' ' ILE . 40.4 mt-10 -59.36 -47.8 84.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.595 -177.232 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 467' ' ' ARG . . . . . 0.5 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 19.8 mtm180 -63.22 -40.76 98.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.376 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.73 -25.49 53.57 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -178.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.13 -37.46 79.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.154 171.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.595 HG12 ' O ' ' B' ' 466' ' ' GLU . 36.2 mm -60.01 -36.87 69.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.125 177.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 471' ' ' LEU . . . . . 0.533 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 93.1 mt -53.24 -49.93 65.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.387 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.482 ' HB3' HD11 ' A' ' 92' ' ' LEU . 2.5 mp0 -63.69 -40.61 97.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.922 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 61.6 m -59.04 -50.89 72.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.025 0.44 . . . . 0.0 110.035 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.643 ' O ' HG12 ' B' ' 478' ' ' ILE . 85.3 t -56.05 -58.45 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.541 175.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.533 ' HG2' ' O ' ' B' ' 471' ' ' LEU . 7.2 ptp180 -71.87 -20.2 61.84 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -169.305 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.53 -43.84 92.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 171.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 88.5 mt -70.14 -53.71 22.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.139 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 478' ' ' ILE . . . . . 0.643 HG12 ' O ' ' B' ' 474' ' ' VAL . 10.1 mm -53.3 -31.88 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.664 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 11.7 tppt? -53.23 -38.06 62.62 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.134 -174.182 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.367 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.485 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 39.8 ptt180 . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 120.872 0.368 . . . . 0.0 110.718 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.421 ' CG2' HG22 ' B' ' 469' ' ' VAL . 88.7 t -109.28 138.02 38.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.5 m -63.57 140.14 58.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.268 0.556 . . . . 0.0 110.887 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.524 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 10.2 tp -58.54 -40.04 81.89 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.05 -177.247 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -56.71 -37.44 70.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.722 178.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -67.53 -41.73 83.88 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.23 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.473 ' HA ' HD13 ' A' ' 95' ' ' LEU . 83.7 mt -69.69 -32.41 71.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.647 -176.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 9.2 mtpm? -62.82 -26.17 68.62 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -69.47 -21.5 63.7 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.734 0.302 . . . . 0.0 111.14 -177.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 92' ' ' LEU . 8.6 mp -64.54 -41.07 96.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.32 -174.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.69 -20.84 68.61 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.439 177.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -89.61 -22.9 22.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.72 0.295 . . . . 0.0 110.911 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.688 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 37.4 t -67.4 111.1 3.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.545 -177.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.31 -26.81 68.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.679 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.3 m -71.87 -48.04 48.63 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.049 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.3 tp -70.7 -46.72 62.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.793 -173.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.688 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -58.56 -29.83 66.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.876 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 33.7 t -67.16 -24.33 65.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.07 0.462 . . . . 0.0 110.049 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.5 mt -84.02 -36.11 23.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.678 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.479 HD21 HD13 ' B' ' 477' ' ' ILE . 11.2 mp -63.86 -22.53 66.96 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.433 177.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 76.7 mt -63.59 -16.86 62.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.971 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -79.47 120.26 79.73 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -62.41 -22.73 74.46 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 123.19 2.593 . . . . 0.0 113.013 -174.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.519 ' NE2' HD11 ' A' ' 113' ' ' LEU . 70.9 t60 -76.32 -48.9 18.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.009 178.099 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 135' ' ' LEU . 47.5 tp -61.91 -37.18 83.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.911 0.386 . . . . 0.0 111.148 -175.354 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -67.83 -22.16 65.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.56 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 64.9 mm-40 -74.98 -43.15 55.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.739 176.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.541 HD21 ' OE1' ' A' ' 133' ' ' GLU . 10.5 mp -52.19 -43.88 64.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.621 0.248 . . . . 0.0 111.352 176.03 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.468 ' HG2' HG22 ' B' ' 474' ' ' VAL . 55.8 mtm -59.91 -53.7 54.76 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.302 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.571 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 26.4 m -68.72 -23.98 28.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 111.518 -177.024 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -75.84 -51.71 11.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.169 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.482 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 60.7 tp -61.05 -34.5 74.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.454 -177.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.429 ' OD2' ' HG2' ' B' ' 475' ' ' ARG . 24.5 t70 -62.66 -35.55 79.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.415 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.571 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 69.0 mt-30 -63.27 -29.6 70.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.498 0.666 . . . . 0.0 111.169 -177.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.92 25.42 71.96 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 114.54 -1.209 . . . . 0.0 114.034 174.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -67.01 -46.47 74.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.295 0.548 . . . . 0.0 110.053 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.533 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 17.8 m-20 -141.63 46.4 1.69 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.697 176.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.68 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -48.32 -32.11 6.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.999 178.371 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.23 -49.89 75.82 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.468 0.175 . . . . 0.0 111.382 -177.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.473 ' HG2' ' HB3' ' A' ' 122' ' ' ASP . 58.6 pttt -75.76 -30.63 59.23 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.143 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 91.9 mt -63.58 -43.67 96.29 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.427 -179.148 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.6 mmt -50.61 -36.83 36.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.929 0.395 . . . . 0.0 111.169 177.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 30.0 mmm180 -81.74 -47.23 13.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.043 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.582 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.86 -24.34 66.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.972 -176.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.482 ' CE1' ' HB2' ' A' ' 117' ' ' LEU . 3.4 m-30 -78.86 -29.7 44.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.807 0.337 . . . . 0.0 111.098 -178.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 4.7 mmt -73.51 -10.33 59.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.358 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.3 pt20 -98.99 -15.3 19.13 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.104 -179.116 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.541 ' OE1' HD21 ' A' ' 113' ' ' LEU . 3.7 mt-10 -87.54 119.01 70.55 Favored Pre-proline 0 N--CA 1.451 -0.406 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.223 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.611 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 14.1 Cg_endo -56.25 -23.26 44.71 Favored 'Trans proline' 0 CA--C 1.52 -0.185 0 C-N-CA 123.066 2.511 . . . . 0.0 112.453 -173.105 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.435 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.5 mp -72.56 -42.09 65.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.324 -178.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.49 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 31.0 t80 -76.64 -29.97 56.67 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.189 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 133' ' ' GLU . 57.5 t -61.24 -44.7 98.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.048 176.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.611 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 42.0 mt-10 -67.63 -41.34 84.06 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.323 178.085 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -57.11 -50.93 71.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.11 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.714 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.71 -45.1 87.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.032 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -63.48 -29.77 71.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.381 0.61 . . . . 0.0 110.588 -174.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' CYS . . . . . 0.445 ' O ' HG13 ' A' ' 146' ' ' ILE . 89.1 m -82.79 -47.86 11.45 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.359 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 29.1 p -62.92 -32.33 73.6 Favored 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 121.177 -0.209 . . . . 0.0 111.383 -174.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 79.3 mt -65.68 -26.87 67.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.809 0.338 . . . . 0.0 111.092 -178.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -85.87 -14.84 66.53 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.013 177.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 142' ' ' CYS . 32.5 mt -91.63 -42.96 13.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.867 0.365 . . . . 0.0 110.892 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.428 ' CG1' HD11 ' A' ' 95' ' ' LEU . 20.4 m -90.61 7.76 4.1 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.884 -174.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 . . . . . 0 C--N 1.326 -0.417 0 CA-C-O 121.128 0.49 . . . . 0.0 110.53 179.712 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 47.9 mt . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 464' ' ' ARG . . . . . 0.475 ' HD3' ' N ' ' B' ' 465' ' ' HIS . 0.0 OUTLIER -75.19 -28.94 60.2 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.57 -176.21 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 465' ' ' HIS . . . . . 0.485 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 13.4 t60 -76.24 -45.33 33.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.132 173.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -63.17 -30.48 71.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 467' ' ' ARG . . . . . 0.444 ' O ' HD23 ' B' ' 471' ' ' LEU . 32.8 mtp180 -63.31 -55.07 27.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.613 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 468' ' ' ASN . . . . . 0.485 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -70.93 -18.57 62.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.829 0.823 . . . . 0.0 109.997 -174.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 469' ' ' VAL . . . . . 0.421 HG22 ' CG2' ' A' ' 87' ' ' VAL . 1.3 t -73.08 -20.2 18.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.52 178.169 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.49 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 35.8 mm -72.84 -37.35 54.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 122.188 0.994 . . . . 0.0 108.4 -178.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 471' ' ' LEU . . . . . 0.612 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.5 OUTLIER -51.28 -48.86 62.11 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 113.166 -1.834 . . . . 0.0 110.546 177.152 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.485 ' NE2' ' HA ' ' A' ' 86' ' ' ARG . 3.6 mm-40 -46.74 -54.23 10.16 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.798 -1.092 . . . . 0.0 110.498 174.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 33.0 m -60.79 -54.11 49.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.668 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.468 HG22 ' HG2' ' A' ' 114' ' ' MET . 75.7 t -48.61 -54.79 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.905 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.6 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 52.2 mtt180 -74.31 -19.8 60.35 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.883 -0.598 . . . . 0.0 112.402 -171.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -74.54 -45.7 43.91 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 172.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.479 HD13 HD21 ' A' ' 105' ' ' LEU . 92.2 mt -64.46 -55.11 23.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.772 -177.198 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 478' ' ' ILE . . . . . 0.42 HG13 ' O ' ' B' ' 474' ' ' VAL . 52.4 mt -54.06 -26.18 14.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.059 0.457 . . . . 0.0 111.084 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.6 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 1.6 tppp? -73.04 -42.11 63.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.926 -172.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.694 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.876 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 121.222 0.534 . . . . 0.0 110.486 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 39.7 t -81.84 131.67 33.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.614 -172.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.3 m -63.98 144.82 56.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.468 176.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.533 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.85 -34.22 74.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.705 -173.892 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -61.24 -40.93 95.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.711 -0.222 . . . . 0.0 110.742 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -63.34 -39.42 94.49 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.576 ' HA ' HD13 ' A' ' 95' ' ' LEU . 88.2 mt -69.06 -32.42 71.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.64 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 97.4 mttt -58.04 -27.32 63.48 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -178.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.444 ' HB2' HG22 ' A' ' 146' ' ' ILE . 24.0 m-80 -72.64 -18.63 61.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.797 0.332 . . . . 0.0 111.277 -178.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.576 HD13 ' HA ' ' A' ' 92' ' ' LEU . 7.4 mp -71.02 -40.58 71.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.113 -175.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -63.05 -21.07 63.33 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.693 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -108.71 6.51 25.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.064 0.459 . . . . 0.0 110.739 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.625 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.9 t -76.96 108.54 10.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.24 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.14 67.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.131 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.1 m -71.7 -43.87 65.18 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.185 0.517 . . . . 0.0 110.78 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.542 HD12 HD11 ' A' ' 104' ' ' LEU . 21.4 tp -71.09 -49.56 43.15 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.446 -171.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.625 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.0 ptp180 -57.72 -32.07 67.05 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.327 -179.251 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 67.5 m -62.95 -40.23 97.02 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.542 HD11 HD12 ' A' ' 101' ' ' LEU . 0.5 OUTLIER -88.56 -15.75 34.35 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.508 -0.877 . . . . 0.0 112.161 -178.965 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.47 HD13 ' O ' ' A' ' 101' ' ' LEU . 8.7 mp -68.74 -12.06 61.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.194 0.521 . . . . 0.0 110.591 171.11 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 80.1 mt -73.14 -13.42 61.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.021 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -74.03 123.7 89.47 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.865 176.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.5 -30.34 90.52 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.111 2.54 . . . . 0.0 112.763 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -78.77 -41.29 30.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.657 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 104' ' ' LEU . 5.0 tt -63.18 -42.48 99.39 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.239 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -68.06 -27.19 66.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.151 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -70.84 -43.07 69.3 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.187 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.494 HD13 ' HB2' ' A' ' 136' ' ' PHE . 85.8 mt -56.11 -51.77 66.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.315 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 59.7 mtp -54.28 -54.15 44.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.829 -179.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.648 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.8 m -65.89 -34.45 70.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.343 -176.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -62.86 -46.36 88.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.086 0.47 . . . . 0.0 110.61 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.45 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 62.7 tp -64.47 -36.39 84.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.621 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.41 -36.74 84.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.802 177.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.648 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 75.7 mt-30 -68.2 -32.15 72.17 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.868 0.842 . . . . 0.0 110.508 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 66.11 27.08 72.63 Favored Glycine 0 N--CA 1.447 -0.567 0 CA-C-N 114.145 -1.389 . . . . 0.0 113.18 175.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.67 -32.38 59.18 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.176 0.512 . . . . 0.0 110.806 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.499 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 15.4 t0 -160.52 69.23 0.37 Allowed 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 168.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.512 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -55.31 -26.77 42.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.007 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.75 -49.39 73.22 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.057 0.456 . . . . 0.0 110.596 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.0 -38.03 66.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.557 178.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 95.4 mt -61.65 -46.67 88.79 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.162 -177.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -54.88 -33.86 62.4 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.006 0.431 . . . . 0.0 111.187 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -79.34 -49.08 12.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.449 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.679 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.45 -27.03 67.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.057 -176.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.592 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.2 m-30 -79.26 -27.54 42.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.877 0.37 . . . . 0.0 111.436 -176.817 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' MET . . . . . 0.513 ' HE2' HG12 ' A' ' 137' ' ' VAL . 3.3 mmt -86.13 3.42 42.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.821 0.344 . . . . 0.0 111.574 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.679 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.8 pt20 -100.56 -19.61 16.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.039 0.447 . . . . 0.0 109.965 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -105.36 137.45 19.27 Favored Pre-proline 0 N--CA 1.448 -0.548 0 CA-C-O 121.393 0.616 . . . . 0.0 111.688 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.674 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 56.4 Cg_endo -68.45 -11.87 33.19 Favored 'Trans proline' 0 CA--C 1.527 0.144 0 C-N-CA 123.904 3.069 . . . . 0.0 113.974 -173.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 45.5 mt -77.8 -37.62 48.33 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.427 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.592 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 45.5 t80 -88.98 -32.1 17.8 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.573 -173.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.674 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 10.5 m -54.87 -44.89 74.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.831 176.013 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 25.7 mm-40 -57.62 -50.29 73.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.433 176.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -54.94 -48.93 72.51 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.211 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.762 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.28 -49.55 71.37 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.052 -0.977 . . . . 0.0 111.019 -177.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.71 -31.11 72.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.218 0.532 . . . . 0.0 110.55 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' CYS . . . . . 0.547 ' O ' HG13 ' A' ' 146' ' ' ILE . 65.4 m -70.61 -47.72 58.72 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.018 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 28.3 p -67.5 -30.98 70.8 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.526 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.762 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.8 mt -65.71 -27.95 68.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.708 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -83.24 -14.67 73.78 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.226 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 142' ' ' CYS . 21.1 mt -91.8 -40.83 12.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.199 0.523 . . . . 0.0 110.505 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 15.3 m -94.75 7.5 6.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.398 -177.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 . . . . . 0 C--O 1.234 0.252 0 CA-C-O 121.369 0.604 . . . . 0.0 112.112 -173.586 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 29.4 mm . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.802 0.334 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -57.76 -35.46 70.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.915 0.388 . . . . 0.0 110.769 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 -69.95 -48.9 56.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.962 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.456 ' O ' HG12 ' B' ' 470' ' ' ILE . 6.5 mm-40 -55.91 -50.42 70.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.93 -178.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -59.92 -40.86 90.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.396 -176.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -79.0 -23.46 44.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.382 0.61 . . . . 0.0 109.666 -178.416 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -65.32 -32.15 56.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.422 173.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.456 HG12 ' O ' ' B' ' 466' ' ' GLU . 26.3 mm -61.94 -29.87 47.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.391 179.054 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 83.7 mt -63.53 -31.86 73.15 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.881 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -71.7 -35.22 70.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.059 0.457 . . . . 0.0 110.092 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 45.4 m -72.7 -59.08 2.89 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.077 -177.022 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.41 ' O ' HG13 ' B' ' 478' ' ' ILE . 11.5 p -54.95 -45.34 76.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.085 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 18.8 tpp85 -65.68 -35.17 80.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.634 0.254 . . . . 0.0 110.96 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.06 -47.88 78.42 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 120.687 0.28 . . . . 0.0 110.65 -179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 50.6 mt -67.55 -55.4 17.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.846 -174.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 478' ' ' ILE . . . . . 0.41 HG13 ' O ' ' B' ' 474' ' ' VAL . 46.3 mt -58.52 -25.55 28.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.156 -175.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.531 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 22.8 tptp -65.09 -34.6 78.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.219 -173.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 480' ' ' LYS . . . . . 0.46 ' HD2' ' H ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.547 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.884 176.372 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 . . . . . 0 N--CA 1.451 -0.375 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 24.5 t -80.55 134.72 26.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.099 -173.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.1 m -67.58 144.34 55.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.981 176.339 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.523 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 1.6 tt -62.32 -33.38 74.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.994 -173.22 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -56.01 -43.66 77.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.665 174.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -68.66 -28.09 66.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.412 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 90.7 mt -78.68 -35.26 45.43 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.622 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 50.1 mtpt -57.72 -29.49 64.77 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.157 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -73.22 -18.66 61.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.606 0.241 . . . . 0.0 111.082 -176.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.512 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 82.1 mt -62.67 -47.16 84.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.032 -175.535 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.93 -15.36 81.03 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.259 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 93' ' ' LYS . 17.4 mm-40 -95.5 -16.0 22.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.15 0.5 . . . . 0.0 110.397 -177.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.61 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 33.0 t -77.49 121.31 23.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.967 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.45 -27.62 67.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.629 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.6 m -69.24 -45.93 68.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.225 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.512 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 38.8 tp -71.11 -46.97 60.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.57 -173.589 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 98' ' ' SER . 8.9 ptp180 -60.29 -27.27 67.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.534 -178.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.6 m -62.99 -22.88 67.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.974 0.416 . . . . 0.0 110.662 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 110' ' ' LEU . 17.5 mt -86.57 -34.38 19.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.32 0.581 . . . . 0.0 109.717 178.267 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.485 HD21 HD13 ' B' ' 477' ' ' ILE . 9.3 mp -64.1 -18.37 64.34 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.612 178.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 63.7 mt -66.06 -21.02 66.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.293 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -78.39 118.1 70.24 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.265 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.4 -36.66 97.54 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.069 2.512 . . . . 0.0 112.589 178.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.3 t60 -68.29 -44.06 76.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.86 0.362 . . . . 0.0 110.558 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 104' ' ' LEU . 4.4 tt -65.59 -46.01 81.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.277 -176.395 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.419 ' O ' HG23 ' A' ' 115' ' ' VAL . 13.5 ptp180 -64.47 -34.18 77.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.491 -179.057 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -66.65 -34.97 79.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.947 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.3 mt -59.47 -48.59 81.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.129 0.49 . . . . 0.0 109.717 174.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 68.6 mtp -55.75 -52.09 65.14 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.973 176.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.494 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 84.0 t -60.25 -38.83 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.542 -179.137 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -64.56 -43.01 95.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.07 0.462 . . . . 0.0 111.071 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 56.4 tp -67.55 -38.41 84.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.57 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.435 ' HB2' HD12 ' B' ' 478' ' ' ILE . 23.8 t0 -63.97 -27.83 69.4 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.084 0.469 . . . . 0.0 111.375 -175.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 70.9 mt-30 -63.19 -29.77 71.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.516 0.674 . . . . 0.0 110.785 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.5 29.3 72.93 Favored Glycine 0 CA--C 1.518 0.226 0 CA-C-N 114.551 -1.204 . . . . 0.0 114.239 172.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -73.1 -55.45 6.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.568 0.699 . . . . 0.0 109.526 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -135.16 50.85 2.12 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.502 176.349 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.598 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -48.68 -37.57 18.89 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 113.505 -1.679 . . . . 0.0 111.961 179.003 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.16 -46.53 77.1 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.908 0.385 . . . . 0.0 110.866 -176.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -65.57 -41.91 92.39 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.183 177.289 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.475 HD22 ' CE2' ' A' ' 130' ' ' TYR . 95.5 mt -62.63 -43.67 98.22 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.572 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -34.67 65.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.933 0.397 . . . . 0.0 111.142 -178.456 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.9 mmm180 -77.01 -46.09 25.04 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.007 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.93 -38.65 86.56 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.421 -178.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.475 ' CE2' HD22 ' A' ' 126' ' ' LEU . 3.2 m-30 -72.31 -21.78 61.28 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.865 -174.834 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' MET . . . . . 0.448 ' HE2' HG12 ' A' ' 137' ' ' VAL . 3.6 mmt -79.43 -1.23 36.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.14 -179.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -98.79 -20.03 17.11 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 175.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -88.17 120.89 70.72 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.733 -175.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.678 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 27.9 Cg_endo -62.2 -14.11 36.13 Favored 'Trans proline' 0 N--CA 1.465 -0.157 0 C-N-CA 122.863 2.375 . . . . 0.0 112.671 -175.329 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.3 mp -77.32 -40.26 44.88 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.592 176.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.425 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 32.8 t80 -88.74 -31.01 18.63 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.066 -172.119 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.678 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 16.6 m -58.47 -49.11 83.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.246 177.177 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.53 ' N ' HG23 ' A' ' 137' ' ' VAL . 11.0 pt-20 -70.96 -36.64 72.64 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.558 179.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -56.29 -48.07 77.36 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 174.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.779 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.46 -49.78 74.07 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.726 178.027 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -62.09 -30.76 71.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.209 0.528 . . . . 0.0 110.627 -175.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 64.6 m -77.3 -45.29 26.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.537 -179.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.437 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.3 p -69.33 -28.11 65.96 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.861 0.362 . . . . 0.0 110.53 -177.445 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 83.3 mt -62.13 -31.3 71.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.69 178.163 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' GLY . . . . . 0.534 ' HA2' ' OE2' ' A' ' 148' ' ' GLU . . . -79.87 -17.69 74.36 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.452 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 49.0 mt -91.16 -26.24 5.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.109 0.48 . . . . 0.0 110.569 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.408 HG13 HD21 ' A' ' 95' ' ' LEU . 17.3 m -104.05 -3.43 9.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.599 -177.198 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.534 ' OE2' ' HA2' ' A' ' 145' ' ' GLY . 12.7 pt-20 . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.255 0.55 . . . . 0.0 110.393 -178.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 47.3 mm . . . . . 0 CA--C 1.528 0.118 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -58.56 -43.36 89.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.886 0.375 . . . . 0.0 110.772 178.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -64.12 -48.83 74.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.067 175.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.58 ' O ' HG12 ' B' ' 470' ' ' ILE . 43.4 mt-10 -60.14 -43.83 95.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.45 -176.751 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -58.78 -39.97 82.62 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -30.89 60.23 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.5 t -62.46 -35.51 70.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.584 176.172 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.58 HG12 ' O ' ' B' ' 466' ' ' GLU . 31.6 mm -63.41 -34.85 69.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.493 178.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 82.8 mt -57.44 -42.5 82.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.691 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -62.78 -43.11 99.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.441 177.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 56.1 m -63.65 -55.5 23.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.752 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.455 ' O ' HG13 ' B' ' 478' ' ' ILE . 75.0 t -51.16 -55.7 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.868 178.274 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -68.85 -32.13 71.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.582 -172.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.14 -47.03 88.13 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 120.962 0.41 . . . . 0.0 109.941 177.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.485 HD13 HD21 ' A' ' 105' ' ' LEU . 79.6 mt -63.54 -53.34 46.4 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.099 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 478' ' ' ILE . . . . . 0.455 HG13 ' O ' ' B' ' 474' ' ' VAL . 49.9 mt -58.63 -26.76 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.868 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -57.7 -41.31 81.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.736 -179.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.24 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.872 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 . . . . . 0 N--CA 1.45 -0.454 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.545 HG21 ' HB ' ' A' ' 147' ' ' VAL . 12.0 p -84.16 154.11 3.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.168 -173.014 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.7 m -59.36 141.33 54.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.467 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 92' ' ' LEU . 3.2 tt -68.03 -30.97 70.32 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.865 -178.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -54.25 -43.97 71.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.48 173.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.438 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 2.8 m-20 -63.31 -35.63 81.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.137 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 89' ' ' LEU . 44.6 mt -71.01 -34.47 71.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.194 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.449 ' NZ ' ' HB3' ' A' ' 93' ' ' LYS . 9.8 mtpm? -59.64 -24.13 63.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.317 -0.401 . . . . 0.0 112.053 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -77.42 -17.44 58.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.177 -179.047 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.556 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 91.8 mt -62.7 -46.02 90.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.438 -176.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.66 -18.32 69.99 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.622 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -84.67 -16.19 42.73 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.938 0.399 . . . . 0.0 110.608 -179.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.646 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.7 t -78.27 122.07 25.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.084 -176.409 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.51 -25.2 63.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.428 177.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 97.2 m -72.78 -45.2 59.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.919 178.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.556 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 36.2 tp -69.45 -51.26 37.83 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.766 -172.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.646 ' HG2' ' O ' ' A' ' 98' ' ' SER . 6.2 ptp180 -58.45 -29.5 66.2 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.974 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 33.3 t -62.05 -42.67 99.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -178.296 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.682 HD21 ' SG ' ' A' ' 142' ' ' CYS . 0.5 OUTLIER -87.96 -16.2 34.46 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.261 -178.608 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.495 HD13 ' O ' ' A' ' 101' ' ' LEU . 9.4 mp -69.36 -12.22 61.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.179 0.514 . . . . 0.0 110.541 171.085 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 83.1 mt -73.09 -17.63 61.39 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.792 178.128 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -71.0 118.75 68.44 Favored Pre-proline 0 C--O 1.234 0.256 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.34 -32.37 71.71 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 123.063 2.509 . . . . 0.0 112.755 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -71.56 -49.86 36.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.534 0.206 . . . . 0.0 110.849 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.57 HD21 ' HB2' ' A' ' 139' ' ' PHE . 33.2 tp -63.51 -43.17 97.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 120.774 0.321 . . . . 0.0 111.077 -176.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -66.15 -30.59 71.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.182 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLN . . . . . 0.433 ' HA ' HG22 ' A' ' 115' ' ' VAL . 15.7 mm-40 -72.33 -39.3 68.29 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.654 175.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 72.4 mt -56.72 -50.24 72.78 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.405 ' HG2' HG23 ' B' ' 474' ' ' VAL . 57.5 mtp -53.94 -55.51 26.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.904 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.625 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 34.5 m -67.21 -23.89 31.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -176.363 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 57.3 m-20 -72.22 -38.81 68.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.189 0.519 . . . . 0.0 110.69 177.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.27 -43.61 81.4 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.521 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -61.61 -16.55 49.31 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.604 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.625 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 77.6 mt-30 -74.43 -29.73 61.61 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.4 14.93 60.62 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 114.578 -1.192 . . . . 0.0 113.908 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -55.14 -55.03 35.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.475 0.655 . . . . 0.0 110.186 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -135.09 55.8 1.87 Allowed 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.909 175.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.635 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -49.96 -30.52 10.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.933 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.86 -53.06 61.08 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.724 0.297 . . . . 0.0 111.09 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -75.72 -28.75 58.67 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.494 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.487 HD22 ' CE2' ' A' ' 130' ' ' TYR . 94.6 mt -64.25 -48.71 74.74 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.41 178.016 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.95 -40.21 60.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.951 0.405 . . . . 0.0 111.403 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -79.26 -44.84 20.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.972 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.588 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.99 -26.88 65.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.693 -176.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.487 ' CE2' HD22 ' A' ' 126' ' ' LEU . 4.3 m-30 -76.85 -29.44 55.86 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.93 0.395 . . . . 0.0 110.992 -178.462 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' MET . . . . . 0.424 ' HA ' ' CE ' ' A' ' 131' ' ' MET . 1.4 mmt -76.33 -2.79 33.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.89 -175.223 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.588 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.3 pt20 -103.96 -8.11 19.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.085 0.469 . . . . 0.0 110.416 176.58 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.472 ' O ' HG23 ' A' ' 137' ' ' VAL . 7.3 mt-10 -95.08 118.85 66.48 Favored Pre-proline 0 N--CA 1.449 -0.522 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 -178.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.472 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 19.7 Cg_endo -58.47 -21.39 53.8 Favored 'Trans proline' 0 CA--C 1.519 -0.244 0 C-N-CA 122.826 2.351 . . . . 0.0 111.976 -177.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.37 -39.02 81.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.28 177.147 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -87.86 -29.15 21.13 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.225 -178.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 133' ' ' GLU . 86.4 t -62.82 -44.06 99.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.696 177.314 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 14.0 pt-20 -67.76 -32.88 73.79 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.404 179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' PHE . . . . . 0.57 ' HB2' HD21 ' A' ' 110' ' ' LEU . 30.6 t80 -61.91 -52.73 62.91 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.062 0.458 . . . . 0.0 109.948 174.006 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.702 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -59.6 -42.75 93.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.175 -178.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -62.72 -33.04 74.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.418 0.628 . . . . 0.0 110.427 -175.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' CYS . . . . . 0.682 ' SG ' HD21 ' A' ' 104' ' ' LEU . 89.4 m -75.74 -47.93 23.94 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.167 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.544 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 22.4 p -67.58 -32.81 73.82 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.933 -176.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.3 mt -69.56 -27.16 64.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.063 -179.099 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -79.29 -20.64 69.09 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.465 -0.874 . . . . 0.0 111.807 177.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 65.5 mt -91.04 -35.89 7.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.84 0.352 . . . . 0.0 111.342 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.545 ' HB ' HG21 ' A' ' 87' ' ' VAL . 30.9 m -83.2 5.24 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.309 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 C--N 1.323 -0.545 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 170.559 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 43.0 mm . . . . . 0 C--O 1.234 0.282 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -70.83 -25.28 62.77 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.198 -176.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -74.17 -50.92 17.18 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.366 174.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.574 ' O ' HG12 ' B' ' 470' ' ' ILE . 54.7 mm-40 -54.86 -44.63 74.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.07 -175.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -59.0 -35.51 73.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.994 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -31.1 54.94 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -178.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.1 -36.67 78.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.722 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.574 HG12 ' O ' ' B' ' 466' ' ' GLU . 28.3 mm -60.99 -36.91 75.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.346 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 90.3 mt -57.13 -44.24 83.13 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.809 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.48 ' HB3' HD11 ' A' ' 92' ' ' LEU . 2.1 mp0 -62.71 -38.9 92.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.663 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 473' ' ' CYS . . . . . 0.425 ' O ' HG13 ' B' ' 477' ' ' ILE . 60.5 m -66.72 -59.9 3.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.175 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.405 HG23 ' HG2' ' A' ' 114' ' ' MET . 10.3 p -54.36 -43.78 63.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.04 -179.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.529 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 73.6 mtp180 -67.65 -30.29 69.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.523 0.202 . . . . 0.0 111.373 -177.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 476' ' ' TYR . . . . . 0.413 ' CZ ' ' HE2' ' B' ' 480' ' ' LYS . 0.5 OUTLIER -68.77 -46.83 67.74 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.09 0.471 . . . . 0.0 109.929 176.42 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.456 HD13 HD21 ' A' ' 105' ' ' LEU . 56.5 mt -64.55 -51.82 62.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.257 -175.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 61.8 mt -56.59 -24.85 19.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.758 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.529 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 13.4 ttmm -71.23 -32.85 69.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.87 -173.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 480' ' ' LYS . . . . . 0.413 ' HE2' ' CZ ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.597 0 C-N-CA 119.795 -0.762 . . . . 0.0 112.308 176.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.0 ptp180 . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.4 p -110.46 160.89 9.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.771 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.0 m -72.41 164.58 26.12 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.783 0.325 . . . . 0.0 111.593 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.442 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -69.82 -38.76 76.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.503 -176.652 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -53.1 -42.05 65.56 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.116 0.484 . . . . 0.0 110.877 177.041 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.46 ' O ' HG12 ' A' ' 147' ' ' VAL . 3.1 m-20 -67.02 -23.08 65.87 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.999 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.51 ' HA ' HD13 ' A' ' 95' ' ' LEU . 81.2 mt -87.17 -34.37 19.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.098 0.475 . . . . 0.0 110.753 177.349 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 2.6 mmmp? -56.72 -36.51 69.8 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.76 -15.81 61.19 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -174.273 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.51 HD13 ' HA ' ' A' ' 92' ' ' LEU . 8.3 mp -63.46 -42.9 98.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.81 0.338 . . . . 0.0 110.834 -178.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -71.08 -13.26 72.72 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.711 176.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -94.27 -11.3 30.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.238 0.542 . . . . 0.0 109.779 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.644 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.4 t -81.61 113.08 19.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.578 -176.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.83 -25.65 67.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.62 178.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 63.3 m -71.29 -46.06 61.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.054 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.419 HD11 ' CD2' ' A' ' 139' ' ' PHE . 61.1 tp -72.3 -45.98 57.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.563 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -58.59 -31.05 67.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.116 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.432 ' HA ' HD23 ' A' ' 106' ' ' LEU . 37.6 t -62.54 -22.5 66.36 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.228 0.537 . . . . 0.0 110.423 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.452 HD11 ' SG ' ' A' ' 142' ' ' CYS . 21.7 mt -84.44 -31.71 24.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.876 178.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.24 -2.1 17.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.203 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.2 mm? -67.28 -18.43 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.836 0.351 . . . . 0.0 110.235 172.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -84.84 115.41 60.78 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.902 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.36 -37.89 92.98 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.776 2.317 . . . . 0.0 111.879 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.483 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 66.7 t60 -60.28 -46.95 88.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.724 177.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.448 ' O ' HD23 ' A' ' 110' ' ' LEU . 4.4 tt -59.67 -40.72 88.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.176 0.512 . . . . 0.0 109.64 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 111' ' ' ARG . 23.2 mtm180 -66.38 -40.32 89.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.447 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -62.63 -37.18 85.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.675 176.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 109' ' ' HIS . 86.1 mt -58.02 -52.22 66.41 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 175.105 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.41 ' HG2' HG22 ' B' ' 474' ' ' VAL . 65.5 mtp -53.41 -51.72 61.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.871 176.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.598 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 56.8 t -58.38 -46.65 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.351 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -60.48 -42.8 97.02 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.032 0.444 . . . . 0.0 111.488 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.507 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 54.3 tp -68.01 -36.02 79.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.887 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.12 -24.27 63.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.064 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.598 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 25.8 mt-30 -61.98 -30.65 71.08 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.725 0.774 . . . . 0.0 110.612 177.611 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.49 25.82 74.67 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 114.336 -1.302 . . . . 0.0 113.368 174.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -76.73 -55.39 5.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.208 0.527 . . . . 0.0 109.826 -178.636 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.513 ' OD2' ' HE2' ' A' ' 125' ' ' LYS . 4.5 p-10 -135.01 43.12 2.73 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.887 177.052 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.646 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.59 -35.68 9.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.974 177.054 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.41 -42.16 98.75 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.014 0.435 . . . . 0.0 110.97 -177.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.513 ' HE2' ' OD2' ' A' ' 122' ' ' ASP . 35.7 ttpt -72.79 -44.99 60.86 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.2 0.524 . . . . 0.0 110.059 175.708 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.444 HD22 ' HE2' ' A' ' 130' ' ' TYR . 95.1 mt -56.72 -38.72 72.73 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.326 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.7 mmt -51.2 -40.0 57.74 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 110.959 177.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 24.0 mmm180 -79.32 -40.41 30.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.826 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.574 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.76 -27.28 67.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.692 -177.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.507 ' CE1' ' HB2' ' A' ' 117' ' ' LEU . 3.3 m-30 -81.87 -29.32 32.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.977 0.418 . . . . 0.0 111.21 -176.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' MET . . . . . 0.494 ' HE2' HG12 ' A' ' 137' ' ' VAL . 15.0 mmt -77.32 4.98 9.45 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.539 -177.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.574 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 20.7 pt20 -107.07 -9.54 16.16 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.189 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -99.27 120.08 58.95 Favored Pre-proline 0 N--CA 1.452 -0.362 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.769 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.69 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 27.7 Cg_endo -62.38 -13.76 34.75 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.797 2.332 . . . . 0.0 112.224 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.0 mp -72.84 -46.39 53.25 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.611 176.136 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.498 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 32.3 t80 -87.04 -31.4 20.55 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.493 -169.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.69 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.7 m -56.93 -48.29 81.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.879 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 37.4 mt-10 -65.56 -42.57 91.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.638 178.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' PHE . . . . . 0.419 ' CD2' HD11 ' A' ' 101' ' ' LEU . 60.0 t80 -53.89 -50.05 67.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.376 0.607 . . . . 0.0 109.609 176.239 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.757 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.35 -46.32 87.14 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.098 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.31 -28.93 69.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.31 0.576 . . . . 0.0 110.948 -174.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' CYS . . . . . 0.452 ' SG ' HD11 ' A' ' 104' ' ' LEU . 91.5 m -80.84 -41.83 22.56 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.685 -177.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 27.9 p -69.79 -27.34 64.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.616 0.246 . . . . 0.0 111.151 -177.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.757 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 81.6 mt -59.64 -44.9 93.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.059 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -65.11 -17.66 63.81 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.615 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 20.6 mt -91.7 -31.56 4.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.765 0.316 . . . . 0.0 111.054 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.46 HG12 ' O ' ' A' ' 91' ' ' ASN . 13.6 m -98.48 -17.41 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 . . . . . 0 C--N 1.326 -0.43 0 CA-C-O 120.917 0.389 . . . . 0.0 110.286 178.135 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 463' ' ' ILE . . . . . 0.579 ' HA ' ' HG2' ' B' ' 466' ' ' GLU . 27.3 mt . . . . . 0 CA--C 1.53 0.174 0 CA-C-O 120.883 0.373 . . . . 0.0 111.596 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -66.89 -35.3 79.7 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 465' ' ' HIS . . . . . 0.493 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 19.0 t60 -73.38 -47.67 40.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.672 -177.391 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.581 ' O ' HG12 ' B' ' 470' ' ' ILE . 12.3 pt-20 -63.21 -36.91 85.22 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.779 -176.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -61.77 -40.82 96.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.418 . . . . 0.0 112.039 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 468' ' ' ASN . . . . . 0.493 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.6 p-10 -81.8 -23.52 36.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -177.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.17 -36.82 77.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.679 173.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.581 HG12 ' O ' ' B' ' 466' ' ' GLU . 26.5 mm -60.58 -34.35 58.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.28 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 73.0 mt -59.61 -43.55 93.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.167 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -62.62 -41.31 98.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.876 177.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 55.1 m -63.42 -57.3 10.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.437 -178.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.41 HG22 ' HG2' ' A' ' 114' ' ' MET . 98.3 t -51.22 -45.33 31.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.602 175.681 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.601 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 0.8 OUTLIER -60.74 -42.2 96.87 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.317 -178.17 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -67.07 -45.98 75.7 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.673 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.18 -57.22 10.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.93 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 44.9 mt -60.32 -21.13 21.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.782 0.325 . . . . 0.0 111.253 -177.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.601 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 19.3 tptm -67.91 -42.31 81.33 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.77 -177.238 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.518 0 N-CA-C 112.43 0.529 . . . . 0.0 112.43 -178.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? . . . . . 0 CA--C 1.519 -0.229 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.497 HG21 ' HB ' ' A' ' 147' ' ' VAL . 11.2 p -81.35 148.79 5.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.772 -175.225 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 25.2 m -55.54 139.9 42.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.227 -176.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.505 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -61.43 -35.95 78.98 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.04 -179.235 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -60.62 -39.95 90.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.65 177.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -60.71 -38.82 86.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.811 177.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.477 HD12 HD22 ' A' ' 89' ' ' LEU . 61.2 mt -69.96 -36.62 75.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.054 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 9.2 mtpm? -59.93 -17.79 40.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.21 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -83.29 -17.36 42.79 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.597 0.237 . . . . 0.0 111.378 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 84.8 mt -61.28 -44.22 97.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.83 0.348 . . . . 0.0 111.245 -176.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -71.1 -14.46 73.72 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.384 -179.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -87.94 -18.18 29.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.877 0.37 . . . . 0.0 110.503 -178.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.643 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 28.0 t -80.68 115.81 20.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.763 -177.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.72 -21.47 65.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.48 176.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 29.5 m -74.3 -43.71 55.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.927 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 63.2 tp -73.38 -48.38 34.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.424 -175.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.643 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.8 ptp180 -58.77 -29.6 66.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.072 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 28.9 t -63.11 -31.32 72.43 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-O 121.127 0.489 . . . . 0.0 109.956 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.1 mt -75.45 -38.14 59.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.898 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.444 HD21 HD13 ' B' ' 477' ' ' ILE . 11.1 mp -66.8 -17.98 65.15 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.819 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 62.1 mt -65.81 -19.01 65.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.741 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -75.61 120.84 83.52 Favored Pre-proline 0 C--O 1.236 0.352 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 173.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.73 -25.55 79.47 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.674 2.249 . . . . 0.0 112.29 -178.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -71.24 -48.8 48.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.093 178.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 58.2 tp -65.77 -37.27 85.88 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 120.86 0.362 . . . . 0.0 111.103 -175.096 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -69.15 -27.94 65.99 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.161 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLN . . . . . 0.474 ' HA ' HG22 ' A' ' 115' ' ' VAL . 53.5 mm-40 -70.44 -38.85 74.6 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.391 174.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 94.5 mt -59.35 -47.21 86.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.194 0.521 . . . . 0.0 110.054 174.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 69.9 mtp -57.66 -51.95 67.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.668 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.614 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 32.9 m -65.79 -31.51 54.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.516 -177.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -64.69 -45.89 84.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.941 0.401 . . . . 0.0 110.635 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.9 tp -66.69 -40.3 88.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.21 -178.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -63.28 -41.38 98.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.76 -178.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.614 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 48.5 mt-30 -68.76 -29.09 67.4 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.521 0.677 . . . . 0.0 110.592 -177.664 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 83.15 29.84 32.79 Favored Glycine 0 C--N 1.318 -0.472 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.96 174.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -52.2 -54.62 28.74 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.218 0.533 . . . . 0.0 110.207 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.643 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 9.9 t0 -155.79 65.97 0.6 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 172.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.417 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -56.13 -27.23 53.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.211 -177.388 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.56 -47.3 86.8 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.105 0.479 . . . . 0.0 110.478 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -75.25 -42.14 55.83 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.662 177.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 87.7 mt -58.45 -44.24 89.15 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.485 -175.511 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.439 ' SD ' HD21 ' B' ' 471' ' ' LEU . 0.8 OUTLIER -52.25 -37.83 56.44 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.995 0.426 . . . . 0.0 111.421 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -84.06 -42.38 16.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.81 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.573 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.07 -21.64 64.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.983 -176.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.478 ' HB3' ' CD1' ' A' ' 136' ' ' PHE . 4.4 m-30 -82.77 -26.37 31.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.893 0.377 . . . . 0.0 111.203 -178.779 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' MET . . . . . 0.505 ' HE2' HG12 ' A' ' 137' ' ' VAL . 2.7 mmt -81.58 3.2 25.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.04 0.448 . . . . 0.0 111.501 -175.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 24.7 pt20 -102.84 -7.15 21.81 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.851 174.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.401 ' O ' HG22 ' A' ' 137' ' ' VAL . 6.4 mt-10 -99.49 122.66 50.88 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.324 -176.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.716 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 28.7 Cg_endo -62.01 -14.54 37.93 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.061 2.507 . . . . 0.0 112.867 -177.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 51.6 mt -82.75 -33.94 27.28 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.316 176.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.478 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 34.7 t80 -89.62 -31.14 17.68 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.107 -176.096 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.716 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 14.0 m -60.88 -48.44 88.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.08 177.197 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.479 ' N ' HG23 ' A' ' 137' ' ' VAL . 40.9 mm-40 -66.3 -36.5 83.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.849 176.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -56.46 -49.1 75.62 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 173.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.698 ' HA ' ' SG ' ' A' ' 143' ' ' CYS . . . -64.0 -43.0 96.98 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.507 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.46 -36.55 73.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.375 0.607 . . . . 0.0 110.292 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 65.1 m -77.05 -49.82 14.49 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.08 -0.963 . . . . 0.0 111.403 -179.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.698 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.5 p -64.21 -36.84 85.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.775 -176.1 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 46.2 mt -67.95 -34.58 76.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.409 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -73.92 -17.12 79.28 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.163 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 82.4 mt -90.97 -49.02 13.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.689 0.28 . . . . 0.0 110.775 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.497 ' HB ' HG21 ' A' ' 87' ' ' VAL . 16.3 m -86.62 1.8 5.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 -172.08 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 . . . . . 0 C--N 1.325 -0.461 0 CA-C-O 120.94 0.4 . . . . 0.0 111.266 179.01 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 65.9 mt . . . . . 0 C--O 1.225 -0.201 0 CA-C-O 120.754 0.311 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -56.37 -44.15 79.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.689 178.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 465' ' ' HIS . . . . . 0.569 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 58.7 t60 -67.71 -45.29 75.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.778 176.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -60.14 -38.45 83.11 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.566 -179.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 21.6 ttp180 -67.95 -42.92 80.22 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.713 -176.506 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 468' ' ' ASN . . . . . 0.569 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.6 p-10 -76.66 -16.51 59.52 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.675 0.75 . . . . 0.0 110.047 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.4 t -74.67 -21.76 17.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.286 177.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 470' ' ' ILE . . . . . . . . . . . . . 36.8 mm -68.94 -32.82 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-O 122.338 1.066 . . . . 0.0 109.062 -175.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 471' ' ' LEU . . . . . 0.623 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.6 OUTLIER -50.96 -54.83 20.9 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 113.017 -1.901 . . . . 0.0 110.768 179.145 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.477 ' HB3' HD11 ' A' ' 92' ' ' LEU . 2.8 mp0 -50.83 -44.81 59.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.938 176.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 50.6 m -62.81 -56.36 18.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.511 -179.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 92.4 t -52.01 -53.88 16.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.016 178.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 50.2 mtp180 -72.65 -27.33 62.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.623 -171.377 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -67.17 -46.63 73.38 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.053 0.454 . . . . 0.0 109.867 176.05 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.444 HD13 HD21 ' A' ' 105' ' ' LEU . 79.3 mt -63.03 -54.92 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.729 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 41.9 mt -56.33 -28.16 25.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.047 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 25.3 tptp -56.94 -39.46 74.55 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.976 -177.081 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.524 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.029 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 71.5 mtm180 . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.6 p -99.83 155.79 4.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.455 -174.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.0 m -69.29 151.82 45.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.244 0.545 . . . . 0.0 111.204 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.42 HD22 HD12 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -63.79 -33.38 75.53 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.905 -174.588 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -56.35 -39.66 73.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.864 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -68.6 -37.87 80.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.54 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.42 HD12 HD22 ' A' ' 89' ' ' LEU . 84.7 mt -68.9 -36.95 78.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.983 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 98.4 mttt -58.76 -27.08 64.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.742 178.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -72.53 -18.02 61.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.162 -178.302 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.437 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 94.0 mt -61.98 -54.41 42.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.161 -177.328 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -63.02 -21.22 63.43 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 121.145 -0.55 . . . . 0.0 113.07 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -76.35 -20.72 56.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.02 0.438 . . . . 0.0 110.744 -178.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 15.0 m -89.0 117.13 27.8 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.706 -175.021 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.16 -27.68 68.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.584 -176.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 60.3 m -70.03 -42.67 72.65 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.092 -178.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.437 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 43.6 tp -69.84 -49.77 49.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.539 -176.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.62 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 8.1 ptp180 -60.35 -27.23 67.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.649 -177.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.5 t -61.36 -28.98 69.61 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.368 0.604 . . . . 0.0 109.858 176.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.6 mt -80.18 -32.02 38.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.965 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.594 HD21 HD13 ' B' ' 477' ' ' ILE . 9.5 mp -66.56 -22.56 66.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.551 0.691 . . . . 0.0 110.173 177.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 63.4 mt -72.97 -9.15 58.41 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.997 -179.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -79.84 121.23 82.03 Favored Pre-proline 0 C--O 1.233 0.236 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 175.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -63.16 -19.9 69.76 Favored 'Trans proline' 0 CA--C 1.528 0.218 0 C-N-CA 122.777 2.318 . . . . 0.0 112.679 -179.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 112' ' ' GLN . 71.1 t60 -81.87 -49.89 9.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.717 0.294 . . . . 0.0 110.746 175.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.517 HD11 ' HB2' ' A' ' 139' ' ' PHE . 2.6 tt -62.93 -41.84 99.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.488 -174.366 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -61.77 -29.94 70.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.515 177.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 6.6 mm-40 -64.15 -49.19 73.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.262 175.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.559 HD21 ' OE2' ' A' ' 133' ' ' GLU . 8.9 mp -52.04 -44.97 64.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.948 0.404 . . . . 0.0 110.646 174.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 73.9 mtp -57.45 -59.28 5.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.199 178.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.66 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 26.4 m -66.49 -27.62 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.652 -175.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -71.2 -53.53 14.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.976 0.417 . . . . 0.0 110.986 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 59.7 tp -62.11 -39.56 92.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.011 -176.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -66.71 -27.94 68.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.66 -0.246 . . . . 0.0 111.653 -173.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 72.6 mt-30 -64.06 -29.66 70.78 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.682 0.754 . . . . 0.0 110.374 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLY . . . . . 0.409 ' HA2' ' HB3' ' A' ' 123' ' ' LYS . . . 68.71 29.04 72.72 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.603 173.514 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.31 -49.5 27.19 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 5.4 m-20 -136.72 42.61 2.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.944 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.654 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.99 -33.05 7.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.576 -1.193 . . . . 0.0 112.377 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -56.26 -55.6 31.35 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.682 0.277 . . . . 0.0 111.667 -176.326 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -75.04 -29.98 60.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.782 0.325 . . . . 0.0 110.375 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.462 HD22 ' CE1' ' A' ' 130' ' ' TYR . 97.6 mt -65.73 -40.9 92.64 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.875 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.408 ' SD ' HD21 ' B' ' 471' ' ' LEU . 0.0 OUTLIER -55.41 -34.54 64.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.067 0.46 . . . . 0.0 110.64 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -78.87 -49.7 12.45 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.005 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.526 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.09 -16.54 64.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.345 -175.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.462 ' CE1' HD22 ' A' ' 126' ' ' LEU . 3.4 m-30 -88.75 -28.75 20.3 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.765 0.317 . . . . 0.0 111.059 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 3.2 mmt -71.14 -4.95 28.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.407 -178.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 28.3 pt20 -98.76 -18.44 17.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.258 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.559 ' OE2' HD21 ' A' ' 113' ' ' LEU . 4.2 mt-10 -88.86 123.06 68.49 Favored Pre-proline 0 CA--C 1.515 -0.387 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -176.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.42 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 12.6 Cg_endo -55.88 -25.1 50.91 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.169 2.58 . . . . 0.0 112.604 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.31 -45.22 66.69 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.201 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.411 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 28.2 t80 -73.74 -31.68 63.48 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -178.262 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 133' ' ' GLU . 82.9 t -62.54 -42.77 97.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.336 176.284 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 8.3 mm-40 -66.67 -45.91 77.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.341 175.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' PHE . . . . . 0.517 ' HB2' HD11 ' A' ' 110' ' ' LEU . 69.8 t80 -57.54 -48.64 78.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.646 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.786 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.76 -49.52 74.7 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.111 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -60.21 -33.84 72.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.413 0.625 . . . . 0.0 110.294 -176.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' CYS . . . . . 0.445 ' O ' HG13 ' A' ' 146' ' ' ILE . 99.6 m -69.56 -50.3 46.04 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.723 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.0 p -69.49 -29.06 66.62 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.638 -176.268 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.6 mt -60.89 -40.32 92.59 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.061 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -74.05 -29.78 62.17 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.414 -0.898 . . . . 0.0 111.985 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 142' ' ' CYS . 62.6 mt -77.5 -37.05 24.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.67 -0.265 . . . . 0.0 111.234 -177.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 143' ' ' CYS . 23.0 m -87.33 2.92 5.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.399 -178.207 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 19.0 mm-40 . . . . . 0 C--N 1.324 -0.52 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 168.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 463' ' ' ILE . . . . . 0.439 ' HA ' ' HB2' ' B' ' 466' ' ' GLU . 65.7 mt . . . . . 0 N--CA 1.455 -0.179 0 N-CA-C 111.465 0.172 . . . . 0.0 111.465 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -55.25 -49.81 71.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.312 0.577 . . . . 0.0 109.444 174.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 465' ' ' HIS . . . . . 0.472 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 29.0 t60 -70.24 -45.45 66.46 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.165 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.439 ' HB2' ' HA ' ' B' ' 463' ' ' ILE . 39.5 mt-10 -64.19 -22.83 67.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.242 -174.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 38.9 ttt180 -80.15 -41.38 25.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 178.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 468' ' ' ASN . . . . . 0.472 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -84.47 -17.48 38.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.534 0.683 . . . . 0.0 110.597 -174.538 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 3.4 p -78.3 -19.39 13.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.343 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.411 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 39.4 mm -69.11 -31.07 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 122.427 1.108 . . . . 0.0 108.737 -175.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 471' ' ' LEU . . . . . 0.62 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.6 OUTLIER -54.81 -52.63 62.1 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 112.929 -1.941 . . . . 0.0 110.284 179.358 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -53.09 -44.5 67.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.932 174.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 50.7 m -61.28 -55.52 30.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.433 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 94.1 t -51.67 -51.58 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.908 176.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -64.6 -40.75 96.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.616 -173.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.47 -43.57 96.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 0.0 110.447 178.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.594 HD13 HD21 ' A' ' 105' ' ' LEU . 78.2 mt -65.57 -55.42 19.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.274 -178.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 47.0 mt -56.97 -25.14 21.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.067 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -58.89 -47.06 86.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.111 -176.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 480' ' ' LYS . . . . . 0.479 ' HD2' ' H ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.651 0 C-N-CA 119.903 -0.719 . . . . 0.0 112.073 -179.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 . . . . . 0 N--CA 1.45 -0.446 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.451 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 45.2 t -98.6 128.74 49.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.863 0.363 . . . . 0.0 110.502 -175.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.0 m -68.74 150.07 48.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.526 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.62 -34.41 74.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.374 -173.842 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -60.05 -39.89 87.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 0.0 110.296 178.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.41 -38.83 81.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.098 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.517 ' HA ' HD13 ' A' ' 95' ' ' LEU . 94.3 mt -69.46 -35.17 75.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.934 -177.711 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 96.6 mttt -59.31 -30.99 68.75 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -177.484 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -68.58 -19.59 64.48 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.513 0.196 . . . . 0.0 111.148 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.517 HD13 ' HA ' ' A' ' 92' ' ' LEU . 8.7 mp -64.1 -39.15 93.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.955 0.407 . . . . 0.0 110.623 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -72.48 -19.12 78.8 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.597 175.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -83.86 -24.6 30.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.032 0.444 . . . . 0.0 110.371 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.654 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 48.3 t -77.39 111.73 13.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.77 -177.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.2 -21.31 62.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.313 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 58.8 m -71.43 -46.79 59.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.96 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.515 HD11 ' CD1' ' A' ' 139' ' ' PHE . 59.5 tp -68.25 -51.08 49.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.968 -175.746 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.654 ' HG2' ' O ' ' A' ' 98' ' ' SER . 6.3 ptp180 -59.96 -28.19 67.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.682 -178.382 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.49 ' HA ' HD23 ' A' ' 106' ' ' LEU . 33.7 t -62.2 -23.62 66.73 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.095 0.474 . . . . 0.0 110.399 178.359 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.3 mt -82.38 -24.79 34.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.028 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 102' ' ' ARG . 10.2 mp -75.74 -8.68 57.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.51 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.4 mm? -67.48 -22.92 65.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.889 172.499 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -71.25 113.88 23.02 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.858 177.102 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' A' ' 111' ' ' ARG . 25.1 Cg_endo -61.68 -24.29 77.48 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.938 2.425 . . . . 0.0 112.846 -175.572 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 47.1 t60 -78.47 -42.46 29.71 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.824 0.345 . . . . 0.0 110.376 177.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.6 tt -65.36 -42.97 92.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.035 -176.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.457 ' HD3' ' HA ' ' A' ' 108' ' ' PRO . 12.7 ptm180 -67.56 -31.62 71.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.648 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -63.52 -43.02 98.39 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.426 173.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 86.0 mt -57.34 -49.34 76.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.412 ' HG2' HG22 ' B' ' 474' ' ' VAL . 75.0 mtp -54.89 -49.32 71.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.073 177.572 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 45.8 t -60.56 -39.9 82.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.032 0.444 . . . . 0.0 111.343 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.497 ' HA ' ' NE2' ' A' ' 119' ' ' GLN . 74.4 m-20 -68.32 -38.61 81.73 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.268 -178.408 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.56 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 59.7 tp -73.66 -44.66 56.19 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.61 -178.194 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.438 ' OD1' ' HD3' ' B' ' 475' ' ' ARG . 30.9 t70 -71.0 -27.99 64.09 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -171.408 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.497 ' NE2' ' HA ' ' A' ' 116' ' ' ASN . 11.0 pt20 -68.29 -17.54 64.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.279 0.562 . . . . 0.0 110.675 178.26 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 67.39 29.42 74.16 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.442 -0.799 . . . . 0.0 113.864 170.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -76.87 -51.99 10.27 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.954 0.377 . . . . 0.0 111.167 179.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.46 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 17.6 m-20 -132.89 37.06 3.46 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.252 0.549 . . . . 0.0 110.518 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.646 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -46.11 -34.29 4.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.557 -1.201 . . . . 0.0 112.521 179.269 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.2 -46.9 88.14 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.834 0.349 . . . . 0.0 111.462 -176.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.437 ' HE2' ' HB3' ' A' ' 122' ' ' ASP . 3.9 mppt? -81.44 -35.33 30.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.138 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 85.4 mt -59.8 -44.25 94.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.046 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.476 ' HB3' ' NH2' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -54.75 -29.85 54.92 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.796 0.331 . . . . 0.0 111.822 179.314 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -83.19 -50.32 8.56 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.98 0.419 . . . . 0.0 110.441 176.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.752 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.34 -29.97 71.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.104 -176.647 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.594 ' HB3' ' CD1' ' A' ' 136' ' ' PHE . 3.5 m-30 -73.37 -21.92 60.41 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 122.172 -0.33 . . . . 0.0 111.367 -177.304 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' MET . . . . . 0.484 ' SD ' ' HG2' ' B' ' 467' ' ' ARG . 3.3 mmt -85.19 -5.26 59.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.899 0.38 . . . . 0.0 110.892 -177.125 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.752 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.6 pt20 -103.6 -6.63 21.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.896 0.379 . . . . 0.0 110.22 176.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.516 ' O ' HG23 ' A' ' 137' ' ' VAL . 4.1 mt-10 -92.31 120.3 67.68 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.184 -177.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.537 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 22.5 Cg_endo -60.74 -21.0 68.32 Favored 'Trans proline' 0 N--CA 1.464 -0.21 0 C-N-CA 122.754 2.303 . . . . 0.0 112.339 -175.655 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 63.4 mt -82.08 -43.96 17.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.706 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.594 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 47.1 t80 -73.48 -31.21 63.63 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.601 -0.44 . . . . 0.0 109.998 -177.018 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 133' ' ' GLU . 78.0 t -60.67 -39.98 83.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.483 176.627 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 17.7 mm-40 -63.18 -46.67 86.0 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.965 0.412 . . . . 0.0 110.129 177.373 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' PHE . . . . . 0.515 ' CD1' HD11 ' A' ' 101' ' ' LEU . 58.7 t80 -57.93 -50.23 74.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.376 178.34 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.765 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.45 -48.69 74.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.497 -176.071 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -63.99 -30.33 71.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.159 0.504 . . . . 0.0 110.295 -176.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 61.4 m -70.27 -51.07 33.28 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.819 178.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.453 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 24.3 p -66.7 -25.2 66.42 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.242 -176.222 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.765 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 79.1 mt -57.42 -44.0 84.27 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.913 0.387 . . . . 0.0 110.805 177.237 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' GLY . . . . . 0.421 ' O ' ' HG2' ' A' ' 148' ' ' GLU . . . -76.75 -14.59 82.39 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.309 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 41.1 mt -91.46 -29.32 4.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.751 0.31 . . . . 0.0 111.026 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 23.0 m -100.64 5.3 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 CA-C-O 120.698 0.285 . . . . 0.0 110.559 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 145' ' ' GLY . 4.9 pt-20 . . . . . 0 N--CA 1.441 -0.89 0 CA-C-O 121.321 0.582 . . . . 0.0 109.704 178.102 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 77.6 mt . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 464' ' ' ARG . . . . . 0.617 ' HD2' ' H ' ' B' ' 464' ' ' ARG . 0.0 OUTLIER -76.74 -29.43 56.17 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.608 -0.837 . . . . 0.0 109.901 -175.31 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 465' ' ' HIS . . . . . 0.573 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 45.2 t60 -65.55 -48.28 72.99 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.524 171.074 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.404 ' O ' HG12 ' B' ' 470' ' ' ILE . 37.8 mt-10 -62.48 -22.36 66.19 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.407 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 467' ' ' ARG . . . . . 0.484 ' HG2' ' SD ' ' A' ' 131' ' ' MET . 28.4 mtp-105 -79.0 -44.78 21.57 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 176.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 468' ' ' ASN . . . . . 0.573 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -78.53 -19.68 52.39 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.411 -175.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 469' ' ' VAL . . . . . 0.49 HG13 ' O ' ' B' ' 465' ' ' HIS . 31.4 m -71.28 -22.51 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.973 0.416 . . . . 0.0 110.523 176.682 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.404 HG12 ' O ' ' B' ' 466' ' ' GLU . 31.3 mm -66.42 -30.75 50.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.886 177.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 77.8 mt -60.3 -38.09 82.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.789 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.451 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 3.0 mp0 -68.44 -40.0 81.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.067 0.461 . . . . 0.0 110.102 176.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.5 m -62.15 -57.29 12.09 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.509 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.412 HG22 ' HG2' ' A' ' 114' ' ' MET . 96.3 t -53.08 -49.6 49.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.514 176.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.524 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 1.8 tpp180 -59.87 -44.27 94.26 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.689 0.281 . . . . 0.0 111.259 -175.625 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -62.49 -47.06 85.65 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.8 -177.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 72.1 mt -65.6 -54.5 27.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.146 -178.294 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 11.2 mt -57.02 -28.89 30.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.182 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.524 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 21.5 tptm -59.13 -40.25 84.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.053 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 480' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.433 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.258 -179.129 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 121.042 0.449 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.526 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 61.8 t -101.46 139.88 21.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.631 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.429 ' O ' ' HB2' ' A' ' 91' ' ' ASN . 30.1 m -59.82 134.77 57.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.998 0.427 . . . . 0.0 110.196 178.268 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.516 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 3.9 tt -65.02 -33.64 76.52 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.642 -173.414 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -58.51 -37.78 76.31 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.396 175.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.436 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 4.1 m-20 -65.49 -38.57 90.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.988 176.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 78.1 mt -68.89 -34.01 74.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.177 -178.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 56.7 mtpt -59.66 -24.47 63.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.081 -179.438 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -74.54 -19.28 60.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.215 -0.194 . . . . 0.0 111.206 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.36 -42.78 99.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.932 0.396 . . . . 0.0 110.915 -177.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.45 -9.84 81.96 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.441 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -103.06 -24.47 13.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.658 0.266 . . . . 0.0 111.34 -178.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.537 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 23.8 p -71.42 115.92 11.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.921 -176.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.07 -26.96 69.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.308 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 35.9 m -70.17 -44.34 68.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.887 0.375 . . . . 0.0 110.937 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.42 HD11 ' CD2' ' A' ' 139' ' ' PHE . 46.5 tp -72.23 -49.13 37.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.522 -174.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.537 ' HG2' ' O ' ' A' ' 98' ' ' SER . 2.4 ptp180 -58.43 -29.56 66.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.17 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.416 ' HA ' HD23 ' A' ' 106' ' ' LEU . 34.0 t -65.71 -22.82 66.65 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.918 0.39 . . . . 0.0 110.256 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 24.2 mt -84.2 -28.37 27.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.226 0.536 . . . . 0.0 109.65 178.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.533 ' O ' ' HD2' ' A' ' 111' ' ' ARG . 9.7 mp -74.03 2.64 8.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.154 178.063 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.2 mm? -75.7 -19.73 58.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.893 0.378 . . . . 0.0 110.056 171.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -80.17 114.36 46.22 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.572 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -55.82 -39.77 89.16 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.501 2.801 . . . . 0.0 113.137 -177.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -69.03 -41.42 77.71 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.762 0.315 . . . . 0.0 110.624 -178.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.424 ' O ' HD23 ' A' ' 110' ' ' LEU . 3.8 tt -60.45 -41.53 94.27 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 105' ' ' LEU . 57.1 mtp85 -62.78 -44.28 96.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.912 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.81 -24.81 67.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.497 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 65.7 mt -79.16 -51.58 9.33 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 121.646 0.736 . . . . 0.0 109.079 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.576 ' HG3' HG13 ' B' ' 474' ' ' VAL . 44.0 ttp -59.55 -43.86 93.41 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.39 -1.277 . . . . 0.0 111.211 -177.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.628 ' HA ' HD13 ' B' ' 478' ' ' ILE . 33.4 m -68.01 -23.98 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.88 0.372 . . . . 0.0 111.744 -178.426 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 28.2 m-20 -72.69 -42.35 64.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.282 0.563 . . . . 0.0 110.673 177.233 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.485 HD23 HG21 ' B' ' 474' ' ' VAL . 27.9 tp -60.42 -37.27 80.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.041 -177.24 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.525 ' HB2' HD12 ' B' ' 478' ' ' ILE . 17.0 t70 -67.53 -32.22 72.86 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.867 0.365 . . . . 0.0 110.979 -178.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 68.8 mt-30 -60.75 -28.89 69.04 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.497 -178.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' GLY . . . . . 0.56 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 70.51 20.54 77.16 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.039 -0.982 . . . . 0.0 114.06 169.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -69.01 -50.59 47.5 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.451 0.643 . . . . 0.0 109.691 -178.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.483 ' OD2' ' HE2' ' A' ' 125' ' ' LYS . 13.4 p-10 -141.01 40.21 1.8 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.648 179.159 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.617 ' HD2' ' H ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -52.78 -26.99 16.0 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.794 -1.094 . . . . 0.0 112.033 179.429 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.617 ' H ' ' HD2' ' A' ' 123' ' ' LYS . . . -67.6 -39.13 84.8 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.25 0.547 . . . . 0.0 110.137 -177.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.504 ' C ' ' HD2' ' A' ' 125' ' ' LYS . 5.1 tmmm? -79.45 -45.03 20.2 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.07 177.307 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.532 HD22 ' CE1' ' A' ' 130' ' ' TYR . 94.5 mt -56.25 -38.11 70.68 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.463 -178.172 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.58 -44.89 56.94 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.953 0.406 . . . . 0.0 111.385 177.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -84.18 -36.34 22.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.801 -178.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.504 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -70.24 -16.81 63.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.638 -178.386 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.532 ' CE1' HD22 ' A' ' 126' ' ' LEU . 7.3 m-30 -87.45 -22.1 25.16 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.934 0.397 . . . . 0.0 110.737 178.652 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 5.8 mmt -77.85 -6.11 53.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.963 -177.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.9 pt20 -99.59 -4.23 31.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.948 0.404 . . . . 0.0 110.235 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.522 ' O ' HG23 ' A' ' 137' ' ' VAL . 3.9 mt-10 -104.65 119.89 52.15 Favored Pre-proline 0 N--CA 1.452 -0.356 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.19 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.459 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 16.1 Cg_endo -57.11 -24.53 58.9 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.976 2.451 . . . . 0.0 112.363 -175.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.523 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.1 mp -67.01 -51.66 52.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.347 -179.304 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.476 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 27.7 t80 -75.64 -28.04 58.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -174.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 133' ' ' GLU . 99.4 t -59.38 -43.26 89.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.331 175.507 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 44.8 mt-10 -64.74 -46.85 80.48 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.818 0.342 . . . . 0.0 110.173 178.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' PHE . . . . . 0.42 ' CD2' HD11 ' A' ' 101' ' ' LEU . 71.4 t80 -56.98 -47.09 81.61 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.556 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.697 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -68.16 -45.55 73.21 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.72 -176.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.73 -32.47 73.79 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.996 0.427 . . . . 0.0 110.331 -176.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 91.2 m -77.01 -42.77 37.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.686 -176.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.443 ' HA ' HD12 ' A' ' 146' ' ' ILE . 27.8 p -64.95 -27.07 68.59 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.212 -177.394 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 82.2 mt -63.2 -39.34 94.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.767 0.318 . . . . 0.0 110.927 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -74.25 -14.76 80.43 Favored Glycine 0 C--O 1.225 -0.418 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.088 178.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.443 HD12 ' HA ' ' A' ' 143' ' ' CYS . 50.7 mt -90.78 -40.34 12.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.972 0.415 . . . . 0.0 110.493 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.436 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 29.7 m -87.15 12.57 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.883 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 7.7 pt-20 . . . . . 0 C--O 1.236 0.342 0 O-C-N 124.115 0.885 . . . . 0.0 112.146 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 463' ' ' ILE . . . . . 0.487 ' O ' ' HG3' ' B' ' 467' ' ' ARG . 71.5 mt . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 120.36 0.124 . . . . 0.0 111.329 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 464' ' ' ARG . . . . . 0.499 ' C ' ' HD2' ' B' ' 464' ' ' ARG . 1.4 ppt_? -70.63 -37.53 73.81 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -177.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 465' ' ' HIS . . . . . 0.543 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 49.8 t60 -65.88 -46.92 76.61 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.387 176.179 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.624 ' O ' HG12 ' B' ' 470' ' ' ILE . 39.7 mt-10 -58.91 -36.5 74.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.695 -179.302 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 467' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' B' ' 463' ' ' ILE . 19.1 mtm180 -66.67 -46.8 74.48 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 468' ' ' ASN . . . . . 0.543 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.9 p-10 -75.16 -19.01 60.07 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.934 -177.526 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.0 t -66.8 -34.88 72.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.347 170.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.624 HG12 ' O ' ' B' ' 466' ' ' GLU . 35.1 mm -65.12 -29.63 47.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 96.8 mt -56.05 -41.17 74.61 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.598 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.526 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.4 mp0 -64.79 -44.11 91.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.76 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 473' ' ' CYS . . . . . 0.415 ' O ' HG13 ' B' ' 477' ' ' ILE . 42.6 m -63.01 -52.95 60.97 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.268 0.556 . . . . 0.0 110.626 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.576 HG13 ' HG3' ' A' ' 114' ' ' MET . 24.5 t -56.45 -55.11 20.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.663 178.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.64 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 53.2 mtm180 -68.99 -20.18 64.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.232 -174.64 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 476' ' ' TYR . . . . . 0.427 ' O ' ' HD2' ' B' ' 480' ' ' LYS . 2.4 t80 -73.82 -55.28 6.41 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.193 176.54 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.415 HG13 ' O ' ' B' ' 473' ' ' CYS . 62.2 mt -60.54 -59.15 4.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-O 120.917 0.389 . . . . 0.0 111.242 -173.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 478' ' ' ILE . . . . . 0.628 HD13 ' HA ' ' A' ' 115' ' ' VAL . 46.3 mt -53.71 -30.49 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.872 -176.093 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.64 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 1.5 ttmm -81.65 -19.04 42.53 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -166.214 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 480' ' ' LYS . . . . . 0.427 ' HD2' ' O ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 C-N-CA 118.946 -1.102 . . . . 0.0 112.659 167.193 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.2 ptt180 . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 121.042 0.449 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.655 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 48.8 t -109.72 136.0 46.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.58 -175.269 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.605 ' OG ' ' HG2' ' A' ' 90' ' ' GLN . 37.0 t -63.25 144.02 57.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.565 176.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.42 -21.36 66.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.846 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.605 ' HG2' ' OG ' ' A' ' 88' ' ' SER . 11.6 pt20 -66.5 -39.88 88.94 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 177.435 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -69.79 -35.24 74.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.11 177.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.3 mt -70.31 -37.94 74.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.763 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -61.73 -22.53 65.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.814 0.34 . . . . 0.0 111.849 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -78.69 -17.98 55.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.535 -178.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 95.9 mt -61.31 -47.07 87.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.698 -179.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -69.35 -12.21 65.87 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.744 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -86.44 -24.45 25.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.738 0.304 . . . . 0.0 110.899 -177.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.57 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 82.0 p -80.43 124.58 29.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.96 0.409 . . . . 0.0 110.432 -177.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.22 -26.65 65.82 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.075 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.7 m -68.22 -48.14 65.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.067 -178.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -67.8 -49.99 59.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.463 -175.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.57 ' HG2' ' O ' ' A' ' 98' ' ' SER . 7.9 ptp180 -60.63 -27.87 68.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.402 -178.315 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.3 t -68.62 -23.35 64.43 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.275 0.56 . . . . 0.0 110.001 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.1 mt -81.33 -32.51 32.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.811 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.8 mp -72.19 -5.29 34.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.349 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 57.1 mt -76.69 -8.31 57.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.229 176.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -87.48 117.84 69.08 Favored Pre-proline 0 C--N 1.332 -0.157 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 173.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -58.52 -32.15 95.88 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.825 2.35 . . . . 0.0 112.613 -178.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.8 t60 -66.86 -43.45 83.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.96 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 54.3 tp -63.3 -35.3 79.89 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.913 0.387 . . . . 0.0 110.008 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 -59.92 -42.97 95.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.075 177.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -64.26 -45.61 87.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.13 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.41 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 91.9 mt -56.3 -47.04 79.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.155 0.502 . . . . 0.0 110.351 178.209 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.468 ' HG2' HG22 ' B' ' 474' ' ' VAL . 71.4 mtp -58.75 -50.82 72.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.926 177.446 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.607 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 52.2 t -59.27 -41.97 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 120.804 0.335 . . . . 0.0 111.301 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -64.28 -45.24 88.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.262 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 48.5 tp -67.02 -39.94 87.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.298 -177.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.475 ' CB ' HD12 ' B' ' 478' ' ' ILE . 16.9 t70 -62.39 -33.53 74.95 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.961 -175.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 63.1 mt-30 -60.26 -26.86 66.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.265 0.555 . . . . 0.0 110.501 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' GLY . . . . . 0.505 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 68.2 23.67 74.74 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.096 -0.956 . . . . 0.0 114.075 170.217 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -78.9 -45.83 19.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.132 0.491 . . . . 0.0 110.029 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.493 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 10.4 m-20 -132.44 31.65 4.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.756 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.668 ' HD2' ' N ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -53.22 -28.02 24.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.184 -0.916 . . . . 0.0 112.099 -179.013 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.668 ' N ' ' HD2' ' A' ' 123' ' ' LYS . . . -64.11 -38.43 91.03 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.369 0.604 . . . . 0.0 110.753 -175.455 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.424 ' HE3' ' HB3' ' A' ' 122' ' ' ASP . 46.6 mtmt -87.21 -42.02 13.28 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.004 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 86.2 mt -55.0 -42.04 72.02 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.404 -178.525 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.62 -41.53 55.04 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.162 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -82.34 -39.79 22.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.511 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.48 -32.28 73.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.251 -178.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.41 ' HE1' ' O ' ' A' ' 113' ' ' LEU . 3.4 m-30 -78.34 -17.35 56.65 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.01 -177.193 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' MET . . . . . 0.615 ' HE2' HG12 ' A' ' 137' ' ' VAL . 3.6 mmt -76.85 -4.22 42.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.251 -177.323 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -88.38 -20.01 25.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.104 0.478 . . . . 0.0 109.854 175.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -92.2 121.66 66.23 Favored Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.658 -172.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.717 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 28.4 Cg_endo -63.17 -14.06 39.44 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.107 2.538 . . . . 0.0 112.502 -178.223 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 52.7 mt -80.04 -34.6 38.13 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.88 177.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -89.58 -35.01 16.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.227 -175.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.717 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.8 m -57.62 -48.68 82.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.223 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.473 ' N ' HG23 ' A' ' 137' ' ' VAL . 27.3 mm-40 -61.34 -42.15 98.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.423 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -57.19 -50.96 71.22 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.219 0.533 . . . . 0.0 109.665 176.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.775 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.06 -45.37 92.53 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.976 179.363 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -63.02 -32.86 74.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.286 0.565 . . . . 0.0 110.493 -175.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 90.9 m -79.69 -44.87 20.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.611 -177.393 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.47 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -66.4 -28.27 68.5 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.157 -175.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.9 mt -58.82 -51.03 71.74 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.688 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.12 -21.45 65.99 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.322 -176.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 52.3 mt -86.99 -35.15 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.676 0.274 . . . . 0.0 110.853 -179.047 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.449 ' HB ' HG11 ' A' ' 87' ' ' VAL . 18.7 m -95.88 -5.75 10.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -175.752 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 25.0 mt-10 . . . . . 0 C--N 1.327 -0.373 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.949 175.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 463' ' ' ILE . . . . . 0.46 ' O ' ' HD2' ' B' ' 467' ' ' ARG . 50.3 mm . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -58.87 -47.39 85.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.237 0.542 . . . . 0.0 110.398 177.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -64.47 -43.11 95.23 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.051 178.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.489 ' O ' HG12 ' B' ' 470' ' ' ILE . 7.9 mm-40 -63.59 -22.67 67.02 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.408 -178.448 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 467' ' ' ARG . . . . . 0.571 ' HE ' ' HA ' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -84.14 -41.19 17.32 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.155 176.649 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -31.09 71.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.689 0.281 . . . . 0.0 110.623 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 31.5 m -69.59 -21.82 24.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-O 120.791 0.329 . . . . 0.0 110.907 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 466' ' ' GLU . 42.8 mm -66.64 -32.77 59.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.224 178.341 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 71.6 mt -58.79 -45.05 90.74 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.291 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.655 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.5 mp0 -62.24 -39.9 94.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.586 177.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 473' ' ' CYS . . . . . 0.59 ' O ' HG12 ' B' ' 477' ' ' ILE . 59.9 m -64.12 -57.71 8.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.356 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.468 HG22 ' HG2' ' A' ' 114' ' ' MET . 85.4 t -52.02 -50.28 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.12 176.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 22.8 ttm180 -66.65 -33.16 75.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.225 -174.359 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -61.23 -45.57 94.01 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 175.701 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.59 HG12 ' O ' ' B' ' 473' ' ' CYS . 9.2 mm -57.95 -63.5 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 121.765 0.793 . . . . 0.0 109.228 178.544 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 478' ' ' ILE . . . . . 0.475 HD12 ' CB ' ' A' ' 118' ' ' ASP . 16.6 mt -56.32 -30.05 29.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.167 -1.379 . . . . 0.0 112.065 -174.39 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 80.7 tttt -60.31 -44.3 95.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.516 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.655 -177.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? . . . . . 0 N--CA 1.454 -0.259 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -88.58 146.95 5.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.545 -176.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.0 m -63.87 144.69 56.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.312 0.577 . . . . 0.0 111.249 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 tt -66.13 -30.39 70.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.107 -0.952 . . . . 0.0 110.156 -176.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -58.79 -36.91 75.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.347 176.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -68.09 -40.06 82.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.0 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.421 HD11 ' HB3' ' B' ' 472' ' ' GLN . 83.7 mt -65.14 -34.49 78.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.439 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.415 ' HA ' ' CE2' ' B' ' 476' ' ' TYR . 10.4 mtpm? -59.1 -25.21 63.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.016 179.561 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -72.29 -16.81 61.91 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.455 ' HB2' ' CE1' ' B' ' 476' ' ' TYR . 93.1 mt -62.01 -51.93 66.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.769 0.318 . . . . 0.0 110.719 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -64.08 -19.3 63.56 Favored Glycine 0 CA--C 1.519 0.34 0 C-N-CA 121.02 -0.61 . . . . 0.0 112.47 176.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -79.3 -16.43 56.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.725 0.298 . . . . 0.0 110.751 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.535 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 31.0 t -83.23 120.07 25.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.06 0.457 . . . . 0.0 111.051 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.96 -27.95 67.04 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.401 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 77.3 m -70.33 -47.38 61.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.884 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.592 HD12 HD11 ' A' ' 104' ' ' LEU . 17.4 tp -65.72 -50.15 65.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.92 -174.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.8 ptp180 -58.09 -25.1 60.91 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.142 -0.223 . . . . 0.0 111.44 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 73.9 m -74.15 -39.35 63.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.592 HD11 HD12 ' A' ' 101' ' ' LEU . 0.7 OUTLIER -87.12 -15.51 38.23 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.908 177.94 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.71 HD21 HD13 ' B' ' 477' ' ' ILE . 7.3 mp -68.95 -4.34 16.3 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.109 0.481 . . . . 0.0 110.774 168.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 97.1 mt -81.95 -11.73 58.73 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.774 177.143 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.575 ' O ' ' HG3' ' A' ' 111' ' ' ARG . 56.4 m-80 -75.88 115.21 44.29 Favored Pre-proline 0 N--CA 1.463 0.192 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 175.104 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.42 -26.3 82.41 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.556 2.171 . . . . 0.0 112.193 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -69.62 -47.09 64.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.261 177.054 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 58.5 tp -64.01 -34.6 78.37 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.343 0.592 . . . . 0.0 110.145 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.575 ' HG3' ' O ' ' A' ' 107' ' ' ASN . 70.5 mtp85 -65.05 -42.47 94.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.679 177.064 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -64.01 -39.79 94.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.062 177.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 84.0 mt -59.04 -48.45 81.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.828 178.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.543 ' HG2' HG22 ' B' ' 474' ' ' VAL . 44.2 mtm -57.77 -53.02 62.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.575 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.572 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.1 m -65.7 -28.86 45.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.714 -175.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -69.14 -46.77 66.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.084 0.469 . . . . 0.0 110.518 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.587 HD11 ' SD ' ' A' ' 127' ' ' MET . 33.8 tp -63.3 -38.94 93.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.861 -178.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.538 ' OD1' ' HG2' ' B' ' 475' ' ' ARG . 9.4 t70 -63.71 -30.34 71.45 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.851 -177.757 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.572 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 74.4 mt-30 -60.09 -29.63 68.71 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.503 0.668 . . . . 0.0 109.819 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.35 18.72 73.65 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 114.62 -1.173 . . . . 0.0 113.902 171.632 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -67.07 -55.36 14.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.202 0.501 . . . . 0.0 110.227 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -133.71 45.22 2.68 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.368 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.596 ' O ' ' HG2' ' A' ' 127' ' ' MET . 0.0 OUTLIER -56.92 -29.5 63.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.462 -178.037 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.45 -38.41 84.08 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.812 0.339 . . . . 0.0 111.412 -177.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.597 ' HD2' ' H ' ' A' ' 125' ' ' LYS . 0.0 OUTLIER -87.4 -33.9 18.95 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.477 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.451 HD22 ' CE2' ' A' ' 130' ' ' TYR . 97.4 mt -60.69 -36.02 77.74 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.729 -179.399 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' MET . . . . . 0.596 ' HG2' ' O ' ' A' ' 123' ' ' LYS . 73.9 mmm -53.6 -43.91 68.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.975 0.417 . . . . 0.0 110.454 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.8 mmm180 -72.44 -38.79 68.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.981 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.89 -24.55 63.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.419 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.451 ' CE2' HD22 ' A' ' 126' ' ' LEU . 2.5 m-30 -88.82 -30.62 18.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.834 0.35 . . . . 0.0 110.699 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 1.3 mmt -68.75 -10.36 56.07 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.503 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.8 pt20 -95.65 -9.65 31.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.87 0.367 . . . . 0.0 110.499 -178.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.573 ' O ' HG23 ' A' ' 137' ' ' VAL . 3.4 mt-10 -91.97 121.88 66.13 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.749 -175.017 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.52 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 18.3 Cg_endo -59.31 -20.19 54.33 Favored 'Trans proline' 0 C--O 1.226 -0.113 0 C-N-CA 122.963 2.442 . . . . 0.0 112.585 -177.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.1 mt -80.33 -41.18 25.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.99 0.424 . . . . 0.0 110.535 178.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -78.59 -32.38 47.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.087 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' ' 133' ' ' GLU . 79.6 t -59.91 -42.01 87.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.781 177.374 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 17.5 mm-40 -69.25 -42.97 74.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.106 178.02 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -58.35 -49.22 77.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.695 178.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.793 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -61.64 -47.43 85.42 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.98 -177.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -63.91 -33.21 75.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.163 0.506 . . . . 0.0 110.263 -178.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' CYS . . . . . 0.445 ' O ' HG13 ' A' ' 146' ' ' ILE . 65.3 m -67.4 -51.46 51.59 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.761 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.451 ' O ' HG22 ' A' ' 147' ' ' VAL . 26.1 p -64.64 -33.15 75.26 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.704 -0.225 . . . . 0.0 111.203 -177.462 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.793 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.5 mt -62.71 -36.92 84.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.934 0.397 . . . . 0.0 110.825 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -77.19 -15.32 81.68 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.355 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 142' ' ' CYS . 67.6 mt -91.71 -38.9 11.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.069 0.462 . . . . 0.0 110.964 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.451 HG22 ' O ' ' A' ' 143' ' ' CYS . 19.3 m -95.57 11.35 4.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.108 -177.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.421 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 2.8 pt-20 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.456 179.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 4.2 mp . . . . . 0 CA--C 1.526 0.032 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -70.5 -39.71 74.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.17 0.51 . . . . 0.0 109.768 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 47.6 t60 -62.48 -51.19 68.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.083 174.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.662 ' O ' HG12 ' B' ' 470' ' ' ILE . 34.5 mt-10 -61.59 -43.67 98.43 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.198 -175.523 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -55.46 -40.08 71.16 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 177.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -31.49 52.85 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -177.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.4 t -63.66 -36.0 74.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.266 175.417 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.662 HG12 ' O ' ' B' ' 466' ' ' GLU . 34.0 mm -60.86 -38.57 79.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.879 176.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 87.2 mt -59.29 -37.06 76.75 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.421 ' HB3' HD11 ' A' ' 92' ' ' LEU . 1.6 mp0 -68.12 -44.23 76.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.689 176.278 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 60.4 m -63.15 -56.1 19.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.104 -177.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.543 HG22 ' HG2' ' A' ' 114' ' ' MET . 73.9 t -48.85 -52.66 9.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.762 176.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.538 ' HG2' ' OD1' ' A' ' 118' ' ' ASP . 88.4 mtm180 -69.68 -23.05 63.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.918 -174.238 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 476' ' ' TYR . . . . . 0.455 ' CE1' ' HB2' ' A' ' 95' ' ' LEU . 0.8 OUTLIER -71.17 -47.36 58.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.969 0.414 . . . . 0.0 110.013 176.559 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.71 HD13 HD21 ' A' ' 105' ' ' LEU . 74.5 mt -64.89 -54.16 33.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.513 -177.222 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 478' ' ' ILE . . . . . 0.431 HD13 ' HA ' ' A' ' 115' ' ' VAL . 50.5 mt -54.39 -26.45 15.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.694 178.35 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 479' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 3.6 ttmp? -70.81 -31.15 67.8 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.908 -173.325 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.551 0 C-N-CA 119.785 -0.766 . . . . 0.0 112.581 175.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.325 0 CA-C-O 121.34 0.591 . . . . 0.0 111.847 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.9 p -107.3 157.82 7.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.467 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.8 m -64.07 147.59 51.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.224 0.535 . . . . 0.0 111.251 -176.608 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.507 HD22 HD12 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -67.68 -31.68 71.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.218 -174.846 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -57.97 -41.13 82.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.369 176.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.433 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 5.3 m-20 -64.41 -40.27 95.46 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.227 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.507 HD12 HD22 ' A' ' 89' ' ' LEU . 83.3 mt -67.71 -36.62 80.96 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.889 -178.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -62.81 -19.06 63.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -79.02 -17.76 54.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.61 0.243 . . . . 0.0 111.034 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.424 HD21 HG13 ' A' ' 147' ' ' VAL . 95.4 mt -61.82 -52.69 63.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.816 0.341 . . . . 0.0 111.327 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -64.27 -22.81 67.63 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.794 -176.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -97.38 -15.31 20.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.275 0.537 . . . . 0.0 111.576 -175.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.51 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 68.3 m -71.8 116.11 11.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.469 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.51 -29.06 65.99 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.707 -174.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 18.7 m -68.79 -48.54 63.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.958 0.409 . . . . 0.0 110.902 -178.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.406 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 41.9 tp -68.88 -48.05 64.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.668 -172.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.575 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 7.8 ptp180 -60.3 -28.38 68.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.479 -178.763 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 71.1 m -66.69 -25.63 66.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.99 0.424 . . . . 0.0 110.789 177.523 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.441 ' O ' HD23 ' A' ' 110' ' ' LEU . 22.6 mt -81.48 -33.26 32.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.406 HD21 HD13 ' B' ' 477' ' ' ILE . 11.0 mp -67.48 -12.68 60.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.531 177.439 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 70.3 mt -77.54 -8.0 57.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.348 177.689 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 108' ' ' PRO . 88.3 m-20 -84.21 115.01 58.17 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.705 176.099 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 107' ' ' ASN . 50.0 Cg_exo -54.33 -36.65 87.6 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.451 2.767 . . . . 0.0 113.373 -175.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 60.3 t60 -69.15 -45.01 71.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.594 0.235 . . . . 0.0 110.866 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 104' ' ' LEU . 49.8 tp -62.12 -38.2 88.03 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.132 0.491 . . . . 0.0 109.999 -178.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.42 ' O ' HG22 ' A' ' 115' ' ' VAL . 58.7 mtp180 -56.11 -49.79 72.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.048 174.634 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -63.04 -24.16 67.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.924 -179.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 77.4 mt -78.6 -53.24 7.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -177.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' MET . . . . . 0.578 ' HG3' HG13 ' B' ' 474' ' ' VAL . 42.0 ttp -61.28 -42.21 98.27 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.367 -1.288 . . . . 0.0 111.58 -177.29 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 111' ' ' ARG . 26.3 m -72.95 -28.88 27.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.38 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -62.59 -46.2 89.37 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.145 0.497 . . . . 0.0 110.652 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.1 tp -56.46 -33.89 66.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.399 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -65.92 -32.27 73.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.564 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.66 -29.04 69.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.54 0.686 . . . . 0.0 110.553 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 71.94 19.04 78.06 Favored Glycine 0 C--N 1.322 -0.248 0 CA-C-N 114.89 -1.05 . . . . 0.0 113.775 172.16 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -70.07 -56.01 8.02 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.988 0.423 . . . . 0.0 110.076 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.599 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 20.4 m-20 -123.52 41.37 3.49 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.468 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.85 -33.16 48.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.026 -177.138 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.55 -38.99 65.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.156 0.503 . . . . 0.0 110.896 -177.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.6 mtpt -79.08 -38.84 35.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.502 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 89.6 mt -61.79 -39.09 90.48 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.962 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.88 -35.85 58.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.872 0.368 . . . . 0.0 111.326 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -84.1 -45.43 13.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.227 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.696 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -64.09 -31.96 73.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.749 -177.403 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.553 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 5.2 m-30 -72.39 -22.49 61.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.151 0.5 . . . . 0.0 110.411 -178.022 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' MET . . . . . 0.58 ' HE2' HG12 ' A' ' 137' ' ' VAL . 1.6 mmt -85.74 1.39 49.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.995 -178.432 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.696 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 17.7 pt20 -101.19 -14.13 17.84 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 175.056 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -91.13 120.03 68.64 Favored Pre-proline 0 N--CA 1.451 -0.388 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.331 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.709 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 29.0 Cg_endo -62.6 -13.61 34.71 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.98 2.453 . . . . 0.0 112.32 -179.107 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 86.9 mt -83.52 -32.29 25.98 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.07 178.372 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.553 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 47.4 t80 -90.43 -34.36 15.65 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.303 -177.487 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.709 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 8.6 m -57.11 -46.16 84.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.414 178.007 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.457 ' N ' HG23 ' A' ' 137' ' ' VAL . 5.7 mm-40 -62.31 -43.93 97.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.45 177.07 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -55.1 -49.74 70.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.818 175.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.756 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.81 -47.99 81.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.946 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -61.82 -33.45 74.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.4 0.619 . . . . 0.0 110.524 -176.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.6 m -76.8 -40.92 46.45 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.49 -177.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' CYS . . . . . 0.514 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -73.07 -29.47 62.98 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.607 -177.69 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.4 mt -60.52 -44.09 96.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.604 178.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.38 -20.68 69.78 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.333 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 56.6 mt -87.85 -30.48 5.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.842 0.353 . . . . 0.0 110.568 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.433 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 23.2 m -102.31 8.98 9.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -176.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 42.6 mm-40 . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 120.644 0.259 . . . . 0.0 110.725 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 59.8 mt . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.492 0.187 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -58.66 -42.12 87.67 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 27.9 t-80 -65.96 -46.78 76.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.06 177.095 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 466' ' ' GLU . . . . . 0.598 ' O ' HG12 ' B' ' 470' ' ' ILE . 6.1 mm-40 -56.01 -50.22 71.5 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.059 -178.081 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 36.2 mtm180 -65.26 -33.08 75.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.618 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.05 -31.44 62.87 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.723 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.4 t -66.13 -36.32 77.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.223 174.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 470' ' ' ILE . . . . . 0.598 HG12 ' O ' ' B' ' 466' ' ' GLU . 43.2 mm -61.1 -35.96 69.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.201 176.504 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 471' ' ' LEU . . . . . 0.469 ' O ' ' HG3' ' B' ' 475' ' ' ARG . 93.3 mt -56.44 -48.48 76.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.12 176.605 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 472' ' ' GLN . . . . . 0.442 ' HB3' HD11 ' A' ' 92' ' ' LEU . 2.0 mp0 -59.46 -40.47 86.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.039 177.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.0 m -61.84 -55.47 29.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.976 0.417 . . . . 0.0 110.055 178.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 474' ' ' VAL . . . . . 0.578 HG13 ' HG3' ' A' ' 114' ' ' MET . 45.8 t -51.75 -50.42 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.597 177.376 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 475' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' B' ' 471' ' ' LEU . 82.8 mtp180 -64.47 -39.0 92.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.286 -175.607 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 476' ' ' TYR . . . . . 0.419 ' O ' ' HG3' ' B' ' 480' ' ' LYS . 0.9 OUTLIER -67.72 -45.84 73.88 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 120.867 0.365 . . . . 0.0 110.502 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 477' ' ' ILE . . . . . 0.406 HD13 HD21 ' A' ' 105' ' ' LEU . 97.5 mt -63.97 -60.54 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.434 -175.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 56.3 mt -53.65 -28.1 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.763 0.316 . . . . 0.0 111.326 -178.127 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -76.45 -32.55 58.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.078 -173.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 480' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.612 0 C-N-CA 120.02 -0.672 . . . . 0.0 112.108 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.839 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.54 ' HA ' ' OD1' ' A' ' 85' ' ' ASP . 7.6 Cg_exo -73.1 65.12 4.24 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.39 2.727 . . . . 0.0 112.577 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 -89.75 -55.11 3.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.799 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 22.7 ptp -88.83 8.94 26.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.224 0.535 . . . . 0.0 110.315 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.54 ' OD1' ' HA ' ' A' ' 82' ' ' PRO . 8.8 m-20 -78.76 -13.5 59.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.653 171.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 -90.52 132.6 35.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.417 -0.811 . . . . 0.0 109.784 177.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.508 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 38.3 t -89.01 143.59 10.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.069 -173.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.0 m -75.84 142.98 42.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.929 176.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.9 mt -55.24 -31.56 61.6 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.208 -0.906 . . . . 0.0 113.138 -173.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -53.31 -51.05 63.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.946 0.403 . . . . 0.0 110.816 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.485 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 6.2 m-20 -63.81 -35.83 81.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.717 -178.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 84.7 mt -72.66 -39.37 67.18 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.448 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.522 ' HA ' ' CZ ' ' B' ' 476' ' ' TYR . 97.3 mttt -66.94 -26.34 66.79 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.929 0.395 . . . . 0.0 110.985 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -69.99 -17.69 63.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.994 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.496 HD21 HG13 ' A' ' 147' ' ' VAL . 73.4 mt -65.14 -46.88 79.12 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.917 0.389 . . . . 0.0 110.409 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.39 -20.12 71.26 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.578 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -84.59 -23.87 29.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.849 0.357 . . . . 0.0 110.434 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.624 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 43.7 t -70.91 115.42 10.03 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.095 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.11 -30.05 67.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.173 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.9 m -72.99 -45.18 59.38 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.984 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.2 tt -74.3 -44.4 52.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.899 -172.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 98' ' ' SER . 2.8 ptp180 -56.99 -32.27 65.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.95 178.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.502 ' HA ' HD23 ' A' ' 106' ' ' LEU . 71.3 m -68.89 -18.06 64.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.864 0.364 . . . . 0.0 111.275 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 139' ' ' PHE . 17.2 mt -78.08 -33.7 50.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.105 0.479 . . . . 0.0 109.718 178.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -63.2 -18.05 63.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.193 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.502 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.4 mm? -68.94 -10.79 59.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.358 178.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -86.13 118.86 71.15 Favored Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -62.08 -26.64 78.37 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.98 2.453 . . . . 0.0 112.615 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -76.29 -46.65 26.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.913 0.387 . . . . 0.0 110.165 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.427 HD11 ' HB2' ' A' ' 139' ' ' PHE . 3.9 tt -62.04 -42.81 99.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.267 -176.638 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 8.9 ptp180 -67.21 -31.04 71.15 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.828 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -70.37 -38.61 74.8 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.659 -0.246 . . . . 0.0 110.366 176.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.437 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 81.3 mt -57.36 -50.92 71.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.159 0.504 . . . . 0.0 109.929 174.196 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.451 ' HG2' HG22 ' B' ' 474' ' ' VAL . 62.2 mtp -52.01 -57.0 10.81 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.72 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.715 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 27.4 m -64.04 -36.28 76.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.729 -176.277 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -64.6 -47.69 77.68 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.018 0.437 . . . . 0.0 110.927 178.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 62.3 tp -60.93 -40.35 92.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.058 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -66.4 -41.07 89.87 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.685 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.715 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 71.8 mt-30 -64.1 -28.31 69.69 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.595 0.712 . . . . 0.0 110.27 -178.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 75.69 31.45 56.21 Favored Glycine 0 N--CA 1.444 -0.815 0 CA-C-N 114.687 -1.142 . . . . 0.0 113.703 168.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -51.43 -42.25 61.39 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.059 0.457 . . . . 0.0 109.958 178.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.496 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 10.1 t70 -162.72 72.81 0.34 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 170.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.708 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.6 OUTLIER -53.76 -26.53 23.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.99 178.903 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.31 -54.69 43.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.411 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -25.95 27.25 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.291 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.55 HD22 ' CE2' ' A' ' 130' ' ' TYR . 95.4 mt -62.48 -43.36 99.01 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.438 178.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.575 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.4 OUTLIER -57.2 -28.49 62.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.921 0.391 . . . . 0.0 111.432 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -84.42 -49.16 8.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.922 0.391 . . . . 0.0 110.509 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.475 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -67.96 -16.35 64.02 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.302 -176.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.55 ' CE2' HD22 ' A' ' 126' ' ' LEU . 3.0 m-30 -88.78 -23.26 22.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.734 0.302 . . . . 0.0 111.722 -179.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -84.09 -0.18 50.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.085 0.469 . . . . 0.0 111.03 -176.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.475 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.5 pt20 -101.81 -16.22 16.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.963 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.43 ' O ' HG23 ' A' ' 137' ' ' VAL . 2.4 mt-10 -93.65 118.77 67.51 Favored Pre-proline 0 N--CA 1.449 -0.505 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.713 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 12.1 Cg_endo -55.54 -25.87 51.72 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.072 2.515 . . . . 0.0 112.658 -173.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.6 mt -66.64 -45.23 79.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.964 0.411 . . . . 0.0 110.658 -178.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.425 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 37.0 t80 -76.88 -29.06 55.63 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 -177.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 133' ' ' GLU . 75.2 t -62.9 -42.56 96.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.292 176.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.713 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 33.8 mm-40 -60.64 -46.66 89.47 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.895 0.379 . . . . 0.0 110.016 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' PHE . . . . . 0.509 ' HA ' ' CD1' ' A' ' 104' ' ' LEU . 77.1 t80 -59.57 -47.39 85.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.771 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.775 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.74 -47.22 84.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.185 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -67.94 -27.37 66.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.12 0.486 . . . . 0.0 110.395 -176.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 69.7 m -75.71 -44.17 43.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.407 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 27.6 p -69.74 -30.61 68.25 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.816 -176.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 86.1 mt -59.27 -48.12 82.82 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.966 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.42 -21.65 66.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.634 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 54.6 mt -91.02 -32.66 5.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.568 0.223 . . . . 0.0 111.361 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.496 HG13 HD21 ' A' ' 95' ' ' LEU . 14.9 m -102.53 -16.88 7.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -174.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -84.27 113.85 51.01 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-O 120.737 0.303 . . . . 0.0 111.571 -178.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 88.4 Cg_endo -81.78 -8.66 12.26 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.432 2.088 . . . . 0.0 110.401 171.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 2.2 m -65.93 114.93 5.5 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.681 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -72.8 163.15 28.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.299 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -85.99 66.22 9.48 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 121.59 0.709 . . . . 0.0 110.336 -178.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 51.12 -94.37 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 113.707 -1.588 . . . . 0.0 112.848 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -128.08 26.73 5.75 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.397 -176.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 44.6 m . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.669 -0.682 . . . . 0.0 110.519 178.569 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 11.3 t70 . . . . . 0 N--CA 1.482 1.129 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 41.0 mm -63.27 -30.67 50.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.22 -172.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -60.72 -41.36 95.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.572 0.701 . . . . 0.0 109.448 177.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -75.71 -49.38 18.46 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.805 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.548 ' O ' HG12 ' B' ' 470' ' ' ILE . 45.6 mt-10 -57.66 -47.93 80.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.171 -173.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 467' ' ' ARG . . . . . 0.575 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 78.3 mtm180 -60.37 -35.49 75.83 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -177.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.98 -31.22 58.88 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.99 -35.37 73.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.323 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.548 HG12 ' O ' ' B' ' 466' ' ' GLU . 24.6 mm -61.84 -35.92 70.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.101 177.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 86.8 mt -60.46 -38.02 82.85 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.829 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.508 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 1.8 mp0 -68.15 -41.11 82.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.877 0.37 . . . . 0.0 110.579 177.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.1 m -63.96 -56.11 17.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.806 -178.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.451 HG22 ' HG2' ' A' ' 114' ' ' MET . 82.7 t -52.3 -51.06 34.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.971 178.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 32.3 ttm180 -66.37 -33.33 75.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.492 -172.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 476' ' ' TYR . . . . . 0.522 ' CZ ' ' HA ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -63.72 -46.89 83.37 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.097 0.475 . . . . 0.0 109.948 176.91 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 75.6 mt -64.12 -51.02 74.17 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.511 -176.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.447 HG13 ' O ' ' B' ' 474' ' ' VAL . 40.5 mt -58.21 -23.68 22.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.96 0.41 . . . . 0.0 110.918 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.538 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 20.7 tptp -74.73 -35.31 62.66 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.254 -175.205 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.03 -16.11 11.67 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 119.916 -0.714 . . . . 0.0 112.406 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -91.96 -60.5 1.84 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.07 0.462 . . . . 0.0 111.963 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -90.33 -77.85 0.39 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.525 -167.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -110.18 -48.71 3.15 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.555 -171.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.538 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 80.28 13.07 82.42 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.693 -178.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 2.3 pp -69.67 160.79 30.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.175 0.512 . . . . 0.0 112.127 -175.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -127.99 65.2 1.37 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.903 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 21.9 p -82.52 -28.02 31.33 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.927 -178.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -84.77 72.71 10.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.627 -177.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 32.3 t -140.18 152.16 45.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.984 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -85.06 75.59 10.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.343 0.592 . . . . 0.0 110.252 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -89.99 8.28 33.24 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.749 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 28.5 t -73.77 122.68 22.79 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.15 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -98.55 21.48 11.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.216 0.531 . . . . 0.0 110.661 -179.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -76.89 -32.74 57.66 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.108 177.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 60.1 t . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.635 -0.698 . . . . 0.0 110.531 179.094 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 111.669 -0.573 . . . . 0.0 111.669 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.429 ' HA ' ' OD1' ' A' ' 85' ' ' ASP . 37.2 Cg_endo -66.9 99.53 0.47 Allowed 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.662 2.241 . . . . 0.0 112.304 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -168.09 -75.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.428 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 15.7 tpt -95.56 2.59 54.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.738 0.78 . . . . 0.0 109.93 -177.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.429 ' OD1' ' HA ' ' A' ' 82' ' ' PRO . 20.8 p-10 -88.87 12.85 14.08 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.055 -177.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -58.07 131.65 51.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.25 174.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.423 HG21 HG13 ' B' ' 469' ' ' VAL . 46.5 t -68.99 130.53 34.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.059 -176.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.5 m -67.89 156.8 36.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.049 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.617 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -59.48 -42.07 91.24 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 -176.671 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 28.5 pt20 -52.94 -38.29 61.84 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.99 0.424 . . . . 0.0 111.249 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.428 HD21 ' HA ' ' A' ' 149' ' ' PRO . 5.6 m-20 -80.46 -17.76 50.72 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.176 -177.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.416 ' HA ' HD13 ' A' ' 95' ' ' LEU . 84.2 mt -86.8 -35.35 19.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.316 176.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.617 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 53.2 mtpt -54.47 -37.1 64.84 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -175.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.84 -17.07 62.17 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -175.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 92' ' ' LEU . 9.6 mp -60.3 -48.7 80.63 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -66.81 -21.46 71.26 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.263 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -85.09 -23.25 28.59 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.97 0.414 . . . . 0.0 110.609 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.646 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 42.6 t -65.68 118.21 9.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.259 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.62 -27.24 68.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.265 -177.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 80.2 m -75.12 -43.2 54.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.062 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 20.0 tp -75.64 -44.29 43.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.763 -171.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.646 ' HG2' ' O ' ' A' ' 98' ' ' SER . 7.6 ptp180 -58.91 -30.68 67.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.062 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.1 m -65.47 -24.86 67.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.029 0.443 . . . . 0.0 110.876 177.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.9 mt -83.63 -32.63 25.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.824 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.48 -21.96 66.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.457 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 74.6 mt -71.63 -13.15 61.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.848 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -81.37 113.94 45.53 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.928 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.504 ' HA ' ' NE ' ' A' ' 111' ' ' ARG . 48.9 Cg_exo -56.06 -37.02 96.92 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.088 2.526 . . . . 0.0 113.388 -177.012 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.503 ' CD2' HD22 ' A' ' 135' ' ' LEU . 47.7 t60 -69.27 -41.39 76.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.044 0.449 . . . . 0.0 110.384 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.515 HD11 ' HB2' ' A' ' 139' ' ' PHE . 2.5 tt -64.71 -46.64 81.45 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.985 -177.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.504 ' NE ' ' HA ' ' A' ' 108' ' ' PRO . 16.3 ptt180 -68.15 -28.47 67.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.872 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -44.32 95.85 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.168 0.508 . . . . 0.0 109.737 173.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.86 -47.25 85.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.183 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.472 ' HG2' HG22 ' B' ' 474' ' ' VAL . 51.1 mtp -56.7 -50.79 71.11 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.208 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.61 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.2 m -65.4 -32.27 57.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.861 -0.335 . . . . 0.0 111.136 -178.066 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -65.94 -41.27 91.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.054 0.454 . . . . 0.0 110.704 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.447 HD11 ' SD ' ' A' ' 127' ' ' MET . 32.9 tp -68.14 -37.38 80.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.759 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.446 ' OD1' HG21 ' B' ' 478' ' ' ILE . 36.7 t70 -64.29 -29.57 70.65 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.778 0.323 . . . . 0.0 111.472 -177.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.61 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 68.4 mt-30 -63.53 -28.37 69.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.375 0.607 . . . . 0.0 110.721 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.27 27.78 72.8 Favored Glycine 0 CA--C 1.516 0.154 0 CA-C-N 114.832 -1.076 . . . . 0.0 114.106 170.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -85.0 -53.79 5.06 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.177 0.513 . . . . 0.0 110.29 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -124.04 33.45 5.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.527 -176.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.676 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -45.77 -38.27 6.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.847 -1.069 . . . . 0.0 112.08 177.023 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.16 -41.5 79.33 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 121.01 0.433 . . . . 0.0 111.527 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -85.4 -36.36 20.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.523 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.44 HD22 ' CE1' ' A' ' 130' ' ' TYR . 96.2 mt -57.48 -42.48 82.69 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.63 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.62 ' HG2' ' O ' ' A' ' 123' ' ' LYS . 69.4 mmm -53.16 -39.63 63.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.902 0.382 . . . . 0.0 110.768 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 -70.74 -48.9 52.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.307 0.575 . . . . 0.0 110.208 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.605 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -70.64 -19.45 62.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.221 -0.9 . . . . 0.0 112.328 -174.23 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.57 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.5 m-30 -85.47 -26.22 26.43 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.84 0.352 . . . . 0.0 110.618 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.466 ' HE2' HG12 ' A' ' 137' ' ' VAL . 19.2 mmt -80.75 0.54 34.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.202 -179.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.605 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.6 pt20 -105.73 -5.15 20.17 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.864 0.364 . . . . 0.0 110.296 177.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.401 ' O ' HG22 ' A' ' 137' ' ' VAL . 2.3 mt-10 -106.23 121.41 45.56 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.481 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.705 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 23.8 Cg_endo -61.42 -13.12 27.29 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.298 2.665 . . . . 0.0 113.085 -176.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.503 HD22 ' CD2' ' A' ' 109' ' ' HIS . 6.8 mp -77.3 -40.34 44.69 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.135 177.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.57 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 40.4 t80 -89.06 -33.16 17.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.105 0.479 . . . . 0.0 110.229 -172.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.705 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 9.5 m -58.31 -47.73 86.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.385 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.465 ' N ' HG23 ' A' ' 137' ' ' VAL . 10.8 pt-20 -67.63 -34.96 78.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.775 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' PHE . . . . . 0.515 ' HB2' HD11 ' A' ' 110' ' ' LEU . 45.3 t80 -58.06 -49.6 76.33 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 173.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.764 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -61.23 -46.42 90.48 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.73 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.49 -32.24 72.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.379 0.609 . . . . 0.0 110.885 -176.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 95.2 m -82.71 -38.42 23.35 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.093 -176.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.476 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 25.7 p -73.65 -27.02 61.04 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.246 -176.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.764 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 93.6 mt -60.06 -38.23 82.21 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.098 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -71.87 -16.81 76.52 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.387 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 25.1 mt -91.26 -28.77 4.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.729 0.299 . . . . 0.0 110.896 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 31.0 m -96.7 2.61 10.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -57.04 111.82 3.83 Favored Pre-proline 0 N--CA 1.465 0.296 0 C-N-CA 121.127 -0.229 . . . . 0.0 110.484 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' PRO . . . . . 0.428 ' HA ' HD21 ' A' ' 91' ' ' ASN . 55.6 Cg_endo -71.12 -20.45 28.57 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.456 2.104 . . . . 0.0 111.782 -178.07 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 14.7 m -88.94 91.19 8.73 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.055 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -106.3 22.42 15.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.291 0.567 . . . . 0.0 109.831 177.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -65.73 123.86 20.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.762 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -70.24 147.11 50.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.404 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 61.31 40.96 13.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.964 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 25.7 p . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.647 179.473 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 8.4 t70 . . . . . 0 N--CA 1.482 1.169 0 CA-C-O 120.979 0.418 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 57.6 mt -68.03 -33.95 64.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.63 -171.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -57.56 -45.71 84.81 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.469 0.652 . . . . 0.0 109.287 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 63.8 t60 -67.7 -55.87 11.51 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.499 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.479 ' O ' ' HB ' ' B' ' 469' ' ' VAL . 38.4 mt-10 -56.68 -46.5 81.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.588 -172.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -74.12 -28.47 61.36 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.363 -175.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -27.02 48.62 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 469' ' ' VAL . . . . . 0.479 ' HB ' ' O ' ' B' ' 466' ' ' GLU . 2.4 t -61.23 -33.96 58.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.606 173.01 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.418 HG12 ' O ' ' B' ' 466' ' ' GLU . 30.1 mm -65.4 -28.07 43.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.797 -178.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.81 -29.91 70.47 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.124 0.487 . . . . 0.0 110.344 177.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -81.27 -40.59 23.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.01 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 61.2 m -62.09 -56.85 14.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.816 -177.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.687 ' O ' HG12 ' B' ' 478' ' ' ILE . 88.5 t -54.12 -50.57 54.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.402 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -64.69 -36.89 85.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.984 -171.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -43.78 88.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.24 0.543 . . . . 0.0 109.743 175.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.504 ' O ' ' HD3' ' B' ' 480' ' ' LYS . 78.1 mt -65.91 -53.84 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.227 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.757 HG22 ' H ' ' B' ' 484' ' ' GLY . 8.0 mm -54.5 -31.64 23.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.702 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.521 ' HA ' ' CA ' ' B' ' 484' ' ' GLY . 45.6 tptt -55.08 -39.69 69.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.63 -174.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 480' ' ' LYS . . . . . 0.504 ' HD3' ' O ' ' B' ' 477' ' ' ILE . 0.0 OUTLIER -113.3 -9.15 13.44 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.019 178.501 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.66 -60.78 1.85 Allowed 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 482' ' ' PHE . . . . . 0.603 ' HB2' HG23 ' B' ' 478' ' ' ILE . 92.9 m-85 -115.41 -86.08 0.61 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 119.791 -0.763 . . . . 0.0 112.908 -174.008 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 483' ' ' PHE . . . . . 0.543 ' H ' HG22 ' B' ' 478' ' ' ILE . 73.6 m-85 -108.07 -50.77 2.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.517 0.199 . . . . 0.0 111.256 -171.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.757 ' H ' HG22 ' B' ' 478' ' ' ILE . . . 77.21 45.62 11.24 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.518 -0.849 . . . . 0.0 111.481 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 92.2 mt -70.45 162.38 28.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.246 0.546 . . . . 0.0 111.175 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -121.62 -21.01 6.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.648 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 54.1 p 52.03 25.1 2.97 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 114.869 -1.06 . . . . 0.0 112.886 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -95.21 5.72 51.01 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.108 0.48 . . . . 0.0 110.414 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 9.8 m -59.32 127.25 31.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.682 178.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -80.13 -14.01 58.82 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.268 0.556 . . . . 0.0 111.038 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -89.17 20.4 3.74 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.341 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 24.5 t -140.43 112.55 7.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.238 177.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -70.46 118.91 13.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.976 0.417 . . . . 0.0 110.552 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -75.23 -37.2 61.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.75 -178.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 6.0 m . . . . . 0 C--O 1.249 1.048 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.086 -179.21 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.767 0 N-CA-C 111.625 -0.59 . . . . 0.0 111.625 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.49 45.79 1.68 Allowed 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 122.917 2.412 . . . . 0.0 112.707 -177.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -131.27 17.55 4.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.436 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 47.1 ttp 55.38 45.85 24.55 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.678 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -71.81 -24.06 61.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.403 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -111.82 155.21 23.93 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.144 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.655 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 26.0 t -110.12 145.26 16.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.109 -176.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.0 m -62.56 142.16 58.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.072 0.463 . . . . 0.0 110.819 178.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.452 HD22 HD12 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -59.29 -33.18 70.76 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.548 -176.416 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -58.13 -40.86 82.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.791 177.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.423 ' HB2' HG12 ' A' ' 87' ' ' VAL . 3.5 m-20 -65.78 -42.92 90.21 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.589 ' HA ' HD13 ' A' ' 95' ' ' LEU . 83.7 mt -66.61 -34.64 78.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.845 -175.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -56.23 -32.95 64.94 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -66.18 -24.59 66.66 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.813 0.339 . . . . 0.0 111.702 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.589 HD13 ' HA ' ' A' ' 92' ' ' LEU . 7.5 mp -64.69 -38.03 89.61 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.768 0.318 . . . . 0.0 111.065 -175.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.56 -26.22 71.83 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.67 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -100.71 4.41 43.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.147 0.499 . . . . 0.0 110.856 -178.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.512 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 71.1 m -84.93 107.24 16.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.172 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.39 -29.95 69.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.242 -177.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.2 m -70.64 -39.73 73.49 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 -177.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.465 HD11 ' CD2' ' A' ' 139' ' ' PHE . 40.8 tp -74.73 -48.64 24.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.387 -176.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.512 ' HG2' ' O ' ' A' ' 98' ' ' SER . 4.5 ptp180 -61.39 -27.29 68.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.109 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.5 t -64.16 -23.91 67.49 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.13 0.491 . . . . 0.0 110.148 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.1 mt -87.51 -33.38 18.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.194 178.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.506 HD21 HD13 ' B' ' 477' ' ' ILE . 11.1 mp -69.86 -6.69 34.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.834 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 58.9 mt -67.93 -14.67 63.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.419 176.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -84.37 121.52 75.2 Favored Pre-proline 0 C--O 1.235 0.325 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.934 175.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.06 -29.91 90.3 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.884 2.389 . . . . 0.0 112.796 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 65.1 t60 -70.49 -44.61 67.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.736 0.303 . . . . 0.0 110.8 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.44 ' O ' HD23 ' A' ' 110' ' ' LEU . 4.3 tt -61.57 -42.14 98.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.221 0.534 . . . . 0.0 110.067 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -70.56 -32.73 70.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.281 -178.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -66.47 -37.54 85.33 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.63 175.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 76.1 mt -55.06 -51.26 66.89 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.47 ' HB3' HD11 ' B' ' 478' ' ' ILE . 49.5 mtm -53.77 -54.62 35.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 71.7 t -57.03 -39.49 66.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.544 -178.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -65.21 -41.37 94.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.464 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.515 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 54.9 tp -71.19 -31.98 68.3 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.258 -178.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.495 ' OD1' ' HB2' ' B' ' 485' ' ' LEU . 14.1 t70 -61.07 -38.9 87.86 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.954 -178.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -60.35 -29.37 68.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.557 0.694 . . . . 0.0 111.165 -177.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 66.13 21.31 69.85 Favored Glycine 0 N--CA 1.451 -0.367 0 CA-C-N 114.647 -1.161 . . . . 0.0 113.448 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -72.36 -34.24 67.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.324 0.583 . . . . 0.0 110.297 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.441 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 22.1 p-10 -145.38 40.07 1.2 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.384 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.599 ' N ' ' HD3' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.04 -33.91 5.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.471 -1.24 . . . . 0.0 112.144 177.735 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.7 -52.1 66.54 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.509 -175.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 122' ' ' ASP . 0.2 OUTLIER -76.24 -34.57 59.19 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.359 179.9 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.527 HD22 ' CE1' ' A' ' 130' ' ' TYR . 89.2 mt -58.32 -44.34 88.59 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.462 -178.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.58 -35.07 60.42 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.932 0.396 . . . . 0.0 111.103 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -84.21 -41.38 17.03 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.684 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -71.1 -17.07 62.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.027 -176.186 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.527 ' CE1' HD22 ' A' ' 126' ' ' LEU . 3.8 m-30 -87.58 -28.26 22.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.944 0.402 . . . . 0.0 110.857 179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.545 ' HE2' HG12 ' A' ' 137' ' ' VAL . 4.0 mmt -80.89 5.2 16.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.322 -177.018 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.517 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 28.4 pt20 -104.03 -7.95 19.92 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 176.084 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -103.03 126.24 32.99 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.403 -176.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.711 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 30.4 Cg_endo -63.59 -14.28 41.65 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.904 2.403 . . . . 0.0 112.516 -178.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.2 mp -73.46 -44.08 58.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.771 0.32 . . . . 0.0 110.416 176.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.418 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 36.9 t80 -88.8 -29.87 19.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.111 0.481 . . . . 0.0 110.126 -170.198 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.711 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 18.6 m -59.7 -48.59 86.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.786 177.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.511 ' N ' HG23 ' A' ' 137' ' ' VAL . 36.7 mt-10 -62.24 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.367 176.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' PHE . . . . . 0.465 ' CD2' HD11 ' A' ' 101' ' ' LEU . 61.8 t80 -54.06 -49.18 69.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.695 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.672 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.72 -47.35 81.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.935 178.023 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -61.1 -31.25 70.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.506 0.67 . . . . 0.0 110.493 -176.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.426 ' O ' HG13 ' A' ' 146' ' ' ILE . 78.2 m -77.96 -50.14 12.74 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.532 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -65.88 -29.72 70.21 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.551 0.215 . . . . 0.0 111.298 -175.013 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 57.7 mt -66.57 -23.31 66.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.765 0.316 . . . . 0.0 110.745 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -86.55 -14.67 65.27 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.063 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 142' ' ' CYS . 25.4 mt -91.86 -31.62 4.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.858 0.361 . . . . 0.0 110.906 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.458 ' HB ' HG11 ' A' ' 87' ' ' VAL . 23.0 m -106.8 4.95 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -177.231 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.402 ' HG3' ' H ' ' A' ' 148' ' ' GLU . 0.0 OUTLIER -50.48 129.26 25.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.862 0.839 . . . . 0.0 113.202 -172.801 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -83.37 -2.1 10.46 Favored 'Trans proline' 0 N--CA 1.459 -0.548 0 C-N-CA 123.046 2.497 . . . . 0.0 111.294 174.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 43.3 t -138.72 112.11 8.14 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.867 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -82.66 6.56 17.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.734 0.778 . . . . 0.0 110.167 177.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -115.38 21.75 13.81 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.671 -1.149 . . . . 0.0 109.317 176.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 58.62 -171.23 0.11 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.035 -178.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -135.4 71.52 1.43 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.287 178.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 48.3 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.498 -0.763 . . . . 0.0 110.627 -178.292 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 12.0 t70 . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.805 0.336 . . . . 0.0 110.122 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 463' ' ' ILE . . . . . 0.574 ' O ' ' HB2' ' B' ' 467' ' ' ARG . 42.4 mm -63.14 -34.38 66.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.397 -174.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -60.66 -47.63 85.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.074 0.464 . . . . 0.0 110.3 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -71.81 -43.51 65.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.187 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.533 ' O ' HG12 ' B' ' 470' ' ' ILE . 49.2 mt-10 -69.78 -22.96 63.29 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.016 -174.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 467' ' ' ARG . . . . . 0.574 ' HB2' ' O ' ' B' ' 463' ' ' ILE . 30.8 ttp180 -62.94 -42.74 99.91 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.188 0.595 . . . . 0.0 111.301 177.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -80.41 -18.38 49.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.405 0.621 . . . . 0.0 109.884 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 469' ' ' VAL . . . . . 0.515 ' HB ' ' HA ' ' B' ' 466' ' ' GLU . 2.1 t -67.35 -32.0 55.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.386 171.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.533 HG12 ' O ' ' B' ' 466' ' ' GLU . 32.5 mm -60.14 -31.87 49.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.565 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 471' ' ' LEU . . . . . 0.539 ' O ' ' HG3' ' B' ' 475' ' ' ARG . 85.9 mt -53.9 -44.13 70.24 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.823 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.655 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.8 mp0 -64.8 -41.51 95.75 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.461 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 38.1 m -61.56 -53.28 58.46 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.226 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.476 ' O ' HG13 ' B' ' 478' ' ' ILE . 78.6 t -51.78 -57.78 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.881 176.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.539 ' HG3' ' O ' ' B' ' 471' ' ' LEU . 43.0 mtp180 -73.9 -20.24 60.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.326 -0.397 . . . . 0.0 112.039 -169.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.42 -46.16 70.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.033 0.444 . . . . 0.0 109.967 174.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.506 HD13 HD21 ' A' ' 105' ' ' LEU . 74.8 mt -65.36 -54.6 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.034 -178.381 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.614 HG22 ' H ' ' B' ' 484' ' ' GLY . 53.5 mt -53.43 -31.57 19.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.967 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.606 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 22.7 tptm -56.56 -48.43 77.37 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.275 -174.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.17 -10.91 13.83 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.77 -175.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 481' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' B' ' 477' ' ' ILE . 1.3 m-20 -89.6 -52.29 5.09 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 178.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -110.11 -88.38 0.5 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -172.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -111.65 -50.19 2.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.895 0.379 . . . . 0.0 111.217 -172.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.614 ' H ' HG22 ' B' ' 478' ' ' ILE . . . 71.63 51.07 17.31 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.472 -0.87 . . . . 0.0 111.565 -174.443 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.495 ' HB2' ' OD1' ' A' ' 118' ' ' ASP . 85.4 mt -71.78 141.83 49.7 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.849 0.357 . . . . 0.0 110.431 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -143.41 -27.03 0.56 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.889 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 9.0 t -99.78 -6.59 26.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.713 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 488' ' ' ASN . . . . . 0.458 ' HA ' ' HD3' ' B' ' 491' ' ' LYS . 0.9 OUTLIER -95.74 -5.34 42.29 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.716 -0.394 . . . . 0.0 111.021 -178.298 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 16.1 p -108.29 133.95 51.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.259 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . 60.83 34.6 19.65 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.463 0.649 . . . . 0.0 110.455 -178.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 491' ' ' LYS . . . . . 0.458 ' HD3' ' HA ' ' B' ' 488' ' ' ASN . 21.6 pttm -85.53 37.56 0.7 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.331 -177.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 8.9 t -81.7 54.64 2.45 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.235 0.541 . . . . 0.0 110.169 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -83.42 67.21 9.24 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.057 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -81.18 88.73 6.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.853 -175.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 40.3 t . . . . . 0 C--O 1.25 1.097 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.411 177.951 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.675 0 N-CA-C 112.198 -0.361 . . . . 0.0 112.198 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.48 -28.09 83.07 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.004 2.469 . . . . 0.0 112.569 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.0 t-80 -101.1 89.14 3.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.029 0.443 . . . . 0.0 110.065 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 16.4 ptp -128.95 54.46 1.79 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.81 0.814 . . . . 0.0 109.878 177.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -83.52 -6.5 59.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.85 -176.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -63.8 144.08 57.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.127 0.489 . . . . 0.0 110.478 177.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 24.2 t -75.26 132.01 34.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.416 -173.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.8 m -70.02 153.81 42.74 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.725 176.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.03 -41.49 87.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.867 0.365 . . . . 0.0 110.083 -175.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -55.06 -39.21 68.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.552 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -71.57 -38.35 70.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.907 0.384 . . . . 0.0 110.259 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.9 mt -65.14 -35.07 79.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.251 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -53.73 -32.27 51.5 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.113 178.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -70.5 -18.38 62.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.741 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.08 -52.1 60.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.63 0.252 . . . . 0.0 111.047 -177.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.45 -16.21 62.58 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.129 -0.557 . . . . 0.0 112.932 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 32.8 mm-40 -83.11 -24.1 32.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.819 0.342 . . . . 0.0 110.687 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.525 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.9 t -74.61 113.33 11.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.323 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -24.55 65.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.469 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.5 m -72.7 -41.07 65.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.7 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.437 ' O ' HD13 ' A' ' 105' ' ' LEU . 61.3 tp -67.43 -54.39 20.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.414 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.607 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 6.8 ptp180 -60.55 -24.94 65.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.229 -179.341 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.3 t -58.85 -30.07 67.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.208 0.528 . . . . 0.0 110.2 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 mt -86.71 -32.74 20.3 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.005 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.547 HD21 HD13 ' B' ' 477' ' ' ILE . 9.2 mp -61.59 -20.72 63.63 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.476 178.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 80.8 mt -68.14 -12.64 61.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.185 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -84.69 116.55 65.73 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.075 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.434 ' O ' ' HG2' ' A' ' 111' ' ' ARG . 67.5 Cg_exo -52.63 -36.18 70.74 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 123.802 3.002 . . . . 0.0 113.44 -176.187 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -67.34 -45.35 76.66 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.09 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 50.1 tp -65.85 -38.29 88.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.95 0.405 . . . . 0.0 111.046 -176.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 108' ' ' PRO . 30.1 ptt180 -69.93 -27.64 64.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.094 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 65.3 mm-40 -70.8 -37.81 73.29 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.549 174.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 88.1 mt -58.07 -46.28 85.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.326 176.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.44 ' HG2' HG22 ' B' ' 474' ' ' VAL . 59.0 mtm -58.1 -54.8 42.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.437 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.592 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 32.0 m -66.53 -23.31 31.23 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -175.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -76.47 -45.79 29.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.15 0.5 . . . . 0.0 110.792 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.541 HD12 ' CD2' ' A' ' 130' ' ' TYR . 0.7 OUTLIER -64.48 -49.97 69.28 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.414 -175.885 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' B' ' 488' ' ' ASN . 14.4 t70 -55.65 -21.4 17.84 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.393 -1.276 . . . . 0.0 111.014 -176.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 75.2 mt-30 -65.11 -29.67 70.55 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.499 0.666 . . . . 0.0 109.4 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.432 ' HA3' ' ND2' ' B' ' 488' ' ' ASN . . . 65.16 17.09 63.2 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 114.44 -1.254 . . . . 0.0 113.891 172.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -54.36 -54.94 33.81 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.585 ' OD2' ' HG2' ' A' ' 125' ' ' LYS . 27.3 t70 -143.48 65.92 1.31 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.791 0.805 . . . . 0.0 109.464 172.047 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.68 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -55.54 -23.36 26.13 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.92 179.381 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -53.12 -52.95 57.04 Favored 'General case' 0 C--O 1.231 0.131 0 O-C-N 123.319 0.387 . . . . 0.0 111.828 -177.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.585 ' HG2' ' OD2' ' A' ' 122' ' ' ASP . 18.5 pttm -85.38 -30.01 23.97 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.176 -0.61 . . . . 0.0 111.041 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.639 HD22 ' CE1' ' A' ' 130' ' ' TYR . 36.8 mt -60.52 -43.46 97.08 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.854 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.462 ' O ' ' HG2' ' A' ' 131' ' ' MET . 0.0 OUTLIER -55.61 -38.64 69.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.745 0.307 . . . . 0.0 111.546 179.782 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -84.08 -40.09 18.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.934 0.397 . . . . 0.0 110.873 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.501 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.81 -17.6 63.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.846 -176.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.639 ' CE1' HD22 ' A' ' 126' ' ' LEU . 5.2 m-30 -84.95 -28.41 25.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.066 0.46 . . . . 0.0 110.34 -179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.496 ' HE3' HG12 ' A' ' 137' ' ' VAL . 54.9 mmm -78.59 4.35 13.72 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.357 -178.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.501 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 7.2 pt20 -94.31 -14.83 25.02 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.316 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -99.65 125.25 41.35 Favored Pre-proline 0 N--CA 1.449 -0.48 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.669 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.707 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 29.0 Cg_endo -63.14 -14.21 40.31 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.056 2.504 . . . . 0.0 112.842 -174.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.401 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.3 mp -75.52 -36.15 60.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.927 0.394 . . . . 0.0 110.264 176.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.541 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 35.8 t80 -89.97 -33.88 16.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.152 -173.285 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.707 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 21.0 m -58.19 -49.29 82.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.027 178.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.527 ' N ' HG23 ' A' ' 137' ' ' VAL . 72.7 mm-40 -62.58 -41.44 98.95 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.542 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -55.31 -49.8 71.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.659 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.792 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.61 -48.8 75.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.707 177.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -59.39 -30.73 68.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.363 0.601 . . . . 0.0 110.621 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.7 m -76.2 -52.68 9.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.398 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.545 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.4 p -64.5 -30.82 71.85 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 121.121 -0.232 . . . . 0.0 111.487 -174.062 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.792 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 82.6 mt -60.0 -44.96 94.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.779 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -72.19 -15.17 76.68 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.406 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 65.8 mt -91.19 -36.84 8.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 120.748 0.309 . . . . 0.0 111.315 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 27.7 m -94.55 5.93 7.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -173.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 6.7 mm-40 -62.87 116.19 22.45 Favored Pre-proline 0 C--N 1.326 -0.447 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 174.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -72.25 -6.31 18.83 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 122.646 2.23 . . . . 0.0 112.337 -178.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 14.2 t 69.19 101.51 0.06 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.012 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -80.22 114.29 19.02 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.368 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -126.46 164.24 21.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.243 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -65.25 143.39 57.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.876 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -136.71 102.77 5.0 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.218 -177.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 21.5 m . . . . . 0 C--O 1.251 1.178 0 CA-C-O 118.575 -0.726 . . . . 0.0 110.088 179.067 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 7.7 t70 . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 121.184 0.516 . . . . 0.0 110.427 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 72.6 mt -67.36 -35.49 73.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.773 -172.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -58.2 -44.46 88.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.438 0.637 . . . . 0.0 109.827 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 465' ' ' HIS . . . . . 0.402 ' HA ' ' ND2' ' B' ' 468' ' ' ASN . 62.9 t60 -65.49 -55.27 18.77 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.293 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.34 -38.0 82.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.133 -173.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -72.23 -42.98 65.1 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 111.642 0.238 . . . . 0.0 111.642 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 468' ' ' ASN . . . . . 0.402 ' ND2' ' HA ' ' B' ' 465' ' ' HIS . 2.1 p30 -76.01 -23.56 55.21 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.8 t -58.34 -32.38 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.702 174.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.541 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 25.9 mm -62.98 -37.55 79.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.814 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 85.1 mt -53.55 -42.26 67.3 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.223 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -65.44 -43.31 90.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.396 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 53.3 m -62.04 -54.09 46.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.593 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.44 HG22 ' HG2' ' A' ' 114' ' ' MET . 69.2 t -47.88 -54.33 3.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.762 176.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.456 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 26.7 ttm180 -67.93 -35.73 78.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.596 -173.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -43.17 95.35 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.051 0.453 . . . . 0.0 110.133 178.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.547 HD13 HD21 ' A' ' 105' ' ' LEU . 97.5 mt -67.42 -55.28 17.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.638 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 56.9 mt -54.46 -23.44 10.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.025 0.441 . . . . 0.0 111.026 176.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.603 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 15.3 tppt? -69.99 -48.88 56.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.927 -175.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 480' ' ' LYS . . . . . 0.432 ' HD2' ' HB3' ' B' ' 479' ' ' LYS . 2.1 mptp? -103.53 -16.8 15.44 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.474 -177.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -90.32 -51.86 5.22 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.784 -175.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -100.43 -83.38 0.44 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -173.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -111.9 -48.63 3.04 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -167.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.603 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 95.98 15.08 43.5 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.344 -0.931 . . . . 0.0 112.008 -173.177 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 1.9 pp -75.9 175.52 8.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.362 0.601 . . . . 0.0 112.516 -174.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -143.38 51.48 1.37 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.017 177.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 2.6 t -57.06 -45.7 83.02 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -170.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 488' ' ' ASN . . . . . 0.432 ' ND2' ' HA3' ' A' ' 120' ' ' GLY . 8.7 t30 -92.81 84.76 5.02 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.207 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 29.2 m -144.7 130.77 19.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.943 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -93.5 3.19 55.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.93 0.395 . . . . 0.0 111.023 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 8.4 ptmm? -82.34 49.33 1.41 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.529 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 5.5 p -85.11 61.37 6.83 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.547 0.689 . . . . 0.0 110.481 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 54.5 pttt -132.53 33.88 3.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.677 -177.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -96.85 -4.68 39.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.402 178.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.407 HG22 ' H ' ' B' ' 495' ' ' VAL . 4.1 m . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.521 177.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.661 0 N-CA-C 112.233 -0.347 . . . . 0.0 112.233 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.78 77.26 3.77 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 123.176 2.584 . . . . 0.0 112.306 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.516 ' HD2' ' HE ' ' A' ' 86' ' ' ARG . 28.0 p-80 -78.76 67.76 4.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.609 0.718 . . . . 0.0 110.597 178.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 96.2 mmm -84.04 35.38 0.53 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.321 -176.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.458 ' HA ' ' CE1' ' B' ' 465' ' ' HIS . 13.7 m-20 -81.56 -29.12 33.55 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 171.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.516 ' HE ' ' HD2' ' A' ' 83' ' ' HIS . 14.6 ptp180 -81.94 136.32 35.31 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.139 175.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.556 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 27.7 t -99.8 133.69 41.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.295 -174.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.2 m -55.76 134.93 51.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.924 175.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -59.88 -32.86 71.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.263 -176.315 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -60.37 -40.95 92.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.696 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -64.46 -43.07 95.41 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.159 0.504 . . . . 0.0 110.149 177.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 76.8 mt -65.45 -33.91 77.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.409 -178.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 63.0 mttm -62.5 -24.7 67.62 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -74.36 -18.02 60.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.669 0.271 . . . . 0.0 110.791 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.437 HD21 HG13 ' A' ' 147' ' ' VAL . 91.0 mt -62.27 -42.31 99.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.957 0.408 . . . . 0.0 110.479 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -70.63 -19.01 76.16 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.723 -0.672 . . . . 0.0 112.379 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -86.5 -24.75 25.45 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.85 0.357 . . . . 0.0 110.435 -178.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.656 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.5 t -68.49 108.33 3.25 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.52 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.4 -24.67 66.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.051 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.5 m -75.43 -48.64 21.89 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.817 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.2 tp -67.36 -49.3 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.802 -174.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.656 ' HG2' ' O ' ' A' ' 98' ' ' SER . 8.2 ptp180 -60.14 -28.51 67.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.279 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.477 ' O ' ' HB2' ' A' ' 106' ' ' LEU . 22.7 t -66.9 -25.68 66.5 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.043 0.449 . . . . 0.0 110.096 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 27.3 mt -76.51 -33.22 58.62 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.404 HD21 HD13 ' B' ' 477' ' ' ILE . 10.1 mp -66.59 -15.97 63.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.825 177.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 103' ' ' SER . 3.9 mm? -69.12 -13.83 62.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.645 175.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -78.63 116.32 58.59 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.804 175.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.62 -26.59 82.6 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.99 2.46 . . . . 0.0 112.514 -175.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.464 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 66.2 t60 -74.56 -46.14 40.86 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.776 178.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.402 ' HA ' HD12 ' A' ' 113' ' ' LEU . 51.8 tp -64.77 -39.11 93.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.899 0.381 . . . . 0.0 110.916 -176.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -67.14 -33.22 74.97 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 -70.17 -36.42 74.68 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.24 178.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 109' ' ' HIS . 95.3 mt -58.39 -54.31 48.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.908 175.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.443 ' HG2' HG22 ' B' ' 474' ' ' VAL . 70.7 mtp -55.83 -50.42 70.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.163 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.599 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 48.7 t -59.21 -40.24 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.284 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 16.7 m-20 -60.37 -47.23 86.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.171 0.51 . . . . 0.0 111.088 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 55.9 tp -64.2 -37.74 88.54 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.21 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.474 ' HB2' HD12 ' B' ' 478' ' ' ILE . 26.8 t70 -63.94 -35.63 81.32 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.119 -179.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.599 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 74.5 mt-30 -62.45 -28.92 70.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.582 0.706 . . . . 0.0 110.426 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 70.57 27.39 72.61 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 114.443 -1.253 . . . . 0.0 113.61 171.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -56.5 -55.18 37.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.95 0.405 . . . . 0.0 110.4 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.57 ' O ' HD13 ' A' ' 126' ' ' LEU . 27.5 t70 -151.57 77.22 1.23 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.542 0.687 . . . . 0.0 109.723 174.079 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.677 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.6 OUTLIER -53.68 -23.72 12.31 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.802 -1.09 . . . . 0.0 111.629 178.618 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.9 -51.76 67.92 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -175.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -71.06 -50.06 37.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.8 176.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 122' ' ' ASP . 11.1 mp -51.73 -45.65 63.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -175.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.455 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.1 OUTLIER -54.38 -45.63 72.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.835 0.35 . . . . 0.0 111.658 -179.556 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 42.5 mtm180 -83.44 -35.44 24.99 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.078 -176.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.51 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -73.16 -16.86 61.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.563 -177.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.507 ' HB3' ' CG ' ' A' ' 136' ' ' PHE . 13.1 m-30 -89.16 -27.08 20.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.088 0.471 . . . . 0.0 110.743 177.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.501 ' HE2' HG12 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -79.0 6.29 9.69 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.543 -177.563 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 30.0 pt20 -102.38 -22.85 14.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.845 0.355 . . . . 0.0 110.869 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -103.33 138.6 19.59 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 121.048 0.451 . . . . 0.0 111.37 -175.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.756 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 35.2 Cg_endo -63.42 -13.53 36.74 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.829 3.019 . . . . 0.0 114.043 -171.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.452 HD22 ' CD2' ' A' ' 109' ' ' HIS . 11.0 mp -77.15 -39.15 50.15 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.322 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.507 ' CG ' ' HB3' ' A' ' 130' ' ' TYR . 39.8 t80 -91.51 -33.77 15.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.0 0.428 . . . . 0.0 110.29 -174.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.756 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 15.5 m -56.72 -51.17 70.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.339 179.15 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.524 ' N ' HG23 ' A' ' 137' ' ' VAL . 39.5 mm-40 -66.48 -35.35 80.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.597 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -56.4 -51.11 69.56 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 173.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.75 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.01 -47.4 83.27 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.702 178.088 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.72 -33.16 71.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.29 0.567 . . . . 0.0 110.633 -176.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.4 m -76.12 -48.63 19.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.391 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.519 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 25.6 p -67.19 -30.7 70.72 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.91 -174.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.75 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 74.6 mt -58.95 -47.14 86.14 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.833 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.33 -27.82 73.57 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.248 -176.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 69.8 mt -76.62 -42.12 34.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.805 0.336 . . . . 0.0 110.726 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.437 HG13 HD21 ' A' ' 95' ' ' LEU . 23.4 m -90.2 3.55 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -174.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.651 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 7.4 mm-40 -53.64 114.44 6.27 Favored Pre-proline 0 N--CA 1.465 0.287 0 O-C-N 123.185 0.303 . . . . 0.0 110.473 176.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.74 -11.02 23.82 Favored 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 122.644 2.23 . . . . 0.0 112.077 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 42.7 m -98.27 176.58 5.67 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.794 -178.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 64.35 62.57 0.81 Allowed 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.629 0.58 . . . . 0.0 110.297 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 71.44 125.23 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.898 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -97.08 -2.19 43.76 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.691 -173.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -80.35 43.45 0.64 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.48 -177.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 9.4 p . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.586 179.611 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 N--CA 1.483 1.19 0 CA-C-O 120.498 0.189 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 82.4 mt -63.4 -35.08 70.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.363 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -54.99 -40.23 69.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.356 174.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 465' ' ' HIS . . . . . 0.458 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 57.5 t60 -74.97 -47.28 30.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.566 177.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.588 ' O ' HG12 ' B' ' 470' ' ' ILE . 40.5 mt-10 -57.29 -45.96 83.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.79 -176.024 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 467' ' ' ARG . . . . . 0.455 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 21.8 mtm180 -64.04 -29.57 70.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -177.084 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -32.63 59.24 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.4 t -66.14 -35.7 75.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.388 176.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.588 HG12 ' O ' ' B' ' 466' ' ' GLU . 30.7 mm -63.06 -33.78 62.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.246 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 471' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 90.1 mt -57.45 -48.67 78.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.357 177.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.556 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.1 mp0 -58.88 -36.78 75.21 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.094 178.387 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 57.5 m -63.96 -58.82 5.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.987 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.443 HG22 ' HG2' ' A' ' 114' ' ' MET . 94.2 t -50.45 -44.55 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.808 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 31.2 mmt180 -62.88 -44.04 97.19 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.015 -177.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 476' ' ' TYR . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -67.56 -50.28 59.23 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.67 -179.348 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.611 ' O ' ' HB2' ' B' ' 481' ' ' ASP . 83.9 mt -60.79 -59.27 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.746 -174.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.487 HG23 ' HB2' ' B' ' 482' ' ' PHE . 67.9 mt -58.81 -23.92 24.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.301 -177.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.523 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 5.6 tmtt? -64.57 -42.13 95.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.652 -177.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.72 -14.35 12.01 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.272 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 481' ' ' ASP . . . . . 0.611 ' HB2' ' O ' ' B' ' 477' ' ' ILE . 0.4 OUTLIER -89.41 -40.31 12.81 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -179.301 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 482' ' ' PHE . . . . . 0.487 ' HB2' HG23 ' B' ' 478' ' ' ILE . 89.4 m-85 -116.27 -91.81 0.53 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -174.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -112.81 -49.53 2.93 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.979 -0.289 . . . . 0.0 110.862 -173.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.523 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 64.94 45.93 90.9 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.002 -177.065 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.414 ' HB3' ' HB2' ' B' ' 488' ' ' ASN . 80.8 mt -70.59 139.44 51.43 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.478 -0.361 . . . . 0.0 110.6 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -113.57 -35.99 5.05 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.418 -177.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 13.6 t -129.39 24.17 5.5 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.43 0.633 . . . . 0.0 110.91 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 488' ' ' ASN . . . . . 0.414 ' HB2' ' HB3' ' B' ' 485' ' ' LEU . 13.7 m120 -117.93 104.43 10.9 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.7 -176.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 489' ' ' SER . . . . . 0.412 ' HB3' ' HG3' ' B' ' 491' ' ' LYS . 70.9 m -92.31 147.86 22.59 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.122 176.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -120.06 20.77 12.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.172 0.511 . . . . 0.0 110.828 -178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 491' ' ' LYS . . . . . 0.434 ' O ' ' HD3' ' B' ' 491' ' ' LYS . 0.1 OUTLIER -83.1 163.93 20.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.208 -179.588 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 6.8 p -161.64 168.63 23.07 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.069 176.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 89.8 mttt 54.93 64.46 1.8 Allowed 'General case' 0 C--O 1.232 0.177 0 O-C-N 123.64 0.587 . . . . 0.0 111.107 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -62.29 -40.24 95.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.625 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 44.0 t . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.79 -0.624 . . . . 0.0 109.863 -179.767 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.666 0 N-CA-C 112.106 -0.398 . . . . 0.0 112.106 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -61.75 -33.14 86.15 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.736 2.291 . . . . 0.0 112.546 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -127.48 115.18 18.49 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.829 0.347 . . . . 0.0 110.235 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 27.3 ttt -155.44 67.25 0.64 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.255 0.55 . . . . 0.0 109.572 177.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -89.59 -27.34 20.28 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.315 -176.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.424 ' HA ' ' OE1' ' B' ' 472' ' ' GLN . 37.4 mmt180 -89.62 132.89 34.9 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.321 0.581 . . . . 0.0 110.368 179.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.45 HG11 ' HB ' ' A' ' 147' ' ' VAL . 85.2 t -106.7 137.29 38.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.712 -174.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.3 m -71.41 145.78 49.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.17 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.523 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.3 OUTLIER -58.8 -31.95 68.9 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.403 -176.469 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -56.61 -39.08 72.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.755 0.312 . . . . 0.0 110.703 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -70.45 -40.66 73.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.152 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.415 HD12 HD22 ' A' ' 89' ' ' LEU . 62.0 mt -68.41 -31.36 70.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.254 -178.184 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 62.2 mtpt -60.81 -28.37 68.73 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 178.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -72.32 -16.61 61.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.724 -0.217 . . . . 0.0 111.548 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.491 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 97.0 mt -55.74 -56.48 19.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.535 -176.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -66.01 -21.98 70.17 Favored Glycine 0 CA--C 1.52 0.379 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.691 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -79.62 -20.52 46.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.058 0.456 . . . . 0.0 110.818 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.9 m -78.8 123.18 26.94 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.364 -177.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.61 -27.85 69.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.929 -173.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.1 m -75.12 -39.66 60.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.039 0.447 . . . . 0.0 110.868 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.552 HD12 HD11 ' A' ' 104' ' ' LEU . 29.4 tp -73.0 -49.09 30.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.521 -172.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.701 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 9.0 ptp180 -57.18 -33.52 67.55 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.919 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 73.6 m -63.08 -42.06 99.56 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.552 HD11 HD12 ' A' ' 101' ' ' LEU . 0.6 OUTLIER -87.94 -19.13 27.69 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.923 -0.711 . . . . 0.0 111.653 -179.192 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 101' ' ' LEU . 7.5 mp -64.82 -20.99 66.7 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.278 0.561 . . . . 0.0 110.622 170.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 97.7 mt -71.16 -12.71 61.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.965 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -78.61 118.49 72.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.868 175.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.94 -34.68 92.65 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.421 2.747 . . . . 0.0 112.86 -177.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.554 ' CD2' HD22 ' A' ' 135' ' ' LEU . 60.9 t60 -66.26 -48.76 69.43 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.694 0.283 . . . . 0.0 110.838 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 104' ' ' LEU . 48.7 tp -63.07 -41.79 99.51 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.101 -176.16 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -66.32 -34.57 78.28 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.193 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 65.8 mm-40 -67.67 -28.56 67.8 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 120.597 0.237 . . . . 0.0 111.086 176.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.93 -53.41 18.01 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.562 ' HG3' HG22 ' B' ' 474' ' ' VAL . 33.6 ttp -56.47 -42.91 79.0 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.021 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.411 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 20.5 t -62.94 -45.91 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 120.699 0.285 . . . . 0.0 111.22 177.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -62.99 -40.95 99.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.02 0.438 . . . . 0.0 111.243 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.416 HD23 HG21 ' B' ' 474' ' ' VAL . 46.1 tp -62.63 -37.21 85.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.6 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.401 ' HB2' HD12 ' B' ' 478' ' ' ILE . 6.9 t70 -62.99 -34.63 77.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.412 -178.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 60.7 mt-30 -58.91 -27.0 64.84 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.826 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.573 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 65.78 16.93 64.38 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.33 -0.85 . . . . 0.0 113.856 170.287 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -72.68 -42.96 63.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.311 0.576 . . . . 0.0 109.584 -175.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.42 ' OD1' ' HG2' ' A' ' 125' ' ' LYS . 4.2 t70 -150.04 51.43 0.91 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 173.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.573 ' HG3' ' HA2' ' A' ' 120' ' ' GLY . 0.0 OUTLIER -56.55 -20.71 22.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.66 -1.155 . . . . 0.0 110.582 175.242 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.477 ' N ' ' HD2' ' A' ' 123' ' ' LYS . . . -57.01 -53.81 53.86 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.271 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.42 ' HG2' ' OD1' ' A' ' 122' ' ' ASP . 65.0 pttt -79.61 -28.42 41.0 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.554 178.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.469 HD22 ' CE1' ' A' ' 130' ' ' TYR . 95.8 mt -63.51 -40.37 96.88 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.589 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.473 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.4 OUTLIER -52.92 -34.28 54.44 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.915 0.388 . . . . 0.0 110.857 177.185 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -79.73 -48.79 13.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.786 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.595 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.35 -20.12 64.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.206 -175.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.528 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.3 m-30 -85.04 -36.44 21.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.106 0.479 . . . . 0.0 110.848 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.67 5.94 14.19 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.144 -176.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.595 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.1 pt20 -100.3 -24.09 14.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.905 0.383 . . . . 0.0 110.14 178.447 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.57 136.15 19.4 Favored Pre-proline 0 N--CA 1.452 -0.356 0 CA-C-O 121.149 0.499 . . . . 0.0 110.881 178.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.759 ' HA ' HG22 ' A' ' 137' ' ' VAL . 34.1 Cg_endo -64.04 -14.33 42.82 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 123.532 2.821 . . . . 0.0 114.0 -170.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.554 HD22 ' CD2' ' A' ' 109' ' ' HIS . 4.3 mp -69.54 -39.31 77.54 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.942 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.528 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 60.8 t80 -92.2 -30.82 15.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.086 0.47 . . . . 0.0 110.093 -173.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.759 HG22 ' HA ' ' A' ' 134' ' ' PRO . 35.9 m -59.0 -50.9 78.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.262 -178.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.547 ' N ' HG23 ' A' ' 137' ' ' VAL . 11.7 pt-20 -72.24 -28.56 63.22 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.876 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -59.53 -49.0 79.47 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 172.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.813 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.57 -45.58 92.25 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.562 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.69 -32.66 73.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.518 -177.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 69.0 m -70.76 -51.38 27.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.995 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.0 p -65.26 -27.42 68.64 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.966 -175.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.813 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.3 mt -60.36 -54.47 45.24 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 120.745 0.307 . . . . 0.0 110.23 177.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.76 -14.29 57.91 Favored Glycine 0 CA--C 1.516 0.127 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.833 -176.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.419 HD12 ' HA ' ' A' ' 143' ' ' CYS . 64.5 mt -90.67 -30.48 4.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 120.808 0.337 . . . . 0.0 111.142 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.45 ' HB ' HG11 ' A' ' 87' ' ' VAL . 15.2 m -103.38 -18.35 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.546 -176.141 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -69.3 120.57 77.71 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 120.82 0.343 . . . . 0.0 110.307 177.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.26 -21.69 67.65 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 123.15 2.567 . . . . 0.0 112.029 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 26.9 t -79.39 90.05 5.01 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 174.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -75.1 128.63 35.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.996 0.427 . . . . 0.0 110.419 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -81.33 134.57 35.6 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -74.99 133.22 41.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.101 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -122.27 -161.87 0.96 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.372 -174.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 15.3 p . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.615 -0.707 . . . . 0.0 110.304 179.203 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 12.6 t70 . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 121.006 0.431 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 42.7 mt -65.87 -34.76 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.637 -171.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -65.13 -36.98 85.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.311 0.577 . . . . 0.0 109.823 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -68.24 -55.72 11.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.019 173.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.539 ' O ' ' HB ' ' B' ' 469' ' ' VAL . 40.1 mt-10 -56.5 -51.44 68.49 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.503 -0.772 . . . . 0.0 112.493 -172.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 467' ' ' ARG . . . . . 0.473 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 96.7 mtt180 -67.59 -25.73 65.92 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -174.198 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -29.99 37.78 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 177.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 469' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' B' ' 466' ' ' GLU . 8.5 t -60.93 -38.53 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.921 174.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.524 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 10.6 mm -63.21 -38.5 82.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.304 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 471' ' ' LEU . . . . . 0.497 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 80.3 mt -58.65 -46.06 87.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.119 177.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.508 HE21 ' HA ' ' B' ' 469' ' ' VAL . 10.3 mt-30 -62.88 -33.2 74.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.581 177.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 63.0 m -69.66 -54.97 11.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.234 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.562 HG22 ' HG3' ' A' ' 114' ' ' MET . 54.6 t -47.08 -50.02 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.19 175.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' B' ' 471' ' ' LEU . 35.8 mmt180 -63.61 -34.45 77.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.895 0.378 . . . . 0.0 111.171 -175.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -75.35 -49.34 19.39 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.569 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.542 ' O ' ' HB2' ' B' ' 481' ' ' ASP . 95.5 mt -60.58 -58.37 7.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.572 -176.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.53 HG22 ' H ' ' B' ' 484' ' ' GLY . 50.2 mt -56.53 -23.6 17.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.585 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.617 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 40.9 ttmt -64.41 -48.65 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -178.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.24 -13.54 15.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.895 0.379 . . . . 0.0 111.256 -175.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 481' ' ' ASP . . . . . 0.542 ' HB2' ' O ' ' B' ' 477' ' ' ILE . 0.6 OUTLIER -88.5 -50.13 6.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.738 177.128 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 482' ' ' PHE . . . . . 0.451 ' HB2' HG23 ' B' ' 478' ' ' ILE . 97.2 m-85 -119.09 -87.02 0.64 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -171.385 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -112.47 -50.2 2.91 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -167.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.617 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 83.82 50.23 4.49 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.258 -173.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 73.6 mt -88.32 149.08 23.96 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.741 0.305 . . . . 0.0 110.823 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 60.86 21.0 11.21 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.792 -178.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 60.4 p -144.96 -41.91 0.24 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.175 -176.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -119.59 121.89 40.35 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.453 178.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 45.9 m -56.54 126.06 24.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.077 179.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -77.91 77.16 4.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.493 0.663 . . . . 0.0 111.254 -175.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.42 24.71 0.95 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.815 178.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 20.6 m -95.17 25.18 4.42 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.412 0.625 . . . . 0.0 110.333 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -118.14 136.05 53.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.188 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -83.16 -30.63 27.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.292 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 3.6 p . . . . . 0 C--O 1.25 1.104 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.818 -179.793 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.779 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -57.57 -48.52 16.8 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.735 2.29 . . . . 0.0 111.878 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 -98.08 74.47 2.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.917 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 16.0 tpt -84.88 -3.54 58.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.81 0.814 . . . . 0.0 109.779 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.527 ' HB3' ' ND2' ' B' ' 468' ' ' ASN . 23.2 m-20 -81.63 3.12 26.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.643 179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.561 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 36.4 ptt180 -76.09 138.61 40.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.285 177.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 91.4 t -100.28 139.08 22.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.895 0.378 . . . . 0.0 110.651 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.1 m -65.42 138.96 58.47 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.341 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.75 -33.17 72.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.219 -176.608 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -63.17 -40.42 97.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.746 177.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.64 -41.82 98.21 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 93.3 mt -67.38 -32.21 72.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.839 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 94.3 mttt -61.35 -20.68 63.26 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -77.25 -17.9 58.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.589 0.233 . . . . 0.0 111.131 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 88.2 mt -62.63 -49.57 74.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.273 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -70.61 -14.86 72.81 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.418 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -91.02 -22.59 20.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.882 0.372 . . . . 0.0 110.961 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.657 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 33.0 t -68.49 116.64 9.27 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.386 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.69 -29.63 70.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.045 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.402 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 57.5 m -77.44 -37.46 51.53 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.813 -177.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.503 HD11 ' CD2' ' A' ' 139' ' ' PHE . 48.5 tp -75.28 -47.09 29.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.312 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -60.03 -31.43 69.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.906 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 21.3 t -66.26 -22.92 66.33 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.202 0.525 . . . . 0.0 110.228 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 100' ' ' THR . 28.0 mt -80.52 -32.55 36.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.687 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.7 mp -69.6 -10.52 58.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.96 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.52 -11.52 53.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.843 174.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -86.0 114.61 58.02 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 173.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.41 ' O ' ' HG2' ' A' ' 111' ' ' ARG . 50.4 Cg_exo -54.72 -30.04 64.85 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.947 2.431 . . . . 0.0 112.608 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -68.26 -45.08 74.15 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.901 178.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 55.3 tp -66.33 -38.61 88.06 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.75 0.31 . . . . 0.0 111.188 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 108' ' ' PRO . 5.5 ptp180 -67.35 -30.99 70.95 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.656 -0.418 . . . . 0.0 109.959 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -73.9 -32.52 63.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.819 177.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.42 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 72.3 mt -59.02 -50.73 72.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.36 176.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 60.0 mtm -56.77 -49.83 74.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.559 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.662 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 60.1 t -59.59 -46.53 93.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.153 -178.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -60.29 -48.26 82.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.024 0.44 . . . . 0.0 111.476 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 61.9 tp -62.98 -36.63 84.15 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.663 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.437 ' OD1' ' HD2' ' B' ' 475' ' ' ARG . 19.3 t70 -66.11 -33.53 76.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.865 -177.131 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 60.5 mt-30 -60.27 -28.72 68.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.289 0.566 . . . . 0.0 110.628 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.39 29.37 71.78 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.089 -0.959 . . . . 0.0 114.211 169.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -76.28 -55.1 5.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 117.231 0.515 . . . . 0.0 110.026 176.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -131.25 41.12 3.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.357 0.599 . . . . 0.0 110.146 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.658 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.78 -31.62 5.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.607 -1.179 . . . . 0.0 112.109 177.756 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -54.19 -58.16 8.4 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -177.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -80.02 -26.42 39.82 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.01 -178.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.471 HD22 ' CE2' ' A' ' 130' ' ' TYR . 94.9 mt -62.53 -41.54 98.94 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.5 177.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.436 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -51.75 -39.15 58.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 0.0 111.12 178.208 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 54.2 mtp180 -81.6 -43.23 18.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.769 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.64 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.86 -26.95 68.84 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.52 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.471 ' CE2' HD22 ' A' ' 126' ' ' LEU . 3.4 m-30 -80.54 -19.45 45.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.791 0.329 . . . . 0.0 111.078 -178.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 2.5 mmt -77.57 -4.92 48.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.348 -177.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.64 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.5 pt20 -100.99 -8.54 22.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.978 0.418 . . . . 0.0 110.472 178.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.54 ' O ' HG23 ' A' ' 137' ' ' VAL . 0.6 OUTLIER -94.35 118.48 67.04 Favored Pre-proline 0 N--CA 1.45 -0.472 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.74 -175.025 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.613 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 16.0 Cg_endo -56.39 -24.53 52.57 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.92 2.413 . . . . 0.0 112.168 -175.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.474 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.0 mp -71.04 -43.01 68.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.211 0.529 . . . . 0.0 109.993 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.487 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 29.7 t80 -81.97 -31.33 31.24 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.105 -176.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 133' ' ' GLU . 86.9 t -61.98 -43.53 97.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.481 177.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 48.0 mt-10 -65.97 -42.71 89.56 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.08 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' PHE . . . . . 0.503 ' CD2' HD11 ' A' ' 101' ' ' LEU . 75.5 t80 -57.21 -48.91 77.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.158 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.787 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.79 -48.17 77.99 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.562 -177.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -66.75 -26.8 67.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.192 0.52 . . . . 0.0 110.416 -174.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 94.0 m -79.72 -48.44 13.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.106 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.9 p -64.31 -29.03 70.13 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.55 0.214 . . . . 0.0 111.02 -175.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.787 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 73.8 mt -59.61 -52.83 63.84 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.508 178.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.45 -15.23 63.45 Favored Glycine 0 C--N 1.329 0.188 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.533 -176.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 64.4 mt -88.4 -26.08 5.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 120.766 0.317 . . . . 0.0 111.082 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 13.6 m -103.67 -14.1 8.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.501 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 44.8 mt-10 -71.73 118.07 63.3 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.435 176.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 148' ' ' GLU . 20.0 Cg_endo -62.7 -20.85 72.14 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.818 2.346 . . . . 0.0 111.991 178.316 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 19.5 m -78.2 103.93 8.45 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.707 174.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLN . . . . . 0.47 ' HA ' ' OE1' ' A' ' 151' ' ' GLN . 10.8 mm-40 -66.62 137.91 57.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.745 0.307 . . . . 0.0 110.897 -179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -66.19 126.59 29.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.288 177.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -71.05 129.22 38.43 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.523 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -143.07 93.45 2.5 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.001 -176.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 22.4 m . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.567 -0.73 . . . . 0.0 110.448 -179.74 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 54.9 mt -60.47 -36.22 68.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.683 -174.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -58.72 -42.41 88.66 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 110.218 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -70.25 -50.36 40.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.809 177.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.571 ' O ' HG12 ' B' ' 470' ' ' ILE . 37.5 mt-10 -61.25 -48.28 82.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.286 -172.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 467' ' ' ARG . . . . . 0.436 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 37.2 mtm180 -58.32 -36.43 73.38 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 468' ' ' ASN . . . . . 0.527 ' ND2' ' HB3' ' A' ' 85' ' ' ASP . 0.0 OUTLIER -76.73 -27.31 55.36 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -179.062 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 469' ' ' VAL . . . . . 0.499 ' HA ' ' CG ' ' B' ' 472' ' ' GLN . 2.4 t -72.56 -29.54 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 114.717 -1.129 . . . . 0.0 110.513 177.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.571 HG12 ' O ' ' B' ' 466' ' ' GLU . 17.2 mm -68.62 -34.5 65.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 174.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 91.0 mt -60.48 -41.89 95.17 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.362 176.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.561 ' NE2' ' HA ' ' A' ' 86' ' ' ARG . 4.6 mm-40 -52.2 -48.38 65.1 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.61 0.719 . . . . 0.0 110.061 175.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 473' ' ' CYS . . . . . 0.429 ' O ' HG13 ' B' ' 477' ' ' ILE . 38.1 m -61.51 -54.06 48.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.684 -179.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 89.8 t -50.89 -49.87 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.684 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 24.1 mmm180 -67.1 -28.21 67.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.521 -176.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -76.33 -50.32 14.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.672 0.273 . . . . 0.0 110.672 178.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.429 HG13 ' O ' ' B' ' 473' ' ' CYS . 70.4 mt -63.11 -62.73 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.125 -173.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 46.3 mt -54.83 -24.7 14.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 21.8 tptm -70.98 -39.43 72.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -175.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.72 -15.6 11.9 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.82 -178.076 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -91.68 -59.64 2.08 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.04 0.447 . . . . 0.0 111.694 -176.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -87.32 -85.29 0.17 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.303 -170.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -107.97 -50.12 3.1 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.367 -174.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.463 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 91.69 9.06 63.17 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.577 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.429 HD13 ' ND2' ' B' ' 488' ' ' ASN . 76.7 mt -75.65 140.06 42.34 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.372 0.606 . . . . 0.0 111.325 -176.261 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -148.7 -52.01 0.17 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.173 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 5.1 t -80.73 59.7 3.74 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.561 -1.2 . . . . 0.0 110.57 177.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 488' ' ' ASN . . . . . 0.429 ' ND2' HD13 ' B' ' 485' ' ' LEU . 5.7 m-20 -121.56 152.74 38.88 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.296 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 17.1 m -69.25 -3.79 15.2 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.495 -170.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -83.08 -22.94 33.32 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.417 0.627 . . . . 0.0 110.531 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -124.24 14.49 9.02 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.032 -177.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 57.0 m -113.71 87.96 2.73 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.071 0.462 . . . . 0.0 111.101 -176.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -94.21 17.99 11.7 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.99 -54.45 47.02 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.346 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.379 -0.819 . . . . 0.0 110.633 -179.598 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.7 0 N-CA-C 112.369 -0.293 . . . . 0.0 112.369 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -67.27 -37.63 17.55 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.77 2.313 . . . . 0.0 111.564 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -93.26 -46.75 7.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.011 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 69.2 mtm -85.72 77.85 9.7 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 175.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -92.36 -15.39 27.35 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.303 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -54.86 127.77 30.13 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 121.084 0.469 . . . . 0.0 110.766 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.471 HG21 ' HB ' ' A' ' 147' ' ' VAL . 14.9 p -72.77 148.02 9.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.327 -0.852 . . . . 0.0 111.181 -174.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.4 m -68.41 144.84 54.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.281 -177.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -26.51 68.35 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.793 -175.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 24.2 pt20 -60.82 -35.3 76.18 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.135 0.493 . . . . 0.0 110.313 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -70.7 -37.57 73.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.144 177.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' B' ' 472' ' ' GLN . 61.0 mt -68.07 -37.58 81.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.149 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -61.7 -20.16 63.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.889 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -75.89 -17.75 59.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.965 0.412 . . . . 0.0 110.553 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.49 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 87.8 mt -65.94 -45.0 83.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.982 -178.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -68.9 -13.83 67.01 Favored Glycine 0 CA--C 1.52 0.344 0 CA-C-N 116.073 -0.512 . . . . 0.0 113.496 -176.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -107.31 5.9 27.96 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.122 0.487 . . . . 0.0 110.934 179.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 67.9 m -93.4 112.53 24.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.844 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.91 -26.24 68.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.543 -178.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 27.4 m -70.45 -42.24 71.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.532 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.49 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 24.0 tp -73.63 -44.83 55.96 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.889 -173.003 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.505 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 7.8 ptp180 -60.77 -28.32 68.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.233 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.5 t -61.66 -27.29 68.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.371 0.605 . . . . 0.0 109.861 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.448 ' O ' HD13 ' A' ' 110' ' ' LEU . 21.0 mt -83.98 -32.54 24.94 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.132 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.5 mp -75.76 2.67 11.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.14 0.495 . . . . 0.0 110.648 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 73.9 mt -79.39 -9.2 59.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.088 174.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -90.4 117.45 68.02 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.824 176.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.53 -39.55 87.72 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.159 2.573 . . . . 0.0 113.033 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -68.8 -41.96 77.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.81 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.451 ' O ' HD23 ' A' ' 110' ' ' LEU . 4.4 tt -60.15 -40.05 88.53 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -179.197 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.524 ' O ' HG23 ' A' ' 115' ' ' VAL . 59.7 mtm-85 -66.03 -40.53 91.1 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.419 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -63.88 -36.57 84.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.997 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.444 HD13 ' HB2' ' A' ' 136' ' ' PHE . 90.6 mt -58.62 -47.18 85.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.276 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.474 ' HB3' HD11 ' B' ' 478' ' ' ILE . 74.4 mtp -58.66 -47.45 84.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.978 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 111' ' ' ARG . 98.6 t -58.15 -42.49 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 CA-C-O 120.963 0.411 . . . . 0.0 111.188 178.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.413 ' HB2' ' OH ' ' A' ' 130' ' ' TYR . 92.3 m-20 -66.81 -44.55 80.91 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.134 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.566 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 50.7 tp -72.66 -31.09 64.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.415 -177.078 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.427 ' HB2' HG13 ' B' ' 478' ' ' ILE . 32.8 t70 -54.91 -44.05 73.84 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.027 0.441 . . . . 0.0 110.662 176.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 53.3 mt-30 -67.18 -30.7 70.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.008 -176.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.01 21.92 68.27 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.046 -0.979 . . . . 0.0 113.324 173.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -54.1 -50.09 67.63 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.834 0.35 . . . . 0.0 110.873 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.421 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 23.5 t0 -135.16 66.62 1.52 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.667 0.746 . . . . 0.0 109.367 172.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.648 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -52.74 -30.11 30.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.684 -1.143 . . . . 0.0 111.363 175.929 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.68 -40.3 96.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.807 0.337 . . . . 0.0 111.18 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -78.87 -47.92 15.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.739 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 82.3 mt -56.77 -47.1 80.87 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.635 -175.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.5 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.5 OUTLIER -56.03 -35.47 66.9 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -177.754 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -83.87 -44.16 14.58 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.114 0.483 . . . . 0.0 110.538 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.543 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.03 -21.17 65.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.025 -176.067 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.566 ' CE2' ' HB2' ' A' ' 117' ' ' LEU . 3.6 m-30 -81.66 -29.15 33.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.875 0.369 . . . . 0.0 111.006 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.591 ' HE2' HG12 ' A' ' 137' ' ' VAL . 2.7 mmt -77.57 -4.33 45.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.349 -176.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.543 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.9 pt20 -100.89 0.2 38.02 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 176.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -105.89 118.42 55.24 Favored Pre-proline 0 N--CA 1.449 -0.516 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.366 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.706 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 19.2 Cg_endo -60.99 -13.24 26.34 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.985 2.456 . . . . 0.0 112.108 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.77 -48.2 48.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.769 173.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.549 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 37.0 t80 -88.62 -29.86 19.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.829 0.347 . . . . 0.0 110.731 -169.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.706 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.9 m -56.52 -45.75 82.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.985 176.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.468 ' N ' HG23 ' A' ' 137' ' ' VAL . 34.5 mm-40 -58.32 -49.31 77.62 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.352 176.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' PHE . . . . . 0.421 ' HB2' HD11 ' A' ' 110' ' ' LEU . 76.4 t80 -54.14 -49.43 69.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.961 177.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.754 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.61 -52.73 59.6 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.28 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -62.45 -29.5 70.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.293 0.568 . . . . 0.0 110.44 -174.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 97.6 m -81.11 -46.76 14.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.605 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.418 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 29.5 p -65.28 -31.86 73.23 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.4 -177.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.754 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 65.7 mt -59.11 -41.03 87.19 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.693 178.549 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.411 ' HA2' ' OE2' ' A' ' 148' ' ' GLU . . . -69.41 -28.23 72.71 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.123 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 62.3 mt -80.16 -36.22 16.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-O 121.053 0.454 . . . . 0.0 110.485 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.471 ' HB ' HG21 ' A' ' 87' ' ' VAL . 19.0 m -93.61 7.44 5.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.02 -176.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.635 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 37.1 mt-10 -60.45 110.97 3.35 Favored Pre-proline 0 C--O 1.233 0.229 0 CA-C-O 120.534 0.207 . . . . 0.0 110.461 174.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' PRO . . . . . 0.446 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 69.4 Cg_endo -86.41 -2.21 8.48 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.852 2.368 . . . . 0.0 112.191 177.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 81.8 p 55.19 -169.48 0.08 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.172 -176.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 59.69 45.22 13.23 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.169 0.509 . . . . 0.0 110.416 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -57.75 130.85 48.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.041 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -86.1 156.4 20.39 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.73 -176.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 57.75 37.8 27.28 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.965 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 25.9 p . . . . . 0 C--O 1.25 1.094 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.001 179.573 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 10.0 t70 . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.94 0.4 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.53 -30.46 47.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.775 -171.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 70.1 mtm180 -61.33 -46.82 88.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.605 0.717 . . . . 0.0 109.274 177.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -64.72 -48.12 75.8 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.382 177.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.595 ' O ' HG12 ' B' ' 470' ' ' ILE . 40.4 mt-10 -59.36 -47.8 84.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.595 -177.232 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 467' ' ' ARG . . . . . 0.5 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 19.8 mtm180 -63.22 -40.76 98.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.376 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.73 -25.49 53.57 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -178.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.13 -37.46 79.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.154 171.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.595 HG12 ' O ' ' B' ' 466' ' ' GLU . 36.2 mm -60.01 -36.87 69.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.125 177.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 471' ' ' LEU . . . . . 0.533 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 93.1 mt -53.24 -49.93 65.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.387 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.482 ' HB3' HD11 ' A' ' 92' ' ' LEU . 1.9 mp0 -63.69 -40.61 97.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.922 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 61.6 m -59.04 -50.89 72.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.025 0.44 . . . . 0.0 110.035 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.643 ' O ' HG12 ' B' ' 478' ' ' ILE . 85.3 t -56.05 -58.45 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.541 175.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.533 ' HG2' ' O ' ' B' ' 471' ' ' LEU . 7.2 ptp180 -71.87 -20.2 61.84 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -169.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.53 -43.84 92.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 171.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 88.5 mt -70.14 -53.71 22.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.139 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.745 HG23 ' HB2' ' B' ' 482' ' ' PHE . 10.1 mm -53.3 -31.88 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.664 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 11.7 tppt? -53.23 -38.06 62.62 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.134 -174.182 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.77 -12.23 12.17 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.367 177.628 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -88.47 -60.61 1.92 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.352 -176.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 482' ' ' PHE . . . . . 0.745 ' HB2' HG23 ' B' ' 478' ' ' ILE . 98.4 m-85 -107.27 -87.22 0.48 Allowed 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.107 -0.637 . . . . 0.0 112.18 -174.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -112.41 -50.21 2.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.113 0.482 . . . . 0.0 111.199 -174.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.655 ' H ' HG22 ' B' ' 478' ' ' ILE . . . 80.83 38.56 15.8 Favored Glycine 0 N--CA 1.444 -0.827 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.668 177.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.459 HD13 HG23 ' B' ' 487' ' ' THR . 3.3 pp -108.32 149.59 28.47 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.872 0.368 . . . . 0.0 110.28 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 486' ' ' ASP . . . . . 0.44 ' HA ' HH12 ' B' ' 475' ' ' ARG . 32.6 m-20 -114.54 -8.54 12.75 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.732 0.301 . . . . 0.0 110.825 -177.28 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 487' ' ' THR . . . . . 0.459 HG23 HD13 ' B' ' 485' ' ' LEU . 60.7 p 51.81 27.64 4.36 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.843 0.857 . . . . 0.0 111.843 -177.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -127.53 -59.56 1.21 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.368 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 16.3 m -72.73 103.8 3.75 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.227 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -100.12 43.09 1.07 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.601 0.715 . . . . 0.0 109.466 176.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -94.04 17.72 11.9 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.636 -175.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 8.4 t -71.95 139.36 48.65 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 21.8 ttmm -71.88 94.91 1.48 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.013 -174.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 67.69 -60.33 0.39 Allowed 'General case' 0 N--CA 1.463 0.177 0 O-C-N 124.268 0.98 . . . . 0.0 112.44 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 24.2 t . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.018 178.813 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.792 0 N-CA-C 112.002 -0.439 . . . . 0.0 112.002 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -70.6 165.89 30.42 Favored 'Trans proline' 0 C--O 1.233 0.236 0 C-N-CA 123.183 2.588 . . . . 0.0 111.935 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -108.86 69.76 0.72 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.886 0.374 . . . . 0.0 111.161 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 48.5 tpp -81.06 151.78 28.2 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 175.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 62.49 40.85 10.35 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.259 0.552 . . . . 0.0 110.315 -175.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.485 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 39.8 ptt180 -75.59 150.0 38.15 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.718 -179.26 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.421 ' CG2' HG22 ' B' ' 469' ' ' VAL . 88.7 t -109.28 138.02 38.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.5 m -63.57 140.14 58.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.268 0.556 . . . . 0.0 110.887 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.524 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 10.2 tp -58.54 -40.04 81.89 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.05 -177.247 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -56.71 -37.44 70.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.722 178.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -67.53 -41.73 83.88 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.23 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.473 ' HA ' HD13 ' A' ' 95' ' ' LEU . 83.7 mt -69.69 -32.41 71.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.647 -176.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 9.2 mtpm? -62.82 -26.17 68.62 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -69.47 -21.5 63.7 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.734 0.302 . . . . 0.0 111.14 -177.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 92' ' ' LEU . 8.6 mp -64.54 -41.07 96.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.32 -174.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.69 -20.84 68.61 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.439 177.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -89.61 -22.9 22.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.72 0.295 . . . . 0.0 110.911 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.688 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 37.4 t -67.4 111.1 3.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.545 -177.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.31 -26.81 68.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.679 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.3 m -71.87 -48.04 48.63 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.049 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.3 tp -70.7 -46.72 62.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.793 -173.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.688 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -58.56 -29.83 66.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.876 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 33.7 t -67.16 -24.33 65.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.07 0.462 . . . . 0.0 110.049 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.5 mt -84.02 -36.11 23.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.678 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.479 HD21 HD13 ' B' ' 477' ' ' ILE . 11.2 mp -63.86 -22.53 66.96 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.433 177.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 76.7 mt -63.59 -16.86 62.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.971 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -79.47 120.26 79.73 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -62.41 -22.73 74.46 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 123.19 2.593 . . . . 0.0 113.013 -174.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.519 ' NE2' HD11 ' A' ' 113' ' ' LEU . 70.9 t60 -76.32 -48.9 18.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.009 178.099 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 135' ' ' LEU . 47.5 tp -61.91 -37.18 83.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.911 0.386 . . . . 0.0 111.148 -175.354 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -67.83 -22.16 65.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.56 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 64.9 mm-40 -74.98 -43.15 55.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.739 176.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.541 HD21 ' OE1' ' A' ' 133' ' ' GLU . 10.5 mp -52.19 -43.88 64.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.621 0.248 . . . . 0.0 111.352 176.03 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.468 ' HG2' HG22 ' B' ' 474' ' ' VAL . 55.8 mtm -59.91 -53.7 54.76 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.302 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.571 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 26.4 m -68.72 -23.98 28.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 111.518 -177.024 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -75.84 -51.71 11.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.169 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.482 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 60.7 tp -61.05 -34.5 74.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.454 -177.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.429 ' OD2' ' HG2' ' B' ' 475' ' ' ARG . 24.5 t70 -62.66 -35.55 79.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.415 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.571 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 69.0 mt-30 -63.27 -29.6 70.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.498 0.666 . . . . 0.0 111.169 -177.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.92 25.42 71.96 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 114.54 -1.209 . . . . 0.0 114.034 174.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -67.01 -46.47 74.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.295 0.548 . . . . 0.0 110.053 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.533 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 17.8 m-20 -141.63 46.4 1.69 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.697 176.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.68 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -48.32 -32.11 6.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.999 178.371 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.23 -49.89 75.82 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.468 0.175 . . . . 0.0 111.382 -177.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.473 ' HG2' ' HB3' ' A' ' 122' ' ' ASP . 58.6 pttt -75.76 -30.63 59.23 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.143 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 91.9 mt -63.58 -43.67 96.29 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.427 -179.148 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.6 mmt -50.61 -36.83 36.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.929 0.395 . . . . 0.0 111.169 177.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 30.0 mmm180 -81.74 -47.23 13.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.043 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.582 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.86 -24.34 66.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.972 -176.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.482 ' CE1' ' HB2' ' A' ' 117' ' ' LEU . 3.4 m-30 -78.86 -29.7 44.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.807 0.337 . . . . 0.0 111.098 -178.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 4.7 mmt -73.51 -10.33 59.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.358 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.3 pt20 -98.99 -15.3 19.13 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.104 -179.116 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.541 ' OE1' HD21 ' A' ' 113' ' ' LEU . 3.7 mt-10 -87.54 119.01 70.55 Favored Pre-proline 0 N--CA 1.451 -0.406 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.223 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.611 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 14.1 Cg_endo -56.25 -23.26 44.71 Favored 'Trans proline' 0 CA--C 1.52 -0.185 0 C-N-CA 123.066 2.511 . . . . 0.0 112.453 -173.105 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.435 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.5 mp -72.56 -42.09 65.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.324 -178.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.49 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 31.0 t80 -76.64 -29.97 56.67 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.189 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 133' ' ' GLU . 57.5 t -61.24 -44.7 98.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.048 176.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.611 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 42.0 mt-10 -67.63 -41.34 84.06 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.323 178.085 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -57.11 -50.93 71.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.11 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.714 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.71 -45.1 87.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.032 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -63.48 -29.77 71.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.381 0.61 . . . . 0.0 110.588 -174.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.445 ' O ' HG13 ' A' ' 146' ' ' ILE . 89.1 m -82.79 -47.86 11.45 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.359 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 29.1 p -62.92 -32.33 73.6 Favored 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 121.177 -0.209 . . . . 0.0 111.383 -174.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 79.3 mt -65.68 -26.87 67.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.809 0.338 . . . . 0.0 111.092 -178.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -85.87 -14.84 66.53 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.013 177.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 142' ' ' CYS . 32.5 mt -91.63 -42.96 13.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.867 0.365 . . . . 0.0 110.892 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.428 ' CG1' HD11 ' A' ' 95' ' ' LEU . 20.4 m -90.61 7.76 4.1 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.884 -174.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -58.75 119.72 39.6 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 121.128 0.49 . . . . 0.0 110.53 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -68.14 -28.73 34.08 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.734 2.289 . . . . 0.0 111.746 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 16.3 t 52.25 66.03 1.33 Allowed 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.745 0.653 . . . . 0.0 110.874 174.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLN . . . . . 0.495 ' HB2' ' HG3' ' A' ' 153' ' ' GLU . 44.7 mt-30 -110.12 31.96 5.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.141 -177.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 62.6 24.53 14.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.767 -177.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.495 ' HG3' ' HB2' ' A' ' 151' ' ' GLN . 0.0 OUTLIER -109.92 164.05 12.96 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.023 -179.113 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -98.12 120.63 38.86 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.519 -177.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 18.3 m . . . . . 0 C--O 1.249 1.049 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.11 176.964 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 3.5 t70 . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 121.111 0.481 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 47.9 mt -64.02 -36.18 75.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.459 -168.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 464' ' ' ARG . . . . . 0.475 ' HD3' ' N ' ' B' ' 465' ' ' HIS . 0.0 OUTLIER -75.19 -28.94 60.2 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.57 -176.21 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 465' ' ' HIS . . . . . 0.631 ' HA ' ' ND2' ' B' ' 468' ' ' ASN . 13.4 t60 -76.24 -45.33 33.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.132 173.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -63.17 -30.48 71.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 467' ' ' ARG . . . . . 0.444 ' O ' HD23 ' B' ' 471' ' ' LEU . 32.8 mtp180 -63.31 -55.07 27.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.613 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 468' ' ' ASN . . . . . 0.631 ' ND2' ' HA ' ' B' ' 465' ' ' HIS . 10.4 p30 -70.93 -18.57 62.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.829 0.823 . . . . 0.0 109.997 -174.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 469' ' ' VAL . . . . . 0.421 HG22 ' CG2' ' A' ' 87' ' ' VAL . 1.3 t -73.08 -20.2 18.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.52 178.169 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.49 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 35.8 mm -72.84 -37.35 54.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 122.188 0.994 . . . . 0.0 108.4 -178.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 471' ' ' LEU . . . . . 0.612 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.5 OUTLIER -51.28 -48.86 62.11 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 113.166 -1.834 . . . . 0.0 110.546 177.152 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.485 ' NE2' ' HA ' ' A' ' 86' ' ' ARG . 3.6 mm-40 -46.74 -54.23 10.16 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.798 -1.092 . . . . 0.0 110.498 174.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 33.0 m -60.79 -54.11 49.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.668 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.468 HG22 ' HG2' ' A' ' 114' ' ' MET . 75.7 t -48.61 -54.79 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.905 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.6 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 52.2 mtt180 -74.31 -19.8 60.35 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.883 -0.598 . . . . 0.0 112.402 -171.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -74.54 -45.7 43.91 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 172.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.479 HD13 HD21 ' A' ' 105' ' ' LEU . 92.2 mt -64.46 -55.11 23.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.772 -177.198 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.42 HG13 ' O ' ' B' ' 474' ' ' VAL . 52.4 mt -54.06 -26.18 14.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.059 0.457 . . . . 0.0 111.084 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.6 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 1.6 tppp? -73.04 -42.11 63.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.926 -172.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 480' ' ' LYS . . . . . 0.424 ' HD3' ' N ' ' B' ' 481' ' ' ASP . 0.0 OUTLIER -111.84 -15.66 13.32 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.876 -176.636 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 481' ' ' ASP . . . . . 0.424 ' N ' ' HD3' ' B' ' 480' ' ' LYS . 13.3 t70 -92.96 -59.73 1.98 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.162 0.506 . . . . 0.0 111.437 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -85.97 -85.95 0.15 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.582 -169.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -110.8 -46.15 3.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.1 0.476 . . . . 0.0 111.741 -169.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.443 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 93.98 1.07 65.51 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.519 -177.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 2.7 pp -94.44 173.01 7.84 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.592 0.234 . . . . 0.0 110.507 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -144.38 68.21 1.26 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.787 0.803 . . . . 0.0 110.128 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 7.7 p -78.9 61.29 3.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.865 -175.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -117.31 -13.91 10.42 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.673 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 15.0 m -84.73 100.42 11.49 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.156 0.503 . . . . 0.0 110.794 -176.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -114.62 83.81 1.96 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.199 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -110.73 18.92 19.14 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.148 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 16.1 m -120.86 55.75 1.03 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.154 0.502 . . . . 0.0 110.019 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -98.02 45.73 1.02 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.425 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -91.51 -50.21 5.91 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 175.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 C--O 1.247 0.925 0 CA-C-O 118.566 -0.73 . . . . 0.0 109.935 178.144 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.695 0 N-CA-C 112.101 -0.4 . . . . 0.0 112.101 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -63.09 -12.3 29.2 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 123.197 2.598 . . . . 0.0 113.39 -176.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 56.2 p-80 -65.46 -24.13 67.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.811 0.338 . . . . 0.0 110.936 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 47.9 tpp -103.66 87.46 2.83 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 177.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -79.97 -39.46 30.06 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.358 -175.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 -84.87 142.19 29.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.222 0.534 . . . . 0.0 110.486 -178.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 39.7 t -81.84 131.67 33.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.614 -172.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.3 m -63.98 144.82 56.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.468 176.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.533 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.85 -34.22 74.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.705 -173.892 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -61.24 -40.93 95.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.711 -0.222 . . . . 0.0 110.742 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -63.34 -39.42 94.49 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.576 ' HA ' HD13 ' A' ' 95' ' ' LEU . 88.2 mt -69.06 -32.42 71.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.64 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 97.4 mttt -58.04 -27.32 63.48 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -178.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.444 ' HB2' HG22 ' A' ' 146' ' ' ILE . 24.0 m-80 -72.64 -18.63 61.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.797 0.332 . . . . 0.0 111.277 -178.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.576 HD13 ' HA ' ' A' ' 92' ' ' LEU . 7.4 mp -71.02 -40.58 71.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.113 -175.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -63.05 -21.07 63.33 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.693 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -108.71 6.51 25.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.064 0.459 . . . . 0.0 110.739 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.625 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.9 t -76.96 108.54 10.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.24 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.14 67.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.131 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.1 m -71.7 -43.87 65.18 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.185 0.517 . . . . 0.0 110.78 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.542 HD12 HD11 ' A' ' 104' ' ' LEU . 21.4 tp -71.09 -49.56 43.15 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.446 -171.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.625 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.0 ptp180 -57.72 -32.07 67.05 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.327 -179.251 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 67.5 m -62.95 -40.23 97.02 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.542 HD11 HD12 ' A' ' 101' ' ' LEU . 0.5 OUTLIER -88.56 -15.75 34.35 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.508 -0.877 . . . . 0.0 112.161 -178.965 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.47 HD13 ' O ' ' A' ' 101' ' ' LEU . 8.7 mp -68.74 -12.06 61.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.194 0.521 . . . . 0.0 110.591 171.11 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 80.1 mt -73.14 -13.42 61.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.021 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -74.03 123.7 89.47 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.865 176.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.5 -30.34 90.52 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.111 2.54 . . . . 0.0 112.763 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -78.77 -41.29 30.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.657 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 104' ' ' LEU . 5.0 tt -63.18 -42.48 99.39 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -68.06 -27.19 66.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.151 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -70.84 -43.07 69.3 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.187 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.494 HD13 ' HB2' ' A' ' 136' ' ' PHE . 85.8 mt -56.11 -51.77 66.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.315 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 59.7 mtp -54.28 -54.15 44.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.829 -179.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.648 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.8 m -65.89 -34.45 70.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.343 -176.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -62.86 -46.36 88.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.086 0.47 . . . . 0.0 110.61 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.45 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 62.7 tp -64.47 -36.39 84.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.621 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.41 -36.74 84.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.802 177.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.648 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 75.7 mt-30 -68.2 -32.15 72.17 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.868 0.842 . . . . 0.0 110.508 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 66.11 27.08 72.63 Favored Glycine 0 N--CA 1.447 -0.567 0 CA-C-N 114.145 -1.389 . . . . 0.0 113.18 175.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.67 -32.38 59.18 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.176 0.512 . . . . 0.0 110.806 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.499 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 15.4 t0 -160.52 69.23 0.37 Allowed 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 168.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.512 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -55.31 -26.77 42.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.007 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.75 -49.39 73.22 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.057 0.456 . . . . 0.0 110.596 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.0 -38.03 66.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.557 178.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 95.4 mt -61.65 -46.67 88.79 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.162 -177.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -54.88 -33.86 62.4 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.006 0.431 . . . . 0.0 111.187 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -79.34 -49.08 12.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.449 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.679 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.45 -27.03 67.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.057 -176.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.592 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.2 m-30 -79.26 -27.54 42.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.877 0.37 . . . . 0.0 111.436 -176.817 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.513 ' HE2' HG12 ' A' ' 137' ' ' VAL . 3.3 mmt -86.13 3.42 42.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.821 0.344 . . . . 0.0 111.574 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.679 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.8 pt20 -100.56 -19.61 16.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.039 0.447 . . . . 0.0 109.965 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -105.36 137.45 19.27 Favored Pre-proline 0 N--CA 1.448 -0.548 0 CA-C-O 121.393 0.616 . . . . 0.0 111.688 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.674 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 56.4 Cg_endo -68.45 -11.87 33.19 Favored 'Trans proline' 0 CA--C 1.527 0.144 0 C-N-CA 123.904 3.069 . . . . 0.0 113.974 -173.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 45.5 mt -77.8 -37.62 48.33 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.427 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.592 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 45.5 t80 -88.98 -32.1 17.8 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.573 -173.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.674 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 10.5 m -54.87 -44.89 74.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.831 176.013 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 25.7 mm-40 -57.62 -50.29 73.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.433 176.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -54.94 -48.93 72.51 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.211 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.762 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.28 -49.55 71.37 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.052 -0.977 . . . . 0.0 111.019 -177.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.71 -31.11 72.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.218 0.532 . . . . 0.0 110.55 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.547 ' O ' HG13 ' A' ' 146' ' ' ILE . 65.4 m -70.61 -47.72 58.72 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.018 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 28.3 p -67.5 -30.98 70.8 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.526 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.762 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.8 mt -65.71 -27.95 68.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.708 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -83.24 -14.67 73.78 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.226 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 142' ' ' CYS . 21.1 mt -91.8 -40.83 12.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.199 0.523 . . . . 0.0 110.505 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 15.3 m -94.75 7.5 6.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.398 -177.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -53.9 126.82 51.89 Favored Pre-proline 0 C--O 1.234 0.252 0 CA-C-O 121.369 0.604 . . . . 0.0 112.112 -173.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.81 -3.17 13.51 Favored 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 122.936 2.424 . . . . 0.0 111.295 175.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 3.4 p -84.18 16.7 2.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.497 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -70.69 127.15 31.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.673 176.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -69.74 129.5 39.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.799 0.333 . . . . 0.0 110.203 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -77.6 129.94 36.25 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.854 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -71.29 96.51 1.44 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.143 0.497 . . . . 0.0 110.37 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 3.1 p . . . . . 0 C--O 1.248 1.017 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.394 179.355 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 . . . . . 0 N--CA 1.48 1.033 0 CA-C-O 121.066 0.46 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 29.4 mm -85.82 -19.89 8.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 -176.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -57.76 -35.46 70.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.915 0.388 . . . . 0.0 110.769 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -69.95 -48.9 56.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.962 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.456 ' O ' HG12 ' B' ' 470' ' ' ILE . 6.5 mm-40 -55.91 -50.42 70.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.93 -178.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -59.92 -40.86 90.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.396 -176.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -79.0 -23.46 44.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.382 0.61 . . . . 0.0 109.666 -178.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -65.32 -32.15 56.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.422 173.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.456 HG12 ' O ' ' B' ' 466' ' ' GLU . 26.3 mm -61.94 -29.87 47.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.391 179.054 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 83.7 mt -63.53 -31.86 73.15 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.881 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -71.7 -35.22 70.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.059 0.457 . . . . 0.0 110.092 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 45.4 m -72.7 -59.08 2.89 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.077 -177.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.41 ' O ' HG13 ' B' ' 478' ' ' ILE . 11.5 p -54.95 -45.34 76.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.085 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 18.8 tpp85 -65.68 -35.17 80.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.634 0.254 . . . . 0.0 110.96 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.06 -47.88 78.42 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 120.687 0.28 . . . . 0.0 110.65 -179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 50.6 mt -67.55 -55.4 17.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.846 -174.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.738 HG23 ' HB2' ' B' ' 482' ' ' PHE . 46.3 mt -58.52 -25.55 28.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.156 -175.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.531 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 22.8 tptp -65.09 -34.6 78.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.219 -173.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 480' ' ' LYS . . . . . 0.46 ' HD2' ' H ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER -116.46 -15.47 10.9 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.884 176.372 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -89.57 -57.17 2.97 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 482' ' ' PHE . . . . . 0.738 ' HB2' HG23 ' B' ' 478' ' ' ILE . 69.7 m-85 -89.64 -89.68 0.15 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.776 -172.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -100.91 -47.74 4.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.851 0.358 . . . . 0.0 111.093 -173.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.523 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 95.47 3.62 61.2 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.668 176.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' B' ' 485' ' ' LEU . 3.1 pp -94.8 159.71 14.93 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.407 0.622 . . . . 0.0 111.383 -174.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -153.49 -12.81 0.15 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.958 177.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 13.4 t -83.64 -11.49 57.2 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.823 178.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -93.19 -160.12 0.73 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 42.3 m 64.51 18.38 11.33 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.814 0.696 . . . . 0.0 111.048 -178.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -95.79 3.44 53.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.835 177.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -83.1 19.13 1.49 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.158 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 17.0 t -79.61 134.45 36.45 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -78.1 92.5 4.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.988 0.423 . . . . 0.0 110.815 -175.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -107.59 -51.83 2.85 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.909 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 2.9 m . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.794 178.563 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.587 0 N-CA-C 111.655 -0.578 . . . . 0.0 111.655 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -69.57 124.17 10.89 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.4 2.067 . . . . 0.0 111.956 178.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -128.56 123.05 32.43 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.078 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 17.1 ptp -78.29 73.92 4.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.5 0.667 . . . . 0.0 110.676 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -67.22 -29.16 68.73 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -91.29 140.11 30.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.154 171.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 24.5 t -80.55 134.72 26.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.099 -173.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.1 m -67.58 144.34 55.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.981 176.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.523 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 1.6 tt -62.32 -33.38 74.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.994 -173.22 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -56.01 -43.66 77.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.665 174.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -68.66 -28.09 66.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.412 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 90.7 mt -78.68 -35.26 45.43 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.622 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 50.1 mtpt -57.72 -29.49 64.77 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.157 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -73.22 -18.66 61.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.606 0.241 . . . . 0.0 111.082 -176.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.512 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 82.1 mt -62.67 -47.16 84.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.032 -175.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.93 -15.36 81.03 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.259 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 93' ' ' LYS . 17.4 mm-40 -95.5 -16.0 22.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.15 0.5 . . . . 0.0 110.397 -177.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.61 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 33.0 t -77.49 121.31 23.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.967 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.45 -27.62 67.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.629 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.6 m -69.24 -45.93 68.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.225 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.512 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 38.8 tp -71.11 -46.97 60.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.57 -173.589 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 98' ' ' SER . 8.9 ptp180 -60.29 -27.27 67.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.534 -178.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.6 m -62.99 -22.88 67.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.974 0.416 . . . . 0.0 110.662 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 110' ' ' LEU . 17.5 mt -86.57 -34.38 19.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.32 0.581 . . . . 0.0 109.717 178.267 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.485 HD21 HD13 ' B' ' 477' ' ' ILE . 9.3 mp -64.1 -18.37 64.34 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.612 178.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 63.7 mt -66.06 -21.02 66.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.293 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -78.39 118.1 70.24 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.265 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.4 -36.66 97.54 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.069 2.512 . . . . 0.0 112.589 178.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.3 t60 -68.29 -44.06 76.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.86 0.362 . . . . 0.0 110.558 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 104' ' ' LEU . 4.4 tt -65.59 -46.01 81.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.277 -176.395 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.419 ' O ' HG23 ' A' ' 115' ' ' VAL . 13.5 ptp180 -64.47 -34.18 77.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.491 -179.057 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -66.65 -34.97 79.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.947 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.3 mt -59.47 -48.59 81.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.129 0.49 . . . . 0.0 109.717 174.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 68.6 mtp -55.75 -52.09 65.14 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.973 176.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.494 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 84.0 t -60.25 -38.83 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.542 -179.137 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -64.56 -43.01 95.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.07 0.462 . . . . 0.0 111.071 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 56.4 tp -67.55 -38.41 84.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.57 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.435 ' HB2' HD12 ' B' ' 478' ' ' ILE . 23.8 t0 -63.97 -27.83 69.4 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.084 0.469 . . . . 0.0 111.375 -175.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 70.9 mt-30 -63.19 -29.77 71.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.516 0.674 . . . . 0.0 110.785 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.5 29.3 72.93 Favored Glycine 0 CA--C 1.518 0.226 0 CA-C-N 114.551 -1.204 . . . . 0.0 114.239 172.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -73.1 -55.45 6.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.568 0.699 . . . . 0.0 109.526 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -135.16 50.85 2.12 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.502 176.349 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.598 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -48.68 -37.57 18.89 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 113.505 -1.679 . . . . 0.0 111.961 179.003 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.16 -46.53 77.1 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.908 0.385 . . . . 0.0 110.866 -176.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -65.57 -41.91 92.39 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.183 177.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.475 HD22 ' CE2' ' A' ' 130' ' ' TYR . 95.5 mt -62.63 -43.67 98.22 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.572 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -34.67 65.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.933 0.397 . . . . 0.0 111.142 -178.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.9 mmm180 -77.01 -46.09 25.04 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.007 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.93 -38.65 86.56 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.421 -178.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.475 ' CE2' HD22 ' A' ' 126' ' ' LEU . 3.2 m-30 -72.31 -21.78 61.28 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.865 -174.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.448 ' HE2' HG12 ' A' ' 137' ' ' VAL . 3.6 mmt -79.43 -1.23 36.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.14 -179.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -98.79 -20.03 17.11 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 175.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -88.17 120.89 70.72 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.733 -175.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.678 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 27.9 Cg_endo -62.2 -14.11 36.13 Favored 'Trans proline' 0 N--CA 1.465 -0.157 0 C-N-CA 122.863 2.375 . . . . 0.0 112.671 -175.329 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.3 mp -77.32 -40.26 44.88 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.592 176.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.425 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 32.8 t80 -88.74 -31.01 18.63 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.066 -172.119 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.678 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 16.6 m -58.47 -49.11 83.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.246 177.177 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.53 ' N ' HG23 ' A' ' 137' ' ' VAL . 11.0 pt-20 -70.96 -36.64 72.64 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.558 179.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -56.29 -48.07 77.36 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 174.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.779 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.46 -49.78 74.07 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.726 178.027 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -62.09 -30.76 71.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.209 0.528 . . . . 0.0 110.627 -175.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 64.6 m -77.3 -45.29 26.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.537 -179.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.437 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.3 p -69.33 -28.11 65.96 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.861 0.362 . . . . 0.0 110.53 -177.445 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 83.3 mt -62.13 -31.3 71.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.69 178.163 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.534 ' HA2' ' OE2' ' A' ' 148' ' ' GLU . . . -79.87 -17.69 74.36 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.452 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 49.0 mt -91.16 -26.24 5.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.109 0.48 . . . . 0.0 110.569 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.408 HG13 HD21 ' A' ' 95' ' ' LEU . 17.3 m -104.05 -3.43 9.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.599 -177.198 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.534 ' OE2' ' HA2' ' A' ' 145' ' ' GLY . 12.7 pt-20 -71.66 124.32 90.73 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.255 0.55 . . . . 0.0 110.393 -178.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.9 -8.35 23.42 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.891 2.394 . . . . 0.0 111.452 177.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 5.4 p -86.82 57.48 4.53 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.307 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' GLN . . . . . 0.415 ' HA ' ' OE1' ' A' ' 151' ' ' GLN . 15.9 mm-40 -71.97 85.8 0.99 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.609 -179.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 67.68 109.64 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.168 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -88.62 -29.68 19.78 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.479 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -138.05 111.81 8.28 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.165 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.616 -0.706 . . . . 0.0 110.225 179.223 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 47.3 mm -57.83 -40.12 74.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.071 -173.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -58.56 -43.36 89.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.886 0.375 . . . . 0.0 110.772 178.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -64.12 -48.83 74.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.067 175.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.58 ' O ' HG12 ' B' ' 470' ' ' ILE . 43.4 mt-10 -60.14 -43.83 95.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.45 -176.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -58.78 -39.97 82.62 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -30.89 60.23 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.5 t -62.46 -35.51 70.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.584 176.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.58 HG12 ' O ' ' B' ' 466' ' ' GLU . 31.6 mm -63.41 -34.85 69.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.493 178.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 82.8 mt -57.44 -42.5 82.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.691 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -62.78 -43.11 99.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.441 177.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 56.1 m -63.65 -55.5 23.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.752 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.455 ' O ' HG13 ' B' ' 478' ' ' ILE . 75.0 t -51.16 -55.7 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.868 178.274 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -68.85 -32.13 71.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.582 -172.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.14 -47.03 88.13 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 120.962 0.41 . . . . 0.0 109.941 177.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.485 HD13 HD21 ' A' ' 105' ' ' LEU . 79.6 mt -63.54 -53.34 46.4 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.099 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.798 HG23 ' HB2' ' B' ' 482' ' ' PHE . 49.9 mt -58.63 -26.76 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.868 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.525 ' HA ' ' CA ' ' B' ' 484' ' ' GLY . 27.0 tptp -57.7 -41.31 81.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.736 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.19 -16.8 14.5 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.872 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -89.55 -59.32 2.24 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.742 0.306 . . . . 0.0 111.523 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 482' ' ' PHE . . . . . 0.798 ' HB2' HG23 ' B' ' 478' ' ' ILE . 83.3 m-85 -107.63 -90.43 0.44 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.767 -172.266 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -113.48 -50.24 2.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.682 0.277 . . . . 0.0 111.1 -172.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.765 ' H ' HG22 ' B' ' 478' ' ' ILE . . . 79.43 51.19 5.35 Favored Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.305 -0.95 . . . . 0.0 111.404 -177.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 85.9 mt -72.78 169.35 16.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.276 0.56 . . . . 0.0 111.593 -176.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -140.26 23.34 2.36 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.155 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 44.5 p 51.42 35.88 15.22 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.971 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -113.08 92.11 3.89 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.776 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 489' ' ' SER . . . . . 0.402 ' OG ' ' HE2' ' B' ' 491' ' ' LYS . 6.2 p -87.13 145.43 26.44 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.679 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -81.58 56.62 3.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.191 0.52 . . . . 0.0 111.297 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 491' ' ' LYS . . . . . 0.402 ' HE2' ' OG ' ' B' ' 489' ' ' SER . 66.4 mttm -78.65 93.67 4.92 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.593 177.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 11.0 t 62.97 30.32 16.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.081 -176.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? -86.93 88.98 7.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.698 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -100.89 -57.5 2.09 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.993 0.425 . . . . 0.0 109.868 177.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 47.6 t . . . . . 0 C--O 1.251 1.133 0 CA-C-O 118.436 -0.792 . . . . 0.0 110.149 179.161 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.645 0 N-CA-C 111.475 -0.65 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -67.61 76.85 0.54 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 123.1 2.533 . . . . 0.0 112.142 177.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 48.7 t60 -141.81 46.29 1.67 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.283 0.563 . . . . 0.0 109.781 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 57.7 ttp -106.7 -23.42 12.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.959 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -71.47 -56.98 4.86 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.183 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -91.35 129.14 37.37 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 173.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.545 HG21 ' HB ' ' A' ' 147' ' ' VAL . 12.0 p -84.16 154.11 3.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.168 -173.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.7 m -59.36 141.33 54.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.467 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 92' ' ' LEU . 3.2 tt -68.03 -30.97 70.32 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.865 -178.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -54.25 -43.97 71.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.48 173.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.438 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 2.8 m-20 -63.31 -35.63 81.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.137 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 89' ' ' LEU . 44.6 mt -71.01 -34.47 71.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.194 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.449 ' NZ ' ' HB3' ' A' ' 93' ' ' LYS . 9.8 mtpm? -59.64 -24.13 63.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.317 -0.401 . . . . 0.0 112.053 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -77.42 -17.44 58.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.177 -179.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.556 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 91.8 mt -62.7 -46.02 90.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.438 -176.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.66 -18.32 69.99 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.622 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -84.67 -16.19 42.73 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.938 0.399 . . . . 0.0 110.608 -179.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.646 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.7 t -78.27 122.07 25.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.084 -176.409 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.51 -25.2 63.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.428 177.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 97.2 m -72.78 -45.2 59.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.919 178.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.556 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 36.2 tp -69.45 -51.26 37.83 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.766 -172.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.646 ' HG2' ' O ' ' A' ' 98' ' ' SER . 6.2 ptp180 -58.45 -29.5 66.2 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.974 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 33.3 t -62.05 -42.67 99.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -178.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.682 HD21 ' SG ' ' A' ' 142' ' ' CYS . 0.5 OUTLIER -87.96 -16.2 34.46 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.261 -178.608 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.495 HD13 ' O ' ' A' ' 101' ' ' LEU . 9.4 mp -69.36 -12.22 61.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.179 0.514 . . . . 0.0 110.541 171.085 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 83.1 mt -73.09 -17.63 61.39 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.792 178.128 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -71.0 118.75 68.44 Favored Pre-proline 0 C--O 1.234 0.256 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.34 -32.37 71.71 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 123.063 2.509 . . . . 0.0 112.755 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -71.56 -49.86 36.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.534 0.206 . . . . 0.0 110.849 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.57 HD21 ' HB2' ' A' ' 139' ' ' PHE . 33.2 tp -63.51 -43.17 97.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 120.774 0.321 . . . . 0.0 111.077 -176.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -66.15 -30.59 71.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.182 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLN . . . . . 0.433 ' HA ' HG22 ' A' ' 115' ' ' VAL . 15.7 mm-40 -72.33 -39.3 68.29 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.654 175.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 72.4 mt -56.72 -50.24 72.78 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.405 ' HG2' HG23 ' B' ' 474' ' ' VAL . 57.5 mtp -53.94 -55.51 26.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.904 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.625 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 34.5 m -67.21 -23.89 31.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -176.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 57.3 m-20 -72.22 -38.81 68.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.189 0.519 . . . . 0.0 110.69 177.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.27 -43.61 81.4 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.521 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -61.61 -16.55 49.31 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.604 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.625 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 77.6 mt-30 -74.43 -29.73 61.61 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.4 14.93 60.62 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 114.578 -1.192 . . . . 0.0 113.908 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -55.14 -55.03 35.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.475 0.655 . . . . 0.0 110.186 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -135.09 55.8 1.87 Allowed 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.909 175.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.635 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -49.96 -30.52 10.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.933 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.86 -53.06 61.08 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.724 0.297 . . . . 0.0 111.09 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -75.72 -28.75 58.67 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.494 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.487 HD22 ' CE2' ' A' ' 130' ' ' TYR . 94.6 mt -64.25 -48.71 74.74 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.41 178.016 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.95 -40.21 60.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.951 0.405 . . . . 0.0 111.403 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -79.26 -44.84 20.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.972 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.588 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.99 -26.88 65.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.693 -176.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.487 ' CE2' HD22 ' A' ' 126' ' ' LEU . 4.3 m-30 -76.85 -29.44 55.86 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.93 0.395 . . . . 0.0 110.992 -178.462 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.424 ' HA ' ' CE ' ' A' ' 131' ' ' MET . 1.4 mmt -76.33 -2.79 33.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.89 -175.223 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.588 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.3 pt20 -103.96 -8.11 19.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.085 0.469 . . . . 0.0 110.416 176.58 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.472 ' O ' HG23 ' A' ' 137' ' ' VAL . 7.3 mt-10 -95.08 118.85 66.48 Favored Pre-proline 0 N--CA 1.449 -0.522 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 -178.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.472 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 19.7 Cg_endo -58.47 -21.39 53.8 Favored 'Trans proline' 0 CA--C 1.519 -0.244 0 C-N-CA 122.826 2.351 . . . . 0.0 111.976 -177.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.37 -39.02 81.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.28 177.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -87.86 -29.15 21.13 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.225 -178.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 133' ' ' GLU . 86.4 t -62.82 -44.06 99.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.696 177.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 14.0 pt-20 -67.76 -32.88 73.79 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.404 179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' PHE . . . . . 0.57 ' HB2' HD21 ' A' ' 110' ' ' LEU . 30.6 t80 -61.91 -52.73 62.91 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.062 0.458 . . . . 0.0 109.948 174.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.702 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -59.6 -42.75 93.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.175 -178.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -62.72 -33.04 74.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.418 0.628 . . . . 0.0 110.427 -175.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.682 ' SG ' HD21 ' A' ' 104' ' ' LEU . 89.4 m -75.74 -47.93 23.94 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.167 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.544 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 22.4 p -67.58 -32.81 73.82 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.933 -176.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.3 mt -69.56 -27.16 64.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.063 -179.099 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -79.29 -20.64 69.09 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.465 -0.874 . . . . 0.0 111.807 177.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 65.5 mt -91.04 -35.89 7.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.84 0.352 . . . . 0.0 111.342 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.545 ' HB ' HG21 ' A' ' 87' ' ' VAL . 30.9 m -83.2 5.24 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.309 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -79.24 110.54 15.3 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 170.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -66.16 -37.08 26.43 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.957 2.438 . . . . 0.0 112.373 -177.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 18.0 m -117.4 99.39 6.97 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' GLN . . . . . 0.45 ' HA ' ' OE1' ' A' ' 151' ' ' GLN . 14.6 mm-40 -64.77 105.92 1.1 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.185 0.517 . . . . 0.0 110.861 -176.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 -115.99 125.51 52.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.624 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.463 ' H ' ' CD ' ' A' ' 153' ' ' GLU . 2.8 mp0 -64.21 129.01 38.26 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.829 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -82.1 43.1 0.77 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.563 0.696 . . . . 0.0 110.543 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.248 0.988 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.545 -179.536 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 462' ' ' ASP . . . . . 0.639 ' O ' ' HG2' ' B' ' 466' ' ' GLU . 10.9 t70 . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 121.474 0.654 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 43.0 mm -68.19 -37.98 78.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.354 -170.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -70.83 -25.28 62.77 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.198 -176.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -74.17 -50.92 17.18 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.366 174.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.639 ' HG2' ' O ' ' B' ' 462' ' ' ASP . 54.7 mm-40 -54.86 -44.63 74.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.07 -175.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -59.0 -35.51 73.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.994 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -31.1 54.94 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -178.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.1 -36.67 78.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.722 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.574 HG12 ' O ' ' B' ' 466' ' ' GLU . 28.3 mm -60.99 -36.91 75.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.346 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 90.3 mt -57.13 -44.24 83.13 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.809 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.48 ' HB3' HD11 ' A' ' 92' ' ' LEU . 2.1 mp0 -62.71 -38.9 92.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.663 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 473' ' ' CYS . . . . . 0.425 ' O ' HG13 ' B' ' 477' ' ' ILE . 60.5 m -66.72 -59.9 3.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.175 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.405 HG23 ' HG2' ' A' ' 114' ' ' MET . 10.3 p -54.36 -43.78 63.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.04 -179.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.529 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 73.6 mtp180 -67.65 -30.29 69.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.523 0.202 . . . . 0.0 111.373 -177.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 476' ' ' TYR . . . . . 0.413 ' CZ ' ' HE2' ' B' ' 480' ' ' LYS . 0.5 OUTLIER -68.77 -46.83 67.74 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.09 0.471 . . . . 0.0 109.929 176.42 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.456 HD13 HD21 ' A' ' 105' ' ' LEU . 56.5 mt -64.55 -51.82 62.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.257 -175.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.49 HG23 ' HB2' ' B' ' 482' ' ' PHE . 61.8 mt -56.59 -24.85 19.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.758 177.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.64 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 13.4 ttmm -71.23 -32.85 69.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.87 -173.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 480' ' ' LYS . . . . . 0.413 ' HE2' ' CZ ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER -115.86 -16.57 11.15 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.795 -0.762 . . . . 0.0 112.308 176.842 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -92.0 -57.39 2.74 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.005 0.431 . . . . 0.0 111.944 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 482' ' ' PHE . . . . . 0.49 ' HB2' HG23 ' B' ' 478' ' ' ILE . 96.4 m-85 -97.41 -92.86 0.23 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.168 -171.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -84.84 -48.66 9.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.272 0.558 . . . . 0.0 111.267 -172.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.64 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 89.24 11.47 64.63 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.362 -0.836 . . . . 0.0 113.436 177.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 3.4 pp -115.3 160.04 20.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.942 0.401 . . . . 0.0 111.476 -174.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -125.39 -43.95 1.89 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.701 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 3.5 t -127.8 64.26 1.37 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.958 0.885 . . . . 0.0 110.387 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -122.64 -64.24 1.2 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.826 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 19.4 m -90.34 11.41 21.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.52 -173.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -91.57 16.45 10.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.573 -176.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -108.77 -168.45 1.35 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.254 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 55.4 m 68.19 36.32 3.23 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.509 173.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -97.72 13.83 28.95 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.337 0.589 . . . . 0.0 110.617 176.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -105.11 -3.77 22.66 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.848 -178.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 C--O 1.246 0.896 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.658 -178.002 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.933 0 N-CA-C 111.915 -0.474 . . . . 0.0 111.915 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.28 112.07 1.06 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.082 2.521 . . . . 0.0 112.115 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 62.23 25.66 15.35 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.831 0.824 . . . . 0.0 109.927 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 51.1 ttm -142.39 62.96 1.41 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.145 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -84.11 -20.13 33.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.206 -178.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.0 ptp180 -79.58 146.75 32.41 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 173.028 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.4 p -110.46 160.89 9.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.771 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.0 m -72.41 164.58 26.12 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.783 0.325 . . . . 0.0 111.593 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.442 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -69.82 -38.76 76.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.503 -176.652 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -53.1 -42.05 65.56 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.116 0.484 . . . . 0.0 110.877 177.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.46 ' O ' HG12 ' A' ' 147' ' ' VAL . 3.1 m-20 -67.02 -23.08 65.87 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.999 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.51 ' HA ' HD13 ' A' ' 95' ' ' LEU . 81.2 mt -87.17 -34.37 19.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.098 0.475 . . . . 0.0 110.753 177.349 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 2.6 mmmp? -56.72 -36.51 69.8 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.76 -15.81 61.19 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -174.273 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.51 HD13 ' HA ' ' A' ' 92' ' ' LEU . 8.3 mp -63.46 -42.9 98.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.81 0.338 . . . . 0.0 110.834 -178.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -71.08 -13.26 72.72 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.711 176.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -94.27 -11.3 30.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.238 0.542 . . . . 0.0 109.779 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.644 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.4 t -81.61 113.08 19.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.578 -176.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.83 -25.65 67.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.62 178.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 63.3 m -71.29 -46.06 61.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.054 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.419 HD11 ' CD2' ' A' ' 139' ' ' PHE . 61.1 tp -72.3 -45.98 57.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.563 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -58.59 -31.05 67.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.116 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.432 ' HA ' HD23 ' A' ' 106' ' ' LEU . 37.6 t -62.54 -22.5 66.36 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.228 0.537 . . . . 0.0 110.423 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.452 HD11 ' SG ' ' A' ' 142' ' ' CYS . 21.7 mt -84.44 -31.71 24.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.876 178.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.24 -2.1 17.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.203 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.2 mm? -67.28 -18.43 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.836 0.351 . . . . 0.0 110.235 172.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -84.84 115.41 60.78 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.902 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.36 -37.89 92.98 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.776 2.317 . . . . 0.0 111.879 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.483 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 66.7 t60 -60.28 -46.95 88.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.724 177.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.448 ' O ' HD23 ' A' ' 110' ' ' LEU . 4.4 tt -59.67 -40.72 88.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.176 0.512 . . . . 0.0 109.64 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 111' ' ' ARG . 23.2 mtm180 -66.38 -40.32 89.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.447 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -62.63 -37.18 85.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.675 176.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 109' ' ' HIS . 86.1 mt -58.02 -52.22 66.41 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 175.105 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.41 ' HG2' HG22 ' B' ' 474' ' ' VAL . 65.5 mtp -53.41 -51.72 61.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.871 176.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.598 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 56.8 t -58.38 -46.65 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.351 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -60.48 -42.8 97.02 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.032 0.444 . . . . 0.0 111.488 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.507 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 54.3 tp -68.01 -36.02 79.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.887 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.12 -24.27 63.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.064 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.598 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 25.8 mt-30 -61.98 -30.65 71.08 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.725 0.774 . . . . 0.0 110.612 177.611 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.49 25.82 74.67 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 114.336 -1.302 . . . . 0.0 113.368 174.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.437 ' CD ' ' HB3' ' B' ' 488' ' ' ASN . 5.5 mm-40 -76.73 -55.39 5.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.208 0.527 . . . . 0.0 109.826 -178.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.513 ' OD2' ' HE2' ' A' ' 125' ' ' LYS . 4.5 p-10 -135.01 43.12 2.73 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.887 177.052 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.646 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.59 -35.68 9.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.974 177.054 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.41 -42.16 98.75 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.014 0.435 . . . . 0.0 110.97 -177.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.513 ' HE2' ' OD2' ' A' ' 122' ' ' ASP . 35.7 ttpt -72.79 -44.99 60.86 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.2 0.524 . . . . 0.0 110.059 175.708 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.444 HD22 ' HE2' ' A' ' 130' ' ' TYR . 95.1 mt -56.72 -38.72 72.73 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.326 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.7 mmt -51.2 -40.0 57.74 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 110.959 177.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 24.0 mmm180 -79.32 -40.41 30.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.826 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.574 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.76 -27.28 67.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.692 -177.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.507 ' CE1' ' HB2' ' A' ' 117' ' ' LEU . 3.3 m-30 -81.87 -29.32 32.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.977 0.418 . . . . 0.0 111.21 -176.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.494 ' HE2' HG12 ' A' ' 137' ' ' VAL . 15.0 mmt -77.32 4.98 9.45 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.539 -177.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.574 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 20.7 pt20 -107.07 -9.54 16.16 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.189 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -99.27 120.08 58.95 Favored Pre-proline 0 N--CA 1.452 -0.362 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.769 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.69 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 27.7 Cg_endo -62.38 -13.76 34.75 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.797 2.332 . . . . 0.0 112.224 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.0 mp -72.84 -46.39 53.25 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.611 176.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.498 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 32.3 t80 -87.04 -31.4 20.55 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.493 -169.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.69 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.7 m -56.93 -48.29 81.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.879 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 37.4 mt-10 -65.56 -42.57 91.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.638 178.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' PHE . . . . . 0.419 ' CD2' HD11 ' A' ' 101' ' ' LEU . 60.0 t80 -53.89 -50.05 67.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.376 0.607 . . . . 0.0 109.609 176.239 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.757 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.35 -46.32 87.14 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.098 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.31 -28.93 69.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.31 0.576 . . . . 0.0 110.948 -174.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.452 ' SG ' HD11 ' A' ' 104' ' ' LEU . 91.5 m -80.84 -41.83 22.56 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.685 -177.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 27.9 p -69.79 -27.34 64.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.616 0.246 . . . . 0.0 111.151 -177.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.757 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 81.6 mt -59.64 -44.9 93.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.059 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -65.11 -17.66 63.81 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.615 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 20.6 mt -91.7 -31.56 4.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.765 0.316 . . . . 0.0 111.054 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.461 ' O ' ' HD3' ' A' ' 149' ' ' PRO . 13.6 m -98.48 -17.41 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -75.83 110.68 11.51 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-O 120.917 0.389 . . . . 0.0 110.286 178.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 86.1 Cg_endo -80.81 -9.13 13.28 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.824 2.349 . . . . 0.0 112.741 -177.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 26.2 t 59.13 -154.29 0.37 Allowed 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -175.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.29 154.91 22.67 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.879 0.371 . . . . 0.0 110.016 172.484 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -107.56 30.28 6.42 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.223 0.535 . . . . 0.0 110.324 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -77.59 -16.74 58.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.877 176.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -147.55 126.48 12.76 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.395 176.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 19.3 t . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.527 -0.749 . . . . 0.0 109.842 179.187 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 462' ' ' ASP . . . . . 0.405 ' OD2' ' HB2' ' B' ' 464' ' ' ARG . 14.2 t70 . . . . . 0 N--CA 1.482 1.154 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 463' ' ' ILE . . . . . 0.579 ' HA ' ' HG2' ' B' ' 466' ' ' GLU . 27.3 mt -72.1 -24.57 22.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.596 -170.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 464' ' ' ARG . . . . . 0.405 ' HB2' ' OD2' ' B' ' 462' ' ' ASP . 84.2 mtm180 -66.89 -35.3 79.7 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 465' ' ' HIS . . . . . 0.493 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 19.0 t60 -73.38 -47.67 40.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.672 -177.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.581 ' O ' HG12 ' B' ' 470' ' ' ILE . 12.3 pt-20 -63.21 -36.91 85.22 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.779 -176.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -61.77 -40.82 96.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.418 . . . . 0.0 112.039 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 468' ' ' ASN . . . . . 0.493 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.6 p-10 -81.8 -23.52 36.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -177.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.17 -36.82 77.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.679 173.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.581 HG12 ' O ' ' B' ' 466' ' ' GLU . 26.5 mm -60.58 -34.35 58.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.28 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 73.0 mt -59.61 -43.55 93.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.167 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -62.62 -41.31 98.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.876 177.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 55.1 m -63.42 -57.3 10.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.437 -178.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.41 HG22 ' HG2' ' A' ' 114' ' ' MET . 98.3 t -51.22 -45.33 31.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.602 175.681 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.601 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 0.8 OUTLIER -60.74 -42.2 96.87 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.317 -178.17 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -67.07 -45.98 75.7 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.673 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.18 -57.22 10.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.93 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 44.9 mt -60.32 -21.13 21.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.782 0.325 . . . . 0.0 111.253 -177.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.601 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 19.3 tptm -67.91 -42.31 81.33 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.77 -177.238 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 480' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' B' ' 481' ' ' ASP . 0.0 OUTLIER -114.61 -14.35 12.08 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.43 0.529 . . . . 0.0 112.43 -178.211 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 481' ' ' ASP . . . . . 0.511 ' N ' ' HD3' ' B' ' 480' ' ' LYS . 13.3 t70 -90.65 -59.9 2.06 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.725 -175.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -85.13 -89.07 0.11 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.978 -171.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -112.1 -43.22 3.59 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.101 -171.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 484' ' ' GLY . . . . . . . . . . . . . . . 89.86 1.19 77.13 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.154 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 3.1 pp -123.34 179.65 4.65 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.742 0.306 . . . . 0.0 111.126 -176.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -129.29 107.69 9.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.449 0.643 . . . . 0.0 109.699 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 17.0 p -83.85 -13.29 54.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.079 -175.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 488' ' ' ASN . . . . . 0.437 ' HB3' ' CD ' ' A' ' 121' ' ' GLU . 15.1 m120 -127.9 -163.54 1.28 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.923 -172.426 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 22.0 t 66.61 15.35 10.1 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.746 0.784 . . . . 0.0 109.868 -173.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -88.65 -8.33 54.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.637 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.24 7.96 42.74 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.341 176.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 54.0 m -128.82 148.55 50.89 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.339 178.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -92.04 74.74 5.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.218 0.533 . . . . 0.0 110.386 -178.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -101.96 -62.61 1.24 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.324 -178.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 45.9 t . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.491 -0.766 . . . . 0.0 110.064 178.661 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.599 0 N-CA-C 111.89 -0.484 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -66.26 115.08 3.3 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.938 2.426 . . . . 0.0 112.088 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -86.26 -36.89 19.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.22 0.533 . . . . 0.0 110.121 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 46.8 tpp -142.33 84.08 1.85 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.294 176.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -85.25 -3.1 58.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.488 -176.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -63.23 134.57 56.12 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 175.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.497 HG21 ' HB ' ' A' ' 147' ' ' VAL . 11.2 p -81.35 148.79 5.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.772 -175.225 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 25.2 m -55.54 139.9 42.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.227 -176.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.505 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -61.43 -35.95 78.98 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.04 -179.235 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -60.62 -39.95 90.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.65 177.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -60.71 -38.82 86.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.811 177.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.477 HD12 HD22 ' A' ' 89' ' ' LEU . 61.2 mt -69.96 -36.62 75.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.054 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 9.2 mtpm? -59.93 -17.79 40.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.21 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -83.29 -17.36 42.79 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.597 0.237 . . . . 0.0 111.378 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 84.8 mt -61.28 -44.22 97.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.83 0.348 . . . . 0.0 111.245 -176.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -71.1 -14.46 73.72 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.384 -179.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -87.94 -18.18 29.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.877 0.37 . . . . 0.0 110.503 -178.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.643 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 28.0 t -80.68 115.81 20.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.763 -177.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.72 -21.47 65.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.48 176.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 29.5 m -74.3 -43.71 55.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.927 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 63.2 tp -73.38 -48.38 34.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.424 -175.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.643 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.8 ptp180 -58.77 -29.6 66.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.072 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 28.9 t -63.11 -31.32 72.43 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-O 121.127 0.489 . . . . 0.0 109.956 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.1 mt -75.45 -38.14 59.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.898 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.444 HD21 HD13 ' B' ' 477' ' ' ILE . 11.1 mp -66.8 -17.98 65.15 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.819 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 62.1 mt -65.81 -19.01 65.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.741 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -75.61 120.84 83.52 Favored Pre-proline 0 C--O 1.236 0.352 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 173.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.73 -25.55 79.47 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.674 2.249 . . . . 0.0 112.29 -178.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -71.24 -48.8 48.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.093 178.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 58.2 tp -65.77 -37.27 85.88 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 120.86 0.362 . . . . 0.0 111.103 -175.096 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -69.15 -27.94 65.99 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.161 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLN . . . . . 0.474 ' HA ' HG22 ' A' ' 115' ' ' VAL . 53.5 mm-40 -70.44 -38.85 74.6 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.391 174.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 94.5 mt -59.35 -47.21 86.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.194 0.521 . . . . 0.0 110.054 174.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 69.9 mtp -57.66 -51.95 67.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.668 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.614 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 32.9 m -65.79 -31.51 54.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.516 -177.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -64.69 -45.89 84.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.941 0.401 . . . . 0.0 110.635 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.9 tp -66.69 -40.3 88.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.21 -178.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -63.28 -41.38 98.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.76 -178.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.614 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 48.5 mt-30 -68.76 -29.09 67.4 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.521 0.677 . . . . 0.0 110.592 -177.664 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 83.15 29.84 32.79 Favored Glycine 0 C--N 1.318 -0.472 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.96 174.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -52.2 -54.62 28.74 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.218 0.533 . . . . 0.0 110.207 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.643 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 9.9 t0 -155.79 65.97 0.6 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 172.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.417 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -56.13 -27.23 53.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.211 -177.388 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.56 -47.3 86.8 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.105 0.479 . . . . 0.0 110.478 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -75.25 -42.14 55.83 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.662 177.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 87.7 mt -58.45 -44.24 89.15 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.485 -175.511 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.439 ' SD ' HD21 ' B' ' 471' ' ' LEU . 0.8 OUTLIER -52.25 -37.83 56.44 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.995 0.426 . . . . 0.0 111.421 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -84.06 -42.38 16.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.81 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.573 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.07 -21.64 64.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.983 -176.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.478 ' HB3' ' CD1' ' A' ' 136' ' ' PHE . 4.4 m-30 -82.77 -26.37 31.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.893 0.377 . . . . 0.0 111.203 -178.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.505 ' HE2' HG12 ' A' ' 137' ' ' VAL . 2.7 mmt -81.58 3.2 25.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.04 0.448 . . . . 0.0 111.501 -175.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 24.7 pt20 -102.84 -7.15 21.81 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.851 174.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.401 ' O ' HG22 ' A' ' 137' ' ' VAL . 6.4 mt-10 -99.49 122.66 50.88 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.324 -176.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.716 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 28.7 Cg_endo -62.01 -14.54 37.93 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.061 2.507 . . . . 0.0 112.867 -177.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 51.6 mt -82.75 -33.94 27.28 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.316 176.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.478 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 34.7 t80 -89.62 -31.14 17.68 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.107 -176.096 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.716 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 14.0 m -60.88 -48.44 88.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.08 177.197 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.479 ' N ' HG23 ' A' ' 137' ' ' VAL . 40.9 mm-40 -66.3 -36.5 83.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.849 176.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -56.46 -49.1 75.62 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 173.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.698 ' HA ' ' SG ' ' A' ' 143' ' ' CYS . . . -64.0 -43.0 96.98 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.507 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.46 -36.55 73.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.375 0.607 . . . . 0.0 110.292 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 65.1 m -77.05 -49.82 14.49 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.08 -0.963 . . . . 0.0 111.403 -179.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.698 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.5 p -64.21 -36.84 85.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.775 -176.1 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 46.2 mt -67.95 -34.58 76.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.409 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -73.92 -17.12 79.28 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.163 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 82.4 mt -90.97 -49.02 13.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.689 0.28 . . . . 0.0 110.775 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.497 ' HB ' HG21 ' A' ' 87' ' ' VAL . 16.3 m -86.62 1.8 5.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 -172.08 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -64.6 116.88 32.57 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-O 120.94 0.4 . . . . 0.0 111.266 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -71.4 -26.57 20.29 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.348 2.032 . . . . 0.0 111.219 175.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 23.2 t -162.0 143.29 10.84 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.184 -0.916 . . . . 0.0 108.76 176.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' GLN . . . . . 0.505 ' HB3' ' HB3' ' A' ' 154' ' ' GLU . 64.2 tp60 -121.17 147.99 44.84 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -55.02 112.48 1.07 Allowed 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 176.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 38.52 91.7 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 O-C-N 124.395 1.059 . . . . 0.0 112.173 -166.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.505 ' HB3' ' HB3' ' A' ' 151' ' ' GLN . 8.1 pt-20 -95.86 60.25 2.09 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 114.207 -1.361 . . . . 0.0 110.813 -174.308 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 12.1 t . . . . . 0 C--O 1.249 1.073 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.581 177.836 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 121.074 0.464 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 65.9 mt -70.69 -26.72 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.783 -175.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -56.37 -44.15 79.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.689 178.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 465' ' ' HIS . . . . . 0.569 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 58.7 t60 -67.71 -45.29 75.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.778 176.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -60.14 -38.45 83.11 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.566 -179.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 21.6 ttp180 -67.95 -42.92 80.22 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.713 -176.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 468' ' ' ASN . . . . . 0.569 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.6 p-10 -76.66 -16.51 59.52 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.675 0.75 . . . . 0.0 110.047 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.4 t -74.67 -21.76 17.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.286 177.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 470' ' ' ILE . . . . . . . . . . . . . 36.8 mm -68.94 -32.82 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-O 122.338 1.066 . . . . 0.0 109.062 -175.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 471' ' ' LEU . . . . . 0.623 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.6 OUTLIER -50.96 -54.83 20.9 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 113.017 -1.901 . . . . 0.0 110.768 179.145 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.477 ' HB3' HD11 ' A' ' 92' ' ' LEU . 2.8 mp0 -50.83 -44.81 59.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.938 176.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 50.6 m -62.81 -56.36 18.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.511 -179.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 92.4 t -52.01 -53.88 16.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.016 178.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 50.2 mtp180 -72.65 -27.33 62.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.623 -171.377 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -67.17 -46.63 73.38 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.053 0.454 . . . . 0.0 109.867 176.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.444 HD13 HD21 ' A' ' 105' ' ' LEU . 79.3 mt -63.03 -54.92 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.729 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.51 HG23 ' HB2' ' B' ' 482' ' ' PHE . 41.9 mt -56.33 -28.16 25.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.047 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.653 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 25.3 tptp -56.94 -39.46 74.55 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.976 -177.081 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.39 -14.09 12.22 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.029 -179.129 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -87.78 -59.6 2.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.477 -173.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 482' ' ' PHE . . . . . 0.51 ' HB2' HG23 ' B' ' 478' ' ' ILE . 95.8 m-85 -103.08 -83.55 0.48 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.141 0.422 . . . . 0.0 112.141 -172.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -111.87 -51.05 2.88 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 120.999 -0.281 . . . . 0.0 110.401 -174.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.653 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 61.82 36.66 93.09 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.748 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 3.3 pp -120.3 156.43 31.28 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.945 0.402 . . . . 0.0 110.686 176.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -138.08 -15.33 1.31 Allowed 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.519 0.676 . . . . 0.0 109.658 177.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 22.3 p -99.87 2.43 43.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.697 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -124.97 120.94 33.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.186 -175.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 44.5 m -148.2 88.83 1.68 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.315 0.579 . . . . 0.0 110.949 175.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -85.1 61.81 7.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.768 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -102.64 91.01 4.02 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.707 -176.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 16.7 t 52.28 57.26 6.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 0.0 110.437 178.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 493' ' ' LYS . . . . . 0.527 ' HE3' ' HA ' ' B' ' 493' ' ' LYS . 0.0 OUTLIER -95.19 27.49 3.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.577 0.703 . . . . 0.0 109.648 179.47 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -72.81 90.61 1.44 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.109 178.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 56.7 t . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.542 -0.742 . . . . 0.0 109.732 178.36 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 112.101 -0.4 . . . . 0.0 112.101 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -70.15 -28.29 23.57 Favored 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 122.913 2.409 . . . . 0.0 112.004 176.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 61.47 68.13 0.73 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.342 0.591 . . . . 0.0 110.425 -176.017 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 67.0 mtt -92.71 41.68 1.08 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.242 178.173 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.476 ' HB2' ' ND2' ' B' ' 468' ' ' ASN . 7.6 p-10 -70.44 -33.73 71.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.319 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 71.5 mtm180 -88.22 133.98 33.9 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.774 174.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.6 p -99.83 155.79 4.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.455 -174.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.0 m -69.29 151.82 45.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.244 0.545 . . . . 0.0 111.204 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.42 HD22 HD12 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -63.79 -33.38 75.53 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.905 -174.588 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -56.35 -39.66 73.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.864 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -68.6 -37.87 80.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.54 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.42 HD12 HD22 ' A' ' 89' ' ' LEU . 84.7 mt -68.9 -36.95 78.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.983 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 98.4 mttt -58.76 -27.08 64.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.742 178.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -72.53 -18.02 61.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.162 -178.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.437 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 94.0 mt -61.98 -54.41 42.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.161 -177.328 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -63.02 -21.22 63.43 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 121.145 -0.55 . . . . 0.0 113.07 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -76.35 -20.72 56.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.02 0.438 . . . . 0.0 110.744 -178.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 15.0 m -89.0 117.13 27.8 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.706 -175.021 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.16 -27.68 68.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.584 -176.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 60.3 m -70.03 -42.67 72.65 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.092 -178.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.437 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 43.6 tp -69.84 -49.77 49.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.539 -176.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.62 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 8.1 ptp180 -60.35 -27.23 67.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.649 -177.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.5 t -61.36 -28.98 69.61 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.368 0.604 . . . . 0.0 109.858 176.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.6 mt -80.18 -32.02 38.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.965 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.594 HD21 HD13 ' B' ' 477' ' ' ILE . 9.5 mp -66.56 -22.56 66.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.551 0.691 . . . . 0.0 110.173 177.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 63.4 mt -72.97 -9.15 58.41 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.997 -179.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -79.84 121.23 82.03 Favored Pre-proline 0 C--O 1.233 0.236 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 175.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -63.16 -19.9 69.76 Favored 'Trans proline' 0 CA--C 1.528 0.218 0 C-N-CA 122.777 2.318 . . . . 0.0 112.679 -179.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 112' ' ' GLN . 71.1 t60 -81.87 -49.89 9.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.717 0.294 . . . . 0.0 110.746 175.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.517 HD11 ' HB2' ' A' ' 139' ' ' PHE . 2.6 tt -62.93 -41.84 99.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.488 -174.366 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -61.77 -29.94 70.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.515 177.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 6.6 mm-40 -64.15 -49.19 73.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.262 175.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.559 HD21 ' OE2' ' A' ' 133' ' ' GLU . 8.9 mp -52.04 -44.97 64.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.948 0.404 . . . . 0.0 110.646 174.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 73.9 mtp -57.45 -59.28 5.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.199 178.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.66 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 26.4 m -66.49 -27.62 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.652 -175.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -71.2 -53.53 14.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.976 0.417 . . . . 0.0 110.986 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 59.7 tp -62.11 -39.56 92.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.011 -176.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -66.71 -27.94 68.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.66 -0.246 . . . . 0.0 111.653 -173.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 72.6 mt-30 -64.06 -29.66 70.78 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.682 0.754 . . . . 0.0 110.374 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.409 ' HA2' ' HB3' ' A' ' 123' ' ' LYS . . . 68.71 29.04 72.72 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.603 173.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.31 -49.5 27.19 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 5.4 m-20 -136.72 42.61 2.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.944 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.654 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.99 -33.05 7.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.576 -1.193 . . . . 0.0 112.377 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -56.26 -55.6 31.35 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.682 0.277 . . . . 0.0 111.667 -176.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -75.04 -29.98 60.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.782 0.325 . . . . 0.0 110.375 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.462 HD22 ' CE1' ' A' ' 130' ' ' TYR . 97.6 mt -65.73 -40.9 92.64 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.875 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.408 ' SD ' HD21 ' B' ' 471' ' ' LEU . 0.0 OUTLIER -55.41 -34.54 64.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.067 0.46 . . . . 0.0 110.64 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -78.87 -49.7 12.45 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.005 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.526 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.09 -16.54 64.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.345 -175.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.462 ' CE1' HD22 ' A' ' 126' ' ' LEU . 3.4 m-30 -88.75 -28.75 20.3 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.765 0.317 . . . . 0.0 111.059 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 3.2 mmt -71.14 -4.95 28.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.407 -178.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 28.3 pt20 -98.76 -18.44 17.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.258 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.559 ' OE2' HD21 ' A' ' 113' ' ' LEU . 4.2 mt-10 -88.86 123.06 68.49 Favored Pre-proline 0 CA--C 1.515 -0.387 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -176.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.42 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 12.6 Cg_endo -55.88 -25.1 50.91 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.169 2.58 . . . . 0.0 112.604 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.31 -45.22 66.69 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.201 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.411 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 28.2 t80 -73.74 -31.68 63.48 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -178.262 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 133' ' ' GLU . 82.9 t -62.54 -42.77 97.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.336 176.284 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 8.3 mm-40 -66.67 -45.91 77.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.341 175.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' PHE . . . . . 0.517 ' HB2' HD11 ' A' ' 110' ' ' LEU . 69.8 t80 -57.54 -48.64 78.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.646 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.786 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.76 -49.52 74.7 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.111 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -60.21 -33.84 72.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.413 0.625 . . . . 0.0 110.294 -176.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.445 ' O ' HG13 ' A' ' 146' ' ' ILE . 99.6 m -69.56 -50.3 46.04 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.723 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.0 p -69.49 -29.06 66.62 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.638 -176.268 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.6 mt -60.89 -40.32 92.59 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.061 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -74.05 -29.78 62.17 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.414 -0.898 . . . . 0.0 111.985 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 142' ' ' CYS . 62.6 mt -77.5 -37.05 24.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.67 -0.265 . . . . 0.0 111.234 -177.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.404 ' O ' ' HD3' ' A' ' 149' ' ' PRO . 23.0 m -87.33 2.92 5.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.399 -178.207 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 19.0 mm-40 -82.72 109.5 16.94 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 168.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' PRO . . . . . 0.404 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 73.4 Cg_endo -76.67 -0.82 10.88 Favored 'Trans proline' 0 C--N 1.334 -0.187 0 C-N-CA 122.957 2.438 . . . . 0.0 112.911 -176.09 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 14.6 t 63.78 36.16 10.7 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -177.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 41.5 tp60 -82.42 74.9 9.36 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.781 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -83.21 56.22 3.44 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.924 -173.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -97.18 -155.03 0.47 Allowed 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.955 -1.021 . . . . 0.0 108.768 177.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -87.46 56.27 3.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.25 0.547 . . . . 0.0 110.543 175.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 18.8 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.373 179.408 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 462' ' ' ASP . . . . . 0.46 ' OD2' ' HB2' ' B' ' 464' ' ' ARG . 8.0 t70 . . . . . 0 N--CA 1.478 0.943 0 CA-C-O 121.035 0.445 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 463' ' ' ILE . . . . . 0.439 ' HA ' ' HB2' ' B' ' 466' ' ' GLU . 65.7 mt -68.42 -28.96 42.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.465 -170.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 464' ' ' ARG . . . . . 0.46 ' HB2' ' OD2' ' B' ' 462' ' ' ASP . 20.2 mmm180 -55.25 -49.81 71.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.312 0.577 . . . . 0.0 109.444 174.478 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 465' ' ' HIS . . . . . 0.472 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 29.0 t60 -70.24 -45.45 66.46 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.165 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.439 ' HB2' ' HA ' ' B' ' 463' ' ' ILE . 39.5 mt-10 -64.19 -22.83 67.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.242 -174.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 38.9 ttt180 -80.15 -41.38 25.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 178.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 468' ' ' ASN . . . . . 0.476 ' ND2' ' HB2' ' A' ' 85' ' ' ASP . 2.5 p-10 -84.47 -17.48 38.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.534 0.683 . . . . 0.0 110.597 -174.538 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 3.4 p -78.3 -19.39 13.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.343 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.411 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 39.4 mm -69.11 -31.07 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 122.427 1.108 . . . . 0.0 108.737 -175.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 471' ' ' LEU . . . . . 0.62 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.6 OUTLIER -54.81 -52.63 62.1 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 112.929 -1.941 . . . . 0.0 110.284 179.358 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -53.09 -44.5 67.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.932 174.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 50.7 m -61.28 -55.52 30.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.433 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 94.1 t -51.67 -51.58 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.908 176.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -64.6 -40.75 96.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.616 -173.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.47 -43.57 96.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 0.0 110.447 178.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.594 HD13 HD21 ' A' ' 105' ' ' LEU . 78.2 mt -65.57 -55.42 19.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.274 -178.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.409 HG23 ' HB2' ' B' ' 482' ' ' PHE . 47.0 mt -56.97 -25.14 21.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.067 -178.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.522 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 17.1 tppt? -58.89 -47.06 86.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.111 -176.07 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 480' ' ' LYS . . . . . 0.479 ' HD2' ' H ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER -115.69 -9.2 11.98 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.903 -0.719 . . . . 0.0 112.073 -179.532 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -89.2 -60.22 2.01 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.629 -176.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 482' ' ' PHE . . . . . 0.409 ' HB2' HG23 ' B' ' 478' ' ' ILE . 89.8 m-85 -93.15 -86.95 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -172.266 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -107.48 -39.45 5.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.017 0.437 . . . . 0.0 111.522 -171.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.522 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 96.58 0.25 60.96 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.315 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 3.9 pp -140.97 153.47 45.62 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.835 0.35 . . . . 0.0 110.869 -177.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.23 1.62 18.76 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.518 0.675 . . . . 0.0 109.694 176.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 2.4 p -99.99 66.43 1.35 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.709 -177.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -83.16 81.22 8.78 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 121.219 0.533 . . . . 0.0 110.302 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 15.3 m -87.18 8.15 25.17 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.856 -177.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -78.07 1.12 22.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.76 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -97.97 8.02 45.41 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.513 -178.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 25.7 t -123.48 132.91 54.06 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.266 -177.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 493' ' ' LYS . . . . . 0.442 ' N ' ' HD3' ' B' ' 493' ' ' LYS . 0.4 OUTLIER -150.09 150.23 31.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.267 178.144 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -115.98 104.08 11.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.436 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.247 0.941 0 CA-C-O 118.123 -0.942 . . . . 0.0 111.506 -177.896 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.753 0 N-CA-C 111.956 -0.457 . . . . 0.0 111.956 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -61.43 -60.83 0.19 Allowed 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.75 2.3 . . . . 0.0 112.115 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -172.61 -51.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.225 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.411 ' O ' ' HG3' ' A' ' 84' ' ' MET . 27.0 ptt? -80.2 65.42 5.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.698 0.761 . . . . 0.0 111.249 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -88.06 -0.54 57.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.102 178.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -101.04 146.58 27.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.451 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 45.2 t -98.6 128.74 49.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.863 0.363 . . . . 0.0 110.502 -175.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.0 m -68.74 150.07 48.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.526 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.62 -34.41 74.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.374 -173.842 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -60.05 -39.89 87.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 0.0 110.296 178.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.41 -38.83 81.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.098 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.517 ' HA ' HD13 ' A' ' 95' ' ' LEU . 94.3 mt -69.46 -35.17 75.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.934 -177.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 96.6 mttt -59.31 -30.99 68.75 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -177.484 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -68.58 -19.59 64.48 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.513 0.196 . . . . 0.0 111.148 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.517 HD13 ' HA ' ' A' ' 92' ' ' LEU . 8.7 mp -64.1 -39.15 93.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.955 0.407 . . . . 0.0 110.623 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -72.48 -19.12 78.8 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.597 175.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -83.86 -24.6 30.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.032 0.444 . . . . 0.0 110.371 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.654 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 48.3 t -77.39 111.73 13.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.77 -177.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.2 -21.31 62.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.313 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 58.8 m -71.43 -46.79 59.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.96 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.515 HD11 ' CD1' ' A' ' 139' ' ' PHE . 59.5 tp -68.25 -51.08 49.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.968 -175.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.654 ' HG2' ' O ' ' A' ' 98' ' ' SER . 6.3 ptp180 -59.96 -28.19 67.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.682 -178.382 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.49 ' HA ' HD23 ' A' ' 106' ' ' LEU . 33.7 t -62.2 -23.62 66.73 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.095 0.474 . . . . 0.0 110.399 178.359 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.3 mt -82.38 -24.79 34.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.028 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 102' ' ' ARG . 10.2 mp -75.74 -8.68 57.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.51 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.4 mm? -67.48 -22.92 65.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.889 172.499 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -71.25 113.88 23.02 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.858 177.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' A' ' 111' ' ' ARG . 25.1 Cg_endo -61.68 -24.29 77.48 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.938 2.425 . . . . 0.0 112.846 -175.572 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 47.1 t60 -78.47 -42.46 29.71 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.824 0.345 . . . . 0.0 110.376 177.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.6 tt -65.36 -42.97 92.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.035 -176.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.457 ' HD3' ' HA ' ' A' ' 108' ' ' PRO . 12.7 ptm180 -67.56 -31.62 71.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.648 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -63.52 -43.02 98.39 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.426 173.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 86.0 mt -57.34 -49.34 76.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.412 ' HG2' HG22 ' B' ' 474' ' ' VAL . 75.0 mtp -54.89 -49.32 71.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.073 177.572 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 45.8 t -60.56 -39.9 82.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.032 0.444 . . . . 0.0 111.343 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.497 ' HA ' ' NE2' ' A' ' 119' ' ' GLN . 74.4 m-20 -68.32 -38.61 81.73 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.268 -178.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.56 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 59.7 tp -73.66 -44.66 56.19 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.61 -178.194 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.438 ' OD1' ' HD3' ' B' ' 475' ' ' ARG . 30.9 t70 -71.0 -27.99 64.09 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -171.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.497 ' NE2' ' HA ' ' A' ' 116' ' ' ASN . 11.0 pt20 -68.29 -17.54 64.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.279 0.562 . . . . 0.0 110.675 178.26 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 67.39 29.42 74.16 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.442 -0.799 . . . . 0.0 113.864 170.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -76.87 -51.99 10.27 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.954 0.377 . . . . 0.0 111.167 179.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.46 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 17.6 m-20 -132.89 37.06 3.46 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.252 0.549 . . . . 0.0 110.518 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.646 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -46.11 -34.29 4.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.557 -1.201 . . . . 0.0 112.521 179.269 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.2 -46.9 88.14 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.834 0.349 . . . . 0.0 111.462 -176.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.437 ' HE2' ' HB3' ' A' ' 122' ' ' ASP . 3.9 mppt? -81.44 -35.33 30.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.138 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 85.4 mt -59.8 -44.25 94.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.046 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.476 ' HB3' ' NH2' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -54.75 -29.85 54.92 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.796 0.331 . . . . 0.0 111.822 179.314 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -83.19 -50.32 8.56 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.98 0.419 . . . . 0.0 110.441 176.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.752 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.34 -29.97 71.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.104 -176.647 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.594 ' HB3' ' CD1' ' A' ' 136' ' ' PHE . 3.5 m-30 -73.37 -21.92 60.41 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 122.172 -0.33 . . . . 0.0 111.367 -177.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.484 ' SD ' ' HG2' ' B' ' 467' ' ' ARG . 3.3 mmt -85.19 -5.26 59.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.899 0.38 . . . . 0.0 110.892 -177.125 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.752 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.6 pt20 -103.6 -6.63 21.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.896 0.379 . . . . 0.0 110.22 176.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.516 ' O ' HG23 ' A' ' 137' ' ' VAL . 4.1 mt-10 -92.31 120.3 67.68 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.184 -177.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.537 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 22.5 Cg_endo -60.74 -21.0 68.32 Favored 'Trans proline' 0 N--CA 1.464 -0.21 0 C-N-CA 122.754 2.303 . . . . 0.0 112.339 -175.655 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 63.4 mt -82.08 -43.96 17.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.706 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.594 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 47.1 t80 -73.48 -31.21 63.63 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.601 -0.44 . . . . 0.0 109.998 -177.018 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 133' ' ' GLU . 78.0 t -60.67 -39.98 83.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.483 176.627 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 17.7 mm-40 -63.18 -46.67 86.0 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.965 0.412 . . . . 0.0 110.129 177.373 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' PHE . . . . . 0.515 ' CD1' HD11 ' A' ' 101' ' ' LEU . 58.7 t80 -57.93 -50.23 74.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.376 178.34 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.765 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.45 -48.69 74.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.497 -176.071 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -63.99 -30.33 71.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.159 0.504 . . . . 0.0 110.295 -176.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 61.4 m -70.27 -51.07 33.28 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.819 178.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.453 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 24.3 p -66.7 -25.2 66.42 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.242 -176.222 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.765 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 79.1 mt -57.42 -44.0 84.27 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.913 0.387 . . . . 0.0 110.805 177.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.421 ' O ' ' HG2' ' A' ' 148' ' ' GLU . . . -76.75 -14.59 82.39 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.309 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 41.1 mt -91.46 -29.32 4.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.751 0.31 . . . . 0.0 111.026 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 23.0 m -100.64 5.3 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 CA-C-O 120.698 0.285 . . . . 0.0 110.559 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 145' ' ' GLY . 4.9 pt-20 -65.55 137.16 96.36 Favored Pre-proline 0 N--CA 1.441 -0.89 0 CA-C-O 121.321 0.582 . . . . 0.0 109.704 178.102 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -59.71 -15.0 29.21 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 123.678 2.919 . . . . 0.0 112.562 177.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 51.3 p 47.6 68.72 0.61 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.605 0.762 . . . . 0.0 112.46 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 64.58 103.13 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.212 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -61.27 122.05 14.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.85 179.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -80.29 -16.12 55.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.645 0.736 . . . . 0.0 109.483 177.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.66 41.29 1.61 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.325 176.332 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 31.4 p . . . . . 0 C--O 1.25 1.087 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.487 179.317 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 462' ' ' ASP . . . . . 0.533 ' OD1' ' HG2' ' B' ' 464' ' ' ARG . 10.5 t70 . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 121.284 0.564 . . . . 0.0 110.329 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 77.6 mt -69.33 -34.66 63.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.109 -0.95 . . . . 0.0 112.165 -171.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 464' ' ' ARG . . . . . 0.617 ' HD2' ' H ' ' B' ' 464' ' ' ARG . 0.0 OUTLIER -76.74 -29.43 56.17 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.608 -0.837 . . . . 0.0 109.901 -175.31 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 465' ' ' HIS . . . . . 0.573 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 45.2 t60 -65.55 -48.28 72.99 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.524 171.074 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.404 ' O ' HG12 ' B' ' 470' ' ' ILE . 37.8 mt-10 -62.48 -22.36 66.19 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.407 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 467' ' ' ARG . . . . . 0.484 ' HG2' ' SD ' ' A' ' 131' ' ' MET . 28.4 mtp-105 -79.0 -44.78 21.57 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 176.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 468' ' ' ASN . . . . . 0.573 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -78.53 -19.68 52.39 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.411 -175.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 469' ' ' VAL . . . . . 0.49 HG13 ' O ' ' B' ' 465' ' ' HIS . 31.4 m -71.28 -22.51 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.973 0.416 . . . . 0.0 110.523 176.682 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.404 HG12 ' O ' ' B' ' 466' ' ' GLU . 31.3 mm -66.42 -30.75 50.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.886 177.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 77.8 mt -60.3 -38.09 82.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.789 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.451 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 3.0 mp0 -68.44 -40.0 81.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.067 0.461 . . . . 0.0 110.102 176.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.5 m -62.15 -57.29 12.09 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.509 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.412 HG22 ' HG2' ' A' ' 114' ' ' MET . 96.3 t -53.08 -49.6 49.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.514 176.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.524 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 1.8 tpp180 -59.87 -44.27 94.26 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.689 0.281 . . . . 0.0 111.259 -175.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -62.49 -47.06 85.65 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.8 -177.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 72.1 mt -65.6 -54.5 27.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.146 -178.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.531 HG22 ' H ' ' B' ' 484' ' ' GLY . 11.2 mt -57.02 -28.89 30.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.182 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.544 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 21.5 tptm -59.13 -40.25 84.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.053 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 480' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER -111.7 -17.41 13.0 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.258 -179.129 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -91.47 -55.86 3.34 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.812 -174.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 482' ' ' PHE . . . . . 0.526 ' HB2' HG23 ' B' ' 478' ' ' ILE . 94.3 m-85 -99.1 -94.54 0.24 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.534 -172.659 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -113.33 -48.9 2.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.2 0.524 . . . . 0.0 111.276 -173.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.544 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 79.75 15.45 79.36 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.549 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.455 HD13 ' HB3' ' B' ' 488' ' ' ASN . 3.2 pp -138.66 158.0 45.06 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.775 0.321 . . . . 0.0 111.033 -178.399 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -139.4 -16.51 1.04 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.059 175.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 39.8 p -90.99 -0.23 57.7 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.63 -176.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 488' ' ' ASN . . . . . 0.455 ' HB3' HD13 ' B' ' 485' ' ' LEU . 40.3 t30 -86.35 56.83 4.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.324 0.583 . . . . 0.0 110.307 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 18.3 m -66.45 126.15 27.92 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.426 -0.807 . . . . 0.0 110.362 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -97.49 -14.59 21.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.085 0.469 . . . . 0.0 111.385 -176.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -86.04 74.95 10.01 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.584 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 34.1 t -81.62 157.45 24.69 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.971 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 493' ' ' LYS . . . . . 0.443 ' HD2' ' N ' ' B' ' 493' ' ' LYS . 11.9 mptt -110.88 89.6 3.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.766 0.317 . . . . 0.0 110.395 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -149.16 -41.79 0.15 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.13 -178.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 16.1 t . . . . . 0 C--O 1.248 1.015 0 CA-C-O 119.239 -0.41 . . . . 0.0 109.906 -179.231 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -61.98 127.15 20.52 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.845 2.364 . . . . 0.0 111.508 178.641 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 72.5 t60 70.39 110.22 0.06 Allowed 'General case' 0 N--CA 1.463 0.186 0 O-C-N 123.951 0.782 . . . . 0.0 109.741 -174.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 26.3 mmt -67.77 169.1 10.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.475 -175.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -84.43 39.02 0.71 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.739 0.781 . . . . 0.0 110.456 -176.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 -96.9 163.82 12.81 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.655 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.526 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 61.8 t -101.46 139.88 21.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.631 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.429 ' O ' ' HB2' ' A' ' 91' ' ' ASN . 30.1 m -59.82 134.77 57.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.998 0.427 . . . . 0.0 110.196 178.268 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.516 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 3.9 tt -65.02 -33.64 76.52 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.642 -173.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -58.51 -37.78 76.31 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.396 175.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.436 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 4.1 m-20 -65.49 -38.57 90.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.988 176.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 78.1 mt -68.89 -34.01 74.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.177 -178.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 56.7 mtpt -59.66 -24.47 63.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.081 -179.438 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -74.54 -19.28 60.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.215 -0.194 . . . . 0.0 111.206 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.36 -42.78 99.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.932 0.396 . . . . 0.0 110.915 -177.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.45 -9.84 81.96 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.441 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -103.06 -24.47 13.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.658 0.266 . . . . 0.0 111.34 -178.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.537 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 23.8 p -71.42 115.92 11.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.921 -176.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.07 -26.96 69.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.308 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 35.9 m -70.17 -44.34 68.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.887 0.375 . . . . 0.0 110.937 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.42 HD11 ' CD2' ' A' ' 139' ' ' PHE . 46.5 tp -72.23 -49.13 37.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.522 -174.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.537 ' HG2' ' O ' ' A' ' 98' ' ' SER . 2.4 ptp180 -58.43 -29.56 66.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.17 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.416 ' HA ' HD23 ' A' ' 106' ' ' LEU . 34.0 t -65.71 -22.82 66.65 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.918 0.39 . . . . 0.0 110.256 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 24.2 mt -84.2 -28.37 27.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.226 0.536 . . . . 0.0 109.65 178.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.533 ' O ' ' HD2' ' A' ' 111' ' ' ARG . 9.7 mp -74.03 2.64 8.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.154 178.063 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.2 mm? -75.7 -19.73 58.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.893 0.378 . . . . 0.0 110.056 171.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -80.17 114.36 46.22 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.572 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -55.82 -39.77 89.16 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.501 2.801 . . . . 0.0 113.137 -177.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -69.03 -41.42 77.71 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.762 0.315 . . . . 0.0 110.624 -178.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.424 ' O ' HD23 ' A' ' 110' ' ' LEU . 3.8 tt -60.45 -41.53 94.27 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 105' ' ' LEU . 57.1 mtp85 -62.78 -44.28 96.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.912 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.81 -24.81 67.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.497 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 65.7 mt -79.16 -51.58 9.33 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 121.646 0.736 . . . . 0.0 109.079 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.576 ' HG3' HG13 ' B' ' 474' ' ' VAL . 44.0 ttp -59.55 -43.86 93.41 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.39 -1.277 . . . . 0.0 111.211 -177.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.628 ' HA ' HD13 ' B' ' 478' ' ' ILE . 33.4 m -68.01 -23.98 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.88 0.372 . . . . 0.0 111.744 -178.426 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 28.2 m-20 -72.69 -42.35 64.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.282 0.563 . . . . 0.0 110.673 177.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.485 HD23 HG21 ' B' ' 474' ' ' VAL . 27.9 tp -60.42 -37.27 80.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.041 -177.24 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.525 ' HB2' HD12 ' B' ' 478' ' ' ILE . 17.0 t70 -67.53 -32.22 72.86 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.867 0.365 . . . . 0.0 110.979 -178.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 68.8 mt-30 -60.75 -28.89 69.04 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.497 -178.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.56 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 70.51 20.54 77.16 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.039 -0.982 . . . . 0.0 114.06 169.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -69.01 -50.59 47.5 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.451 0.643 . . . . 0.0 109.691 -178.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.483 ' OD2' ' HE2' ' A' ' 125' ' ' LYS . 13.4 p-10 -141.01 40.21 1.8 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.648 179.159 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.617 ' HD2' ' H ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -52.78 -26.99 16.0 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.794 -1.094 . . . . 0.0 112.033 179.429 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.617 ' H ' ' HD2' ' A' ' 123' ' ' LYS . . . -67.6 -39.13 84.8 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.25 0.547 . . . . 0.0 110.137 -177.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.504 ' C ' ' HD2' ' A' ' 125' ' ' LYS . 5.1 tmmm? -79.45 -45.03 20.2 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.07 177.307 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.532 HD22 ' CE1' ' A' ' 130' ' ' TYR . 94.5 mt -56.25 -38.11 70.68 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.463 -178.172 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.58 -44.89 56.94 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.953 0.406 . . . . 0.0 111.385 177.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -84.18 -36.34 22.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.801 -178.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.504 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -70.24 -16.81 63.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.638 -178.386 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.532 ' CE1' HD22 ' A' ' 126' ' ' LEU . 7.3 m-30 -87.45 -22.1 25.16 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.934 0.397 . . . . 0.0 110.737 178.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 5.8 mmt -77.85 -6.11 53.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.963 -177.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.9 pt20 -99.59 -4.23 31.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.948 0.404 . . . . 0.0 110.235 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.522 ' O ' HG23 ' A' ' 137' ' ' VAL . 3.9 mt-10 -104.65 119.89 52.15 Favored Pre-proline 0 N--CA 1.452 -0.356 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.459 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 16.1 Cg_endo -57.11 -24.53 58.9 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.976 2.451 . . . . 0.0 112.363 -175.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.523 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.1 mp -67.01 -51.66 52.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.347 -179.304 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.476 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 27.7 t80 -75.64 -28.04 58.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -174.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 133' ' ' GLU . 99.4 t -59.38 -43.26 89.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.331 175.507 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 44.8 mt-10 -64.74 -46.85 80.48 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.818 0.342 . . . . 0.0 110.173 178.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' PHE . . . . . 0.42 ' CD2' HD11 ' A' ' 101' ' ' LEU . 71.4 t80 -56.98 -47.09 81.61 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.556 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.697 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -68.16 -45.55 73.21 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.72 -176.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.73 -32.47 73.79 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.996 0.427 . . . . 0.0 110.331 -176.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 91.2 m -77.01 -42.77 37.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.686 -176.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.443 ' HA ' HD12 ' A' ' 146' ' ' ILE . 27.8 p -64.95 -27.07 68.59 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.212 -177.394 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 82.2 mt -63.2 -39.34 94.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.767 0.318 . . . . 0.0 110.927 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -74.25 -14.76 80.43 Favored Glycine 0 C--O 1.225 -0.418 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.088 178.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.443 HD12 ' HA ' ' A' ' 143' ' ' CYS . 50.7 mt -90.78 -40.34 12.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.972 0.415 . . . . 0.0 110.493 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.436 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 29.7 m -87.15 12.57 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.883 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 7.7 pt-20 -42.32 112.51 1.1 Allowed Pre-proline 0 C--O 1.236 0.342 0 O-C-N 124.115 0.885 . . . . 0.0 112.146 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.97 -41.27 1.05 Allowed 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.441 2.094 . . . . 0.0 111.522 177.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 59.4 m -156.84 78.24 0.91 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.649 176.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -95.22 139.64 31.26 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.325 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -102.85 124.4 48.29 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.802 0.334 . . . . 0.0 110.105 175.109 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -107.62 150.29 27.06 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.609 176.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -153.78 158.35 40.78 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 17.8 m . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.913 -179.129 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 462' ' ' ASP . . . . . 0.71 ' OD2' ' HG3' ' B' ' 464' ' ' ARG . 7.5 t70 . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 463' ' ' ILE . . . . . 0.487 ' O ' ' HG3' ' B' ' 467' ' ' ARG . 71.5 mt -76.2 -32.81 23.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.329 -169.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 464' ' ' ARG . . . . . 0.71 ' HG3' ' OD2' ' B' ' 462' ' ' ASP . 1.4 ppt_? -70.63 -37.53 73.81 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -177.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 465' ' ' HIS . . . . . 0.543 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 49.8 t60 -65.88 -46.92 76.61 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.387 176.179 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.624 ' O ' HG12 ' B' ' 470' ' ' ILE . 39.7 mt-10 -58.91 -36.5 74.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.695 -179.302 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 467' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' B' ' 463' ' ' ILE . 19.1 mtm180 -66.67 -46.8 74.48 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 468' ' ' ASN . . . . . 0.543 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.9 p-10 -75.16 -19.01 60.07 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.934 -177.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.0 t -66.8 -34.88 72.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.347 170.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.624 HG12 ' O ' ' B' ' 466' ' ' GLU . 35.1 mm -65.12 -29.63 47.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 96.8 mt -56.05 -41.17 74.61 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.598 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.526 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.4 mp0 -64.79 -44.11 91.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.76 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 473' ' ' CYS . . . . . 0.415 ' O ' HG13 ' B' ' 477' ' ' ILE . 42.6 m -63.01 -52.95 60.97 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.268 0.556 . . . . 0.0 110.626 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.576 HG13 ' HG3' ' A' ' 114' ' ' MET . 24.5 t -56.45 -55.11 20.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.663 178.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.64 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 53.2 mtm180 -68.99 -20.18 64.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.232 -174.64 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 476' ' ' TYR . . . . . 0.427 ' O ' ' HD2' ' B' ' 480' ' ' LYS . 2.4 t80 -73.82 -55.28 6.41 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.193 176.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.415 HG13 ' O ' ' B' ' 473' ' ' CYS . 62.2 mt -60.54 -59.15 4.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-O 120.917 0.389 . . . . 0.0 111.242 -173.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.628 HD13 ' HA ' ' A' ' 115' ' ' VAL . 46.3 mt -53.71 -30.49 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.872 -176.093 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.668 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 1.5 ttmm -81.65 -19.04 42.53 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -166.214 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 480' ' ' LYS . . . . . 0.427 ' HD2' ' O ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER -120.45 -17.22 8.21 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 118.946 -1.102 . . . . 0.0 112.659 167.193 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -91.22 -60.06 1.99 Allowed 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.621 -0.432 . . . . 0.0 112.117 -177.072 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 482' ' ' PHE . . . . . 0.411 ' HB2' HG23 ' B' ' 478' ' ' ILE . 46.1 m-85 -79.94 -90.43 0.05 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.081 -170.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -95.78 -35.05 11.67 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.587 0.708 . . . . 0.0 110.237 -175.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.668 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 78.61 13.19 83.45 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.373 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 57.8 mt -89.83 160.96 16.23 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.031 0.443 . . . . 0.0 111.164 -177.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -147.7 -6.17 0.46 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.374 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 6.2 p -83.22 55.76 3.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.492 -177.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -118.94 77.92 1.23 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.396 0.617 . . . . 0.0 110.301 178.396 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 20.0 m -148.31 -172.74 4.15 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.315 177.491 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -70.95 -55.83 7.53 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.41 0.624 . . . . 0.0 111.068 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -122.09 48.03 1.8 Allowed 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.4 -176.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 5.8 p -86.12 115.71 23.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.574 178.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -143.42 132.03 22.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.626 0.25 . . . . 0.0 111.093 -177.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 21.9 t70 57.28 84.27 0.1 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.763 178.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.385 -0.817 . . . . 0.0 110.222 177.463 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.869 -0.492 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.39 135.16 64.69 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.882 2.388 . . . . 0.0 112.227 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -163.73 -76.6 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -178.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.433 ' SD ' ' HG2' ' A' ' 86' ' ' ARG . 6.3 tmm? -126.49 97.06 4.89 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 171.271 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -109.57 4.48 22.2 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -166.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.433 ' HG2' ' SD ' ' A' ' 84' ' ' MET . 30.2 ptt180 -90.46 163.73 14.54 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.28 178.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.655 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 48.8 t -109.72 136.0 46.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.58 -175.269 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.605 ' OG ' ' HG2' ' A' ' 90' ' ' GLN . 37.0 t -63.25 144.02 57.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.565 176.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.42 -21.36 66.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.846 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.605 ' HG2' ' OG ' ' A' ' 88' ' ' SER . 11.6 pt20 -66.5 -39.88 88.94 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 177.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -69.79 -35.24 74.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.11 177.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.3 mt -70.31 -37.94 74.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.763 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -61.73 -22.53 65.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.814 0.34 . . . . 0.0 111.849 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -78.69 -17.98 55.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.535 -178.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 95.9 mt -61.31 -47.07 87.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.698 -179.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -69.35 -12.21 65.87 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.744 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -86.44 -24.45 25.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.738 0.304 . . . . 0.0 110.899 -177.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.57 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 82.0 p -80.43 124.58 29.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.96 0.409 . . . . 0.0 110.432 -177.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.22 -26.65 65.82 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.075 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.7 m -68.22 -48.14 65.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.067 -178.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -67.8 -49.99 59.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.463 -175.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.57 ' HG2' ' O ' ' A' ' 98' ' ' SER . 7.9 ptp180 -60.63 -27.87 68.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.402 -178.315 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.3 t -68.62 -23.35 64.43 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.275 0.56 . . . . 0.0 110.001 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.1 mt -81.33 -32.51 32.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.811 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.8 mp -72.19 -5.29 34.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.349 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 57.1 mt -76.69 -8.31 57.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.229 176.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -87.48 117.84 69.08 Favored Pre-proline 0 C--N 1.332 -0.157 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 173.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -58.52 -32.15 95.88 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.825 2.35 . . . . 0.0 112.613 -178.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.8 t60 -66.86 -43.45 83.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.96 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 54.3 tp -63.3 -35.3 79.89 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.913 0.387 . . . . 0.0 110.008 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 -59.92 -42.97 95.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.075 177.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -64.26 -45.61 87.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.13 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.41 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 91.9 mt -56.3 -47.04 79.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.155 0.502 . . . . 0.0 110.351 178.209 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.468 ' HG2' HG22 ' B' ' 474' ' ' VAL . 71.4 mtp -58.75 -50.82 72.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.926 177.446 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.607 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 52.2 t -59.27 -41.97 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 120.804 0.335 . . . . 0.0 111.301 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -64.28 -45.24 88.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.262 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 48.5 tp -67.02 -39.94 87.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.298 -177.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.475 ' CB ' HD12 ' B' ' 478' ' ' ILE . 16.9 t70 -62.39 -33.53 74.95 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.961 -175.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 63.1 mt-30 -60.26 -26.86 66.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.265 0.555 . . . . 0.0 110.501 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.505 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 68.2 23.67 74.74 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.096 -0.956 . . . . 0.0 114.075 170.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -78.9 -45.83 19.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.132 0.491 . . . . 0.0 110.029 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.493 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 10.4 m-20 -132.44 31.65 4.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.756 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.668 ' HD2' ' N ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -53.22 -28.02 24.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.184 -0.916 . . . . 0.0 112.099 -179.013 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.668 ' N ' ' HD2' ' A' ' 123' ' ' LYS . . . -64.11 -38.43 91.03 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.369 0.604 . . . . 0.0 110.753 -175.455 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.424 ' HE3' ' HB3' ' A' ' 122' ' ' ASP . 46.6 mtmt -87.21 -42.02 13.28 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.004 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 86.2 mt -55.0 -42.04 72.02 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.404 -178.525 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.62 -41.53 55.04 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.162 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -82.34 -39.79 22.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.511 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.48 -32.28 73.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.251 -178.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.41 ' HE1' ' O ' ' A' ' 113' ' ' LEU . 3.4 m-30 -78.34 -17.35 56.65 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.01 -177.193 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.615 ' HE2' HG12 ' A' ' 137' ' ' VAL . 3.6 mmt -76.85 -4.22 42.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.251 -177.323 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -88.38 -20.01 25.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.104 0.478 . . . . 0.0 109.854 175.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -92.2 121.66 66.23 Favored Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.658 -172.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.717 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 28.4 Cg_endo -63.17 -14.06 39.44 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.107 2.538 . . . . 0.0 112.502 -178.223 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 52.7 mt -80.04 -34.6 38.13 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.88 177.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -89.58 -35.01 16.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.227 -175.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.717 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.8 m -57.62 -48.68 82.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.223 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.473 ' N ' HG23 ' A' ' 137' ' ' VAL . 27.3 mm-40 -61.34 -42.15 98.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.423 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -57.19 -50.96 71.22 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.219 0.533 . . . . 0.0 109.665 176.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.775 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.06 -45.37 92.53 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.976 179.363 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -63.02 -32.86 74.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.286 0.565 . . . . 0.0 110.493 -175.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 90.9 m -79.69 -44.87 20.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.611 -177.393 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.47 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -66.4 -28.27 68.5 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.157 -175.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.9 mt -58.82 -51.03 71.74 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.688 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.12 -21.45 65.99 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.322 -176.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 52.3 mt -86.99 -35.15 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.676 0.274 . . . . 0.0 110.853 -179.047 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.449 ' HB ' HG11 ' A' ' 87' ' ' VAL . 18.7 m -95.88 -5.75 10.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -175.752 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 25.0 mt-10 -85.03 113.05 47.72 Favored Pre-proline 0 C--N 1.327 -0.373 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.949 175.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' PRO . . . . . 0.419 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 72.0 Cg_endo -80.38 -11.16 13.26 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.806 2.338 . . . . 0.0 111.87 176.659 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 10.6 m -89.82 155.77 18.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.832 178.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -78.38 106.91 10.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.58 0.705 . . . . 0.0 110.451 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -96.08 141.42 29.49 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.692 -178.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.25 143.94 26.13 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.562 176.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 45.7 tt0 -70.27 91.51 0.73 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 0.0 110.348 -177.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.731 -0.652 . . . . 0.0 109.713 178.457 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 462' ' ' ASP . . . . . 0.564 ' O ' ' HG2' ' B' ' 466' ' ' GLU . 6.0 p-10 . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 121.368 0.604 . . . . 0.0 109.814 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 463' ' ' ILE . . . . . 0.46 ' O ' ' HD2' ' B' ' 467' ' ' ARG . 50.3 mm -67.08 -29.82 47.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.581 -173.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -58.87 -47.39 85.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.237 0.542 . . . . 0.0 110.398 177.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 465' ' ' HIS . . . . . 0.487 ' HD2' ' OE1' ' B' ' 466' ' ' GLU . 46.6 t60 -64.47 -43.11 95.23 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.051 178.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.564 ' HG2' ' O ' ' B' ' 462' ' ' ASP . 7.9 mm-40 -63.59 -22.67 67.02 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.408 -178.448 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 467' ' ' ARG . . . . . 0.571 ' HE ' ' HA ' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -84.14 -41.19 17.32 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.155 176.649 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -31.09 71.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.689 0.281 . . . . 0.0 110.623 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 31.5 m -69.59 -21.82 24.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-O 120.791 0.329 . . . . 0.0 110.907 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 466' ' ' GLU . 42.8 mm -66.64 -32.77 59.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.224 178.341 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 71.6 mt -58.79 -45.05 90.74 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.291 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.655 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.5 mp0 -62.24 -39.9 94.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.586 177.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 473' ' ' CYS . . . . . 0.59 ' O ' HG12 ' B' ' 477' ' ' ILE . 59.9 m -64.12 -57.71 8.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.356 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.468 HG22 ' HG2' ' A' ' 114' ' ' MET . 85.4 t -52.02 -50.28 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.12 176.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 22.8 ttm180 -66.65 -33.16 75.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.225 -174.359 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -61.23 -45.57 94.01 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 175.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.59 HG12 ' O ' ' B' ' 473' ' ' CYS . 9.2 mm -57.95 -63.5 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 121.765 0.793 . . . . 0.0 109.228 178.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.617 HG23 ' HB2' ' B' ' 482' ' ' PHE . 16.6 mt -56.32 -30.05 29.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.167 -1.379 . . . . 0.0 112.065 -174.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.556 ' HA ' ' CA ' ' B' ' 484' ' ' GLY . 80.7 tttt -60.31 -44.3 95.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 480' ' ' LYS . . . . . 0.496 ' HD3' ' N ' ' B' ' 481' ' ' ASP . 0.0 OUTLIER -108.19 -15.15 14.56 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.655 -177.276 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 481' ' ' ASP . . . . . 0.496 ' N ' ' HD3' ' B' ' 480' ' ' LYS . 11.9 t70 -91.3 -59.05 2.25 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.768 -178.703 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 482' ' ' PHE . . . . . 0.617 ' HB2' HG23 ' B' ' 478' ' ' ILE . 97.9 m-85 -100.42 -89.04 0.34 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -171.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -112.7 -51.0 2.86 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -171.224 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.556 ' CA ' ' HA ' ' B' ' 479' ' ' LYS . . . 66.04 28.4 73.64 Favored Glycine 0 N--CA 1.454 -0.165 0 C-N-CA 120.892 -0.671 . . . . 0.0 111.889 -175.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 58.5 mt -96.86 141.84 29.56 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.285 0.564 . . . . 0.0 111.383 -177.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -102.56 -7.04 22.17 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.907 175.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 2.4 p -74.21 7.22 2.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.161 -177.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 488' ' ' ASN . . . . . 0.457 HD22 ' N ' ' B' ' 488' ' ' ASN . 0.9 OUTLIER -84.24 -15.53 46.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.97 0.414 . . . . 0.0 110.479 179.085 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 44.5 t -156.39 139.87 15.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.247 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -88.49 13.24 12.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.042 176.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -125.32 34.12 5.01 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.831 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 20.5 t -81.95 81.66 7.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.574 0.702 . . . . 0.0 109.546 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -119.95 151.88 38.27 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.522 -176.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -76.02 -46.79 27.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.002 177.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.746 176.658 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.855 0 N-CA-C 111.834 -0.506 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -51.89 -62.21 0.41 Allowed 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.056 2.504 . . . . 0.0 112.558 -174.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -102.14 37.25 1.91 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.193 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 86.2 mtp 55.51 62.85 2.28 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.904 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.448 ' HA ' ' ND1' ' B' ' 465' ' ' HIS . 15.3 p-10 -88.98 -38.68 14.26 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.102 -176.131 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -74.79 115.73 14.72 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -88.58 146.95 5.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.545 -176.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.0 m -63.87 144.69 56.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.312 0.577 . . . . 0.0 111.249 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 tt -66.13 -30.39 70.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.107 -0.952 . . . . 0.0 110.156 -176.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -58.79 -36.91 75.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.347 176.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -68.09 -40.06 82.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.0 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.421 HD11 ' HB3' ' B' ' 472' ' ' GLN . 83.7 mt -65.14 -34.49 78.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.439 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.415 ' HA ' ' CE2' ' B' ' 476' ' ' TYR . 10.4 mtpm? -59.1 -25.21 63.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.016 179.561 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -72.29 -16.81 61.91 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.455 ' HB2' ' CE1' ' B' ' 476' ' ' TYR . 93.1 mt -62.01 -51.93 66.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.769 0.318 . . . . 0.0 110.719 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -64.08 -19.3 63.56 Favored Glycine 0 CA--C 1.519 0.34 0 C-N-CA 121.02 -0.61 . . . . 0.0 112.47 176.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -79.3 -16.43 56.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.725 0.298 . . . . 0.0 110.751 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.535 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 31.0 t -83.23 120.07 25.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.06 0.457 . . . . 0.0 111.051 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.96 -27.95 67.04 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.401 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 77.3 m -70.33 -47.38 61.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.884 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.592 HD12 HD11 ' A' ' 104' ' ' LEU . 17.4 tp -65.72 -50.15 65.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.92 -174.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.8 ptp180 -58.09 -25.1 60.91 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.142 -0.223 . . . . 0.0 111.44 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 73.9 m -74.15 -39.35 63.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.592 HD11 HD12 ' A' ' 101' ' ' LEU . 0.7 OUTLIER -87.12 -15.51 38.23 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.908 177.94 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.71 HD21 HD13 ' B' ' 477' ' ' ILE . 7.3 mp -68.95 -4.34 16.3 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.109 0.481 . . . . 0.0 110.774 168.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 97.1 mt -81.95 -11.73 58.73 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.774 177.143 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.575 ' O ' ' HG3' ' A' ' 111' ' ' ARG . 56.4 m-80 -75.88 115.21 44.29 Favored Pre-proline 0 N--CA 1.463 0.192 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 175.104 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.42 -26.3 82.41 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.556 2.171 . . . . 0.0 112.193 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -69.62 -47.09 64.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.261 177.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 58.5 tp -64.01 -34.6 78.37 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.343 0.592 . . . . 0.0 110.145 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.575 ' HG3' ' O ' ' A' ' 107' ' ' ASN . 70.5 mtp85 -65.05 -42.47 94.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.679 177.064 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -64.01 -39.79 94.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.062 177.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 84.0 mt -59.04 -48.45 81.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.828 178.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.543 ' HG2' HG22 ' B' ' 474' ' ' VAL . 44.2 mtm -57.77 -53.02 62.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.575 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.572 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.1 m -65.7 -28.86 45.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.714 -175.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -69.14 -46.77 66.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.084 0.469 . . . . 0.0 110.518 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.587 HD11 ' SD ' ' A' ' 127' ' ' MET . 33.8 tp -63.3 -38.94 93.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.861 -178.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.538 ' OD1' ' HG2' ' B' ' 475' ' ' ARG . 9.4 t70 -63.71 -30.34 71.45 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.851 -177.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.572 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 74.4 mt-30 -60.09 -29.63 68.71 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.503 0.668 . . . . 0.0 109.819 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.35 18.72 73.65 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 114.62 -1.173 . . . . 0.0 113.902 171.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -67.07 -55.36 14.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.202 0.501 . . . . 0.0 110.227 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -133.71 45.22 2.68 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.368 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.596 ' O ' ' HG2' ' A' ' 127' ' ' MET . 0.0 OUTLIER -56.92 -29.5 63.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.462 -178.037 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.45 -38.41 84.08 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.812 0.339 . . . . 0.0 111.412 -177.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.597 ' HD2' ' H ' ' A' ' 125' ' ' LYS . 0.0 OUTLIER -87.4 -33.9 18.95 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.477 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.451 HD22 ' CE2' ' A' ' 130' ' ' TYR . 97.4 mt -60.69 -36.02 77.74 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.729 -179.399 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' MET . . . . . 0.596 ' HG2' ' O ' ' A' ' 123' ' ' LYS . 73.9 mmm -53.6 -43.91 68.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.975 0.417 . . . . 0.0 110.454 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.8 mmm180 -72.44 -38.79 68.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.981 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.89 -24.55 63.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.419 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.451 ' CE2' HD22 ' A' ' 126' ' ' LEU . 2.5 m-30 -88.82 -30.62 18.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.834 0.35 . . . . 0.0 110.699 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 1.3 mmt -68.75 -10.36 56.07 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.503 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.8 pt20 -95.65 -9.65 31.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.87 0.367 . . . . 0.0 110.499 -178.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.573 ' O ' HG23 ' A' ' 137' ' ' VAL . 3.4 mt-10 -91.97 121.88 66.13 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.749 -175.017 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.52 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 18.3 Cg_endo -59.31 -20.19 54.33 Favored 'Trans proline' 0 C--O 1.226 -0.113 0 C-N-CA 122.963 2.442 . . . . 0.0 112.585 -177.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.1 mt -80.33 -41.18 25.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.99 0.424 . . . . 0.0 110.535 178.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -78.59 -32.38 47.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.087 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' ' 133' ' ' GLU . 79.6 t -59.91 -42.01 87.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.781 177.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 17.5 mm-40 -69.25 -42.97 74.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.106 178.02 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -58.35 -49.22 77.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.695 178.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.793 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -61.64 -47.43 85.42 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.98 -177.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -63.91 -33.21 75.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.163 0.506 . . . . 0.0 110.263 -178.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.445 ' O ' HG13 ' A' ' 146' ' ' ILE . 65.3 m -67.4 -51.46 51.59 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.761 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.451 ' O ' HG22 ' A' ' 147' ' ' VAL . 26.1 p -64.64 -33.15 75.26 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.704 -0.225 . . . . 0.0 111.203 -177.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.793 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.5 mt -62.71 -36.92 84.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.934 0.397 . . . . 0.0 110.825 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -77.19 -15.32 81.68 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.355 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 142' ' ' CYS . 67.6 mt -91.71 -38.9 11.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.069 0.462 . . . . 0.0 110.964 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.451 HG22 ' O ' ' A' ' 143' ' ' CYS . 19.3 m -95.57 11.35 4.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.108 -177.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.421 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 2.8 pt-20 -47.62 126.8 10.53 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.456 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -69.05 -40.0 7.06 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.289 1.992 . . . . 0.0 111.464 176.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 26.0 t -178.23 36.69 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.624 177.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 51.17 52.76 14.23 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -175.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -89.19 140.88 29.02 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.057 -175.013 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -96.34 142.06 28.93 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.035 176.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 60.21 27.37 16.87 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.257 0.551 . . . . 0.0 111.299 -176.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 41.1 p . . . . . 0 C--O 1.255 1.394 0 CA-C-O 117.819 -1.086 . . . . 0.0 109.133 173.498 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 14.3 t70 . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 121.154 0.502 . . . . 0.0 110.099 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 463' ' ' ILE . . . . . 0.562 ' H ' HD12 ' B' ' 463' ' ' ILE . 4.2 mp -61.5 -35.42 66.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.612 -170.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -70.5 -39.71 74.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.17 0.51 . . . . 0.0 109.768 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 465' ' ' HIS . . . . . 0.448 ' ND1' ' HA ' ' A' ' 85' ' ' ASP . 47.6 t60 -62.48 -51.19 68.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.083 174.17 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.662 ' O ' HG12 ' B' ' 470' ' ' ILE . 34.5 mt-10 -61.59 -43.67 98.43 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.198 -175.523 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -55.46 -40.08 71.16 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 177.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -31.49 52.85 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -177.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.4 t -63.66 -36.0 74.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.266 175.417 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.662 HG12 ' O ' ' B' ' 466' ' ' GLU . 34.0 mm -60.86 -38.57 79.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.879 176.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 87.2 mt -59.29 -37.06 76.75 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.421 ' HB3' HD11 ' A' ' 92' ' ' LEU . 1.6 mp0 -68.12 -44.23 76.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.689 176.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 60.4 m -63.15 -56.1 19.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.104 -177.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.543 HG22 ' HG2' ' A' ' 114' ' ' MET . 73.9 t -48.85 -52.66 9.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.762 176.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.538 ' HG2' ' OD1' ' A' ' 118' ' ' ASP . 88.4 mtm180 -69.68 -23.05 63.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.918 -174.238 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 476' ' ' TYR . . . . . 0.455 ' CE1' ' HB2' ' A' ' 95' ' ' LEU . 0.8 OUTLIER -71.17 -47.36 58.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.969 0.414 . . . . 0.0 110.013 176.559 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.71 HD13 HD21 ' A' ' 105' ' ' LEU . 74.5 mt -64.89 -54.16 33.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.513 -177.222 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 478' ' ' ILE . . . . . 0.514 HG23 ' HB2' ' B' ' 482' ' ' PHE . 50.5 mt -54.39 -26.45 15.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.694 178.35 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.599 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 3.6 ttmp? -70.81 -31.15 67.8 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.908 -173.325 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.46 -17.54 10.64 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.785 -0.766 . . . . 0.0 112.581 175.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -91.54 -58.82 2.31 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.967 0.413 . . . . 0.0 112.062 -174.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 482' ' ' PHE . . . . . 0.514 ' HB2' HG23 ' B' ' 478' ' ' ILE . 73.5 m-85 -86.91 -90.23 0.11 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.436 -169.033 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -102.06 -31.09 10.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.191 0.52 . . . . 0.0 110.681 -174.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.599 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 86.96 8.51 75.73 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.911 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 73.5 mt -84.55 140.03 31.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.24 0.543 . . . . 0.0 111.387 -176.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 486' ' ' ASP . . . . . 0.458 ' HB3' ' HE3' ' B' ' 479' ' ' LYS . 5.6 p-10 -128.13 -4.7 5.58 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.013 174.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 11.9 t -84.13 29.21 0.57 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.85 -178.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -88.41 107.57 18.92 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.64 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 57.2 m 71.34 167.36 0.31 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.431 -175.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . 62.13 34.7 16.13 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.204 0.526 . . . . 0.0 110.809 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -82.55 123.35 29.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.7 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 63.8 m -146.95 95.28 2.55 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.106 0.479 . . . . 0.0 110.147 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -82.01 15.83 2.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.719 -174.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -81.09 -18.16 47.5 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.229 177.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.246 0.918 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.956 176.736 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.819 0 N-CA-C 111.786 -0.526 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.412 ' O ' ' HB2' ' A' ' 83' ' ' HIS . 79.0 Cg_exo -48.59 115.83 1.8 Allowed 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.231 2.621 . . . . 0.0 112.46 -179.629 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 82' ' ' PRO . 69.0 m-70 72.3 -47.47 0.67 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.711 0.804 . . . . 0.0 111.567 -177.321 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 24.9 mmt -86.3 71.96 10.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.205 0.526 . . . . 0.0 111.482 -178.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -115.49 25.66 10.64 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 170.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -75.9 160.59 29.75 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.847 -173.525 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.9 p -107.3 157.82 7.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.467 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.8 m -64.07 147.59 51.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.224 0.535 . . . . 0.0 111.251 -176.608 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.507 HD22 HD12 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -67.68 -31.68 71.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.218 -174.846 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -57.97 -41.13 82.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.369 176.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.433 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 5.3 m-20 -64.41 -40.27 95.46 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.227 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.507 HD12 HD22 ' A' ' 89' ' ' LEU . 83.3 mt -67.71 -36.62 80.96 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.889 -178.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -62.81 -19.06 63.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -79.02 -17.76 54.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.61 0.243 . . . . 0.0 111.034 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.424 HD21 HG13 ' A' ' 147' ' ' VAL . 95.4 mt -61.82 -52.69 63.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.816 0.341 . . . . 0.0 111.327 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -64.27 -22.81 67.63 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.794 -176.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -97.38 -15.31 20.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.275 0.537 . . . . 0.0 111.576 -175.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.51 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 68.3 m -71.8 116.11 11.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.469 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.51 -29.06 65.99 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.707 -174.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 18.7 m -68.79 -48.54 63.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.958 0.409 . . . . 0.0 110.902 -178.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.406 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 41.9 tp -68.88 -48.05 64.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.668 -172.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.575 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 7.8 ptp180 -60.3 -28.38 68.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.479 -178.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 71.1 m -66.69 -25.63 66.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.99 0.424 . . . . 0.0 110.789 177.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.441 ' O ' HD23 ' A' ' 110' ' ' LEU . 22.6 mt -81.48 -33.26 32.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.406 HD21 HD13 ' B' ' 477' ' ' ILE . 11.0 mp -67.48 -12.68 60.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.531 177.439 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 70.3 mt -77.54 -8.0 57.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.348 177.689 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 108' ' ' PRO . 88.3 m-20 -84.21 115.01 58.17 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.705 176.099 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 107' ' ' ASN . 50.0 Cg_exo -54.33 -36.65 87.6 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.451 2.767 . . . . 0.0 113.373 -175.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 60.3 t60 -69.15 -45.01 71.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.594 0.235 . . . . 0.0 110.866 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 104' ' ' LEU . 49.8 tp -62.12 -38.2 88.03 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.132 0.491 . . . . 0.0 109.999 -178.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.42 ' O ' HG22 ' A' ' 115' ' ' VAL . 58.7 mtp180 -56.11 -49.79 72.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.048 174.634 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -63.04 -24.16 67.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.924 -179.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 77.4 mt -78.6 -53.24 7.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -177.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' MET . . . . . 0.578 ' HG3' HG13 ' B' ' 474' ' ' VAL . 42.0 ttp -61.28 -42.21 98.27 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.367 -1.288 . . . . 0.0 111.58 -177.29 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 111' ' ' ARG . 26.3 m -72.95 -28.88 27.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.38 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -62.59 -46.2 89.37 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.145 0.497 . . . . 0.0 110.652 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.1 tp -56.46 -33.89 66.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.399 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -65.92 -32.27 73.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.564 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.66 -29.04 69.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.54 0.686 . . . . 0.0 110.553 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 71.94 19.04 78.06 Favored Glycine 0 C--N 1.322 -0.248 0 CA-C-N 114.89 -1.05 . . . . 0.0 113.775 172.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -70.07 -56.01 8.02 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.988 0.423 . . . . 0.0 110.076 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.599 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 20.4 m-20 -123.52 41.37 3.49 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.468 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.85 -33.16 48.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.026 -177.138 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.55 -38.99 65.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.156 0.503 . . . . 0.0 110.896 -177.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.6 mtpt -79.08 -38.84 35.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.502 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 89.6 mt -61.79 -39.09 90.48 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.962 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.88 -35.85 58.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.872 0.368 . . . . 0.0 111.326 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -84.1 -45.43 13.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.227 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.696 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -64.09 -31.96 73.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.749 -177.403 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.553 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 5.2 m-30 -72.39 -22.49 61.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.151 0.5 . . . . 0.0 110.411 -178.022 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.58 ' HE2' HG12 ' A' ' 137' ' ' VAL . 1.6 mmt -85.74 1.39 49.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.995 -178.432 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.696 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 17.7 pt20 -101.19 -14.13 17.84 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 175.056 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -91.13 120.03 68.64 Favored Pre-proline 0 N--CA 1.451 -0.388 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.331 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.709 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 29.0 Cg_endo -62.6 -13.61 34.71 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.98 2.453 . . . . 0.0 112.32 -179.107 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 86.9 mt -83.52 -32.29 25.98 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.07 178.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.553 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 47.4 t80 -90.43 -34.36 15.65 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.303 -177.487 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.709 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 8.6 m -57.11 -46.16 84.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.414 178.007 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.457 ' N ' HG23 ' A' ' 137' ' ' VAL . 5.7 mm-40 -62.31 -43.93 97.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.45 177.07 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -55.1 -49.74 70.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.818 175.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.756 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.81 -47.99 81.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.946 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -61.82 -33.45 74.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.4 0.619 . . . . 0.0 110.524 -176.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.6 m -76.8 -40.92 46.45 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.49 -177.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.514 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -73.07 -29.47 62.98 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.607 -177.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.4 mt -60.52 -44.09 96.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.604 178.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.38 -20.68 69.78 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.333 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 56.6 mt -87.85 -30.48 5.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.842 0.353 . . . . 0.0 110.568 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.433 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 23.2 m -102.31 8.98 9.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -176.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 42.6 mm-40 -56.95 117.79 19.78 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 120.644 0.259 . . . . 0.0 110.725 176.104 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -74.92 -7.22 19.03 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.563 2.175 . . . . 0.0 112.167 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 18.6 t 68.47 82.71 0.17 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.55 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -84.21 27.72 0.67 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.882 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -131.09 129.01 41.36 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.413 176.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -65.47 144.51 56.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.244 -176.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -161.19 157.91 26.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.981 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 42.6 m . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.182 176.178 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 462' ' ' ASP . . . . . 0.6 ' O ' ' HG2' ' B' ' 466' ' ' GLU . 14.1 t70 . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 120.985 0.422 . . . . 0.0 110.724 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 59.8 mt -68.53 -32.25 54.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.47 -173.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 464' ' ' ARG . . . . . 0.449 ' HB2' ' OD1' ' B' ' 462' ' ' ASP . 11.5 mmm180 -58.66 -42.12 87.67 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 175.419 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 70.8 t60 -65.96 -46.78 76.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.06 177.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 466' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' B' ' 462' ' ' ASP . 6.1 mm-40 -56.01 -50.22 71.5 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.059 -178.081 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 36.2 mtm180 -65.26 -33.08 75.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.618 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.05 -31.44 62.87 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.723 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.4 t -66.13 -36.32 77.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.223 174.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 470' ' ' ILE . . . . . 0.598 HG12 ' O ' ' B' ' 466' ' ' GLU . 43.2 mm -61.1 -35.96 69.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.201 176.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 471' ' ' LEU . . . . . 0.469 ' O ' ' HG3' ' B' ' 475' ' ' ARG . 93.3 mt -56.44 -48.48 76.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.12 176.605 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 472' ' ' GLN . . . . . 0.442 ' HB3' HD11 ' A' ' 92' ' ' LEU . 2.0 mp0 -59.46 -40.47 86.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.039 177.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.0 m -61.84 -55.47 29.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.976 0.417 . . . . 0.0 110.055 178.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 474' ' ' VAL . . . . . 0.578 HG13 ' HG3' ' A' ' 114' ' ' MET . 45.8 t -51.75 -50.42 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.597 177.376 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 475' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' B' ' 471' ' ' LEU . 82.8 mtp180 -64.47 -39.0 92.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.286 -175.607 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 476' ' ' TYR . . . . . 0.419 ' O ' ' HG3' ' B' ' 480' ' ' LYS . 0.9 OUTLIER -67.72 -45.84 73.88 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 120.867 0.365 . . . . 0.0 110.502 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 477' ' ' ILE . . . . . 0.406 HD13 HD21 ' A' ' 105' ' ' LEU . 97.5 mt -63.97 -60.54 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.434 -175.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 56.3 mt -53.65 -28.1 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.763 0.316 . . . . 0.0 111.326 -178.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 479' ' ' LYS . . . . . 0.634 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 27.4 ttpp -76.45 -32.55 58.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.078 -173.038 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 480' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER -114.39 -15.8 12.05 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.02 -0.672 . . . . 0.0 112.108 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -91.36 -60.24 1.94 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.041 0.448 . . . . 0.0 111.748 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -99.23 -91.63 0.28 Allowed 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -168.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -90.84 -35.71 14.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.326 -169.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 484' ' ' GLY . . . . . 0.634 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 93.67 6.96 61.95 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.138 -178.061 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 43.2 mt -86.13 162.9 18.16 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.811 0.339 . . . . 0.0 110.781 -178.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -175.45 -43.82 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.742 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 11.3 t -104.32 28.3 7.01 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.992 -179.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -116.39 107.9 15.37 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.99 -171.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 47.9 m -153.26 100.93 2.5 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.267 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -141.33 52.12 1.56 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.525 0.679 . . . . 0.0 110.052 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -120.22 18.8 12.26 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.242 -176.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 23.8 t -124.68 136.59 54.03 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.107 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -97.78 10.83 39.12 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.195 0.522 . . . . 0.0 110.518 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -99.46 -16.9 18.19 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.025 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 42.4 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.946 -179.651 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 . . . . . 0 N--CA 1.451 -0.417 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.508 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 38.3 t -89.01 143.59 10.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.069 -173.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.0 m -75.84 142.98 42.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.929 176.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.9 mt -55.24 -31.56 61.6 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.208 -0.906 . . . . 0.0 113.138 -173.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -53.31 -51.05 63.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.946 0.403 . . . . 0.0 110.816 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.485 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 6.2 m-20 -63.81 -35.83 81.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.717 -178.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 84.7 mt -72.66 -39.37 67.18 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.448 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.522 ' HA ' ' CZ ' ' B' ' 476' ' ' TYR . 97.3 mttt -66.94 -26.34 66.79 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.929 0.395 . . . . 0.0 110.985 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -69.99 -17.69 63.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.994 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.496 HD21 HG13 ' A' ' 147' ' ' VAL . 73.4 mt -65.14 -46.88 79.12 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.917 0.389 . . . . 0.0 110.409 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.39 -20.12 71.26 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.578 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -84.59 -23.87 29.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.849 0.357 . . . . 0.0 110.434 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.624 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 43.7 t -70.91 115.42 10.03 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.095 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.11 -30.05 67.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.173 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.9 m -72.99 -45.18 59.38 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.984 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.2 tt -74.3 -44.4 52.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.899 -172.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 98' ' ' SER . 2.8 ptp180 -56.99 -32.27 65.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.95 178.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.502 ' HA ' HD23 ' A' ' 106' ' ' LEU . 71.3 m -68.89 -18.06 64.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.864 0.364 . . . . 0.0 111.275 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 139' ' ' PHE . 17.2 mt -78.08 -33.7 50.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.105 0.479 . . . . 0.0 109.718 178.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -63.2 -18.05 63.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.193 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.502 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.4 mm? -68.94 -10.79 59.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.358 178.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -86.13 118.86 71.15 Favored Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -62.08 -26.64 78.37 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.98 2.453 . . . . 0.0 112.615 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -76.29 -46.65 26.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.913 0.387 . . . . 0.0 110.165 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.427 HD11 ' HB2' ' A' ' 139' ' ' PHE . 3.9 tt -62.04 -42.81 99.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.267 -176.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 8.9 ptp180 -67.21 -31.04 71.15 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.828 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . 0.562 ' HA ' HE21 ' A' ' 112' ' ' GLN . 0.0 OUTLIER -70.37 -38.61 74.8 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.659 -0.246 . . . . 0.0 110.366 176.169 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.437 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 81.3 mt -57.36 -50.92 71.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.159 0.504 . . . . 0.0 109.929 174.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.451 ' HG2' HG22 ' B' ' 474' ' ' VAL . 62.2 mtp -52.01 -57.0 10.81 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.72 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.715 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 27.4 m -64.04 -36.28 76.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.729 -176.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -64.6 -47.69 77.68 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.018 0.437 . . . . 0.0 110.927 178.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 62.3 tp -60.93 -40.35 92.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.058 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -66.4 -41.07 89.87 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.685 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.715 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 71.8 mt-30 -64.1 -28.31 69.69 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.595 0.712 . . . . 0.0 110.27 -178.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 75.69 31.45 56.21 Favored Glycine 0 N--CA 1.444 -0.815 0 CA-C-N 114.687 -1.142 . . . . 0.0 113.703 168.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -51.43 -42.25 61.39 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.059 0.457 . . . . 0.0 109.958 178.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.496 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 10.1 t70 -162.72 72.81 0.34 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 170.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.708 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.6 OUTLIER -53.76 -26.53 23.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.99 178.903 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.31 -54.69 43.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.411 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -25.95 27.25 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.291 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.55 HD22 ' CE2' ' A' ' 130' ' ' TYR . 95.4 mt -62.48 -43.36 99.01 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.438 178.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.575 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.4 OUTLIER -57.2 -28.49 62.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.921 0.391 . . . . 0.0 111.432 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -84.42 -49.16 8.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.922 0.391 . . . . 0.0 110.509 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.475 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -67.96 -16.35 64.02 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.302 -176.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.55 ' CE2' HD22 ' A' ' 126' ' ' LEU . 3.0 m-30 -88.78 -23.26 22.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.734 0.302 . . . . 0.0 111.722 -179.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -84.09 -0.18 50.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.085 0.469 . . . . 0.0 111.03 -176.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.475 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.5 pt20 -101.81 -16.22 16.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.963 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.43 ' O ' HG23 ' A' ' 137' ' ' VAL . 2.4 mt-10 -93.65 118.77 67.51 Favored Pre-proline 0 N--CA 1.449 -0.505 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.713 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 12.1 Cg_endo -55.54 -25.87 51.72 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.072 2.515 . . . . 0.0 112.658 -173.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.6 mt -66.64 -45.23 79.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.964 0.411 . . . . 0.0 110.658 -178.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.425 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 37.0 t80 -76.88 -29.06 55.63 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 -177.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 133' ' ' GLU . 75.2 t -62.9 -42.56 96.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.292 176.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.713 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 33.8 mm-40 -60.64 -46.66 89.47 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.895 0.379 . . . . 0.0 110.016 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . 0.509 ' HA ' ' CD1' ' A' ' 104' ' ' LEU . 77.1 t80 -59.57 -47.39 85.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.771 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.775 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.74 -47.22 84.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.185 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -67.94 -27.37 66.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.12 0.486 . . . . 0.0 110.395 -176.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 69.7 m -75.71 -44.17 43.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.407 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 27.6 p -69.74 -30.61 68.25 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.816 -176.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 86.1 mt -59.27 -48.12 82.82 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.966 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.42 -21.65 66.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.634 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 54.6 mt -91.02 -32.66 5.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.568 0.223 . . . . 0.0 111.361 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.496 HG13 HD21 ' A' ' 95' ' ' LEU . 14.9 m -102.53 -16.88 7.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -174.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 . . . . . 0 C--N 1.324 -0.524 0 CA-C-O 120.737 0.303 . . . . 0.0 111.571 -178.569 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 41.0 mm . . . . . 0 C--O 1.233 0.188 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -60.72 -41.36 95.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.572 0.701 . . . . 0.0 109.448 177.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -75.71 -49.38 18.46 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.805 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.548 ' O ' HG12 ' B' ' 470' ' ' ILE . 45.6 mt-10 -57.66 -47.93 80.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.171 -173.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . 0.575 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 78.3 mtm180 -60.37 -35.49 75.83 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -177.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.98 -31.22 58.88 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.99 -35.37 73.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.323 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.548 HG12 ' O ' ' B' ' 466' ' ' GLU . 24.6 mm -61.84 -35.92 70.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.101 177.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 86.8 mt -60.46 -38.02 82.85 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.829 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.508 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 1.8 mp0 -68.15 -41.11 82.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.877 0.37 . . . . 0.0 110.579 177.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.1 m -63.96 -56.11 17.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.806 -178.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.451 HG22 ' HG2' ' A' ' 114' ' ' MET . 82.7 t -52.3 -51.06 34.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.971 178.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 32.3 ttm180 -66.37 -33.33 75.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.492 -172.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . 0.522 ' CZ ' ' HA ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -63.72 -46.89 83.37 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.097 0.475 . . . . 0.0 109.948 176.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 75.6 mt -64.12 -51.02 74.17 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.511 -176.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . 0.447 HG13 ' O ' ' B' ' 474' ' ' VAL . 40.5 mt -58.21 -23.68 22.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.96 0.41 . . . . 0.0 110.918 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 20.7 tptp -74.73 -35.31 62.66 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.254 -175.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.602 0 C-N-CA 119.916 -0.714 . . . . 0.0 112.406 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.971 0.415 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.423 HG21 HG13 ' B' ' 469' ' ' VAL . 46.5 t -68.99 130.53 34.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.059 -176.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.5 m -67.89 156.8 36.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.049 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.617 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -59.48 -42.07 91.24 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 -176.671 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -52.94 -38.29 61.84 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.99 0.424 . . . . 0.0 111.249 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -80.46 -17.76 50.72 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.176 -177.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.416 ' HA ' HD13 ' A' ' 95' ' ' LEU . 84.2 mt -86.8 -35.35 19.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.316 176.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.617 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 53.2 mtpt -54.47 -37.1 64.84 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -175.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.453 HD22 HG22 ' A' ' 146' ' ' ILE . 0.0 OUTLIER -71.84 -17.07 62.17 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -175.721 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 92' ' ' LEU . 9.6 mp -60.3 -48.7 80.63 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -66.81 -21.46 71.26 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.263 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -85.09 -23.25 28.59 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.97 0.414 . . . . 0.0 110.609 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.646 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 42.6 t -65.68 118.21 9.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.259 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.62 -27.24 68.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.265 -177.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 80.2 m -75.12 -43.2 54.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.062 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 20.0 tp -75.64 -44.29 43.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.763 -171.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.646 ' HG2' ' O ' ' A' ' 98' ' ' SER . 7.6 ptp180 -58.91 -30.68 67.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.062 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.1 m -65.47 -24.86 67.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.029 0.443 . . . . 0.0 110.876 177.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.9 mt -83.63 -32.63 25.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.824 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.48 -21.96 66.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.457 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 74.6 mt -71.63 -13.15 61.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.848 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -81.37 113.94 45.53 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.928 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.504 ' HA ' ' NE ' ' A' ' 111' ' ' ARG . 48.9 Cg_exo -56.06 -37.02 96.92 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.088 2.526 . . . . 0.0 113.388 -177.012 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.503 ' CD2' HD22 ' A' ' 135' ' ' LEU . 47.7 t60 -69.27 -41.39 76.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.044 0.449 . . . . 0.0 110.384 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.515 HD11 ' HB2' ' A' ' 139' ' ' PHE . 2.5 tt -64.71 -46.64 81.45 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.985 -177.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.504 ' NE ' ' HA ' ' A' ' 108' ' ' PRO . 16.3 ptt180 -68.15 -28.47 67.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.872 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -44.32 95.85 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.168 0.508 . . . . 0.0 109.737 173.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.86 -47.25 85.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.183 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.472 ' HG2' HG22 ' B' ' 474' ' ' VAL . 51.1 mtp -56.7 -50.79 71.11 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.208 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.61 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.2 m -65.4 -32.27 57.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.861 -0.335 . . . . 0.0 111.136 -178.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -65.94 -41.27 91.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.054 0.454 . . . . 0.0 110.704 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.447 HD11 ' SD ' ' A' ' 127' ' ' MET . 32.9 tp -68.14 -37.38 80.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.759 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.446 ' OD1' HG21 ' B' ' 478' ' ' ILE . 36.7 t70 -64.29 -29.57 70.65 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.778 0.323 . . . . 0.0 111.472 -177.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.61 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 68.4 mt-30 -63.53 -28.37 69.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.375 0.607 . . . . 0.0 110.721 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.27 27.78 72.8 Favored Glycine 0 CA--C 1.516 0.154 0 CA-C-N 114.832 -1.076 . . . . 0.0 114.106 170.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -85.0 -53.79 5.06 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.177 0.513 . . . . 0.0 110.29 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -124.04 33.45 5.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.527 -176.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.676 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -45.77 -38.27 6.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.847 -1.069 . . . . 0.0 112.08 177.023 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.16 -41.5 79.33 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 121.01 0.433 . . . . 0.0 111.527 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -85.4 -36.36 20.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.523 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.44 HD22 ' CE1' ' A' ' 130' ' ' TYR . 96.2 mt -57.48 -42.48 82.69 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.63 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.62 ' HG2' ' O ' ' A' ' 123' ' ' LYS . 69.4 mmm -53.16 -39.63 63.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.902 0.382 . . . . 0.0 110.768 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 -70.74 -48.9 52.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.307 0.575 . . . . 0.0 110.208 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.605 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -70.64 -19.45 62.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.221 -0.9 . . . . 0.0 112.328 -174.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.57 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.5 m-30 -85.47 -26.22 26.43 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.84 0.352 . . . . 0.0 110.618 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . 0.466 ' HE2' HG12 ' A' ' 137' ' ' VAL . 19.2 mmt -80.75 0.54 34.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.202 -179.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.605 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.6 pt20 -105.73 -5.15 20.17 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.864 0.364 . . . . 0.0 110.296 177.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.401 ' O ' HG22 ' A' ' 137' ' ' VAL . 2.3 mt-10 -106.23 121.41 45.56 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.705 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 23.8 Cg_endo -61.42 -13.12 27.29 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.298 2.665 . . . . 0.0 113.085 -176.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.503 HD22 ' CD2' ' A' ' 109' ' ' HIS . 6.8 mp -77.3 -40.34 44.69 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.135 177.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.57 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 40.4 t80 -89.06 -33.16 17.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.105 0.479 . . . . 0.0 110.229 -172.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.705 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 9.5 m -58.31 -47.73 86.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.385 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.465 ' N ' HG23 ' A' ' 137' ' ' VAL . 10.8 pt-20 -67.63 -34.96 78.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.775 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . 0.515 ' HB2' HD11 ' A' ' 110' ' ' LEU . 45.3 t80 -58.06 -49.6 76.33 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 173.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.764 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -61.23 -46.42 90.48 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.73 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.49 -32.24 72.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.379 0.609 . . . . 0.0 110.885 -176.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 95.2 m -82.71 -38.42 23.35 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.093 -176.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.476 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 25.7 p -73.65 -27.02 61.04 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.246 -176.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.764 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 93.6 mt -60.06 -38.23 82.21 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.098 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -71.87 -16.81 76.52 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.387 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.453 HG22 HD22 ' A' ' 94' ' ' ASN . 25.1 mt -91.26 -28.77 4.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.729 0.299 . . . . 0.0 110.896 -178.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 31.0 m -96.7 2.61 10.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 . . . . . 0 N--CA 1.465 0.296 0 C-N-CA 121.127 -0.229 . . . . 0.0 110.484 175.895 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 57.6 mt . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -57.56 -45.71 84.81 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.469 0.652 . . . . 0.0 109.287 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 63.8 t60 -67.7 -55.87 11.51 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.499 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.479 ' O ' ' HB ' ' B' ' 469' ' ' VAL . 38.4 mt-10 -56.68 -46.5 81.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.588 -172.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -74.12 -28.47 61.36 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.363 -175.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -27.02 48.62 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . 0.479 ' HB ' ' O ' ' B' ' 466' ' ' GLU . 2.4 t -61.23 -33.96 58.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.606 173.01 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.418 HG12 ' O ' ' B' ' 466' ' ' GLU . 30.1 mm -65.4 -28.07 43.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.797 -178.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.81 -29.91 70.47 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.124 0.487 . . . . 0.0 110.344 177.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -81.27 -40.59 23.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.01 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 61.2 m -62.09 -56.85 14.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.816 -177.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.687 ' O ' HG12 ' B' ' 478' ' ' ILE . 88.5 t -54.12 -50.57 54.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.402 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -64.69 -36.89 85.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.984 -171.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -43.78 88.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.24 0.543 . . . . 0.0 109.743 175.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.504 ' O ' ' HD3' ' B' ' 480' ' ' LYS . 78.1 mt -65.91 -53.84 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.227 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . 0.687 HG12 ' O ' ' B' ' 474' ' ' VAL . 8.0 mm -54.5 -31.64 23.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.702 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -55.08 -39.69 69.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.63 -174.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . 0.504 ' HD3' ' O ' ' B' ' 477' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.465 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.019 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.512 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 7.4 ptp180 . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 121.222 0.534 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.655 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 26.0 t -110.12 145.26 16.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.109 -176.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.0 m -62.56 142.16 58.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.072 0.463 . . . . 0.0 110.819 178.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.452 HD22 HD12 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -59.29 -33.18 70.76 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.548 -176.416 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -58.13 -40.86 82.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.791 177.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.423 ' HB2' HG12 ' A' ' 87' ' ' VAL . 3.5 m-20 -65.78 -42.92 90.21 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.589 ' HA ' HD13 ' A' ' 95' ' ' LEU . 83.7 mt -66.61 -34.64 78.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.845 -175.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -56.23 -32.95 64.94 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -66.18 -24.59 66.66 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.813 0.339 . . . . 0.0 111.702 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.589 HD13 ' HA ' ' A' ' 92' ' ' LEU . 7.5 mp -64.69 -38.03 89.61 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.768 0.318 . . . . 0.0 111.065 -175.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.56 -26.22 71.83 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.67 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -100.71 4.41 43.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.147 0.499 . . . . 0.0 110.856 -178.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.512 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 71.1 m -84.93 107.24 16.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.172 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.39 -29.95 69.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.242 -177.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.2 m -70.64 -39.73 73.49 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 -177.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.465 HD11 ' CD2' ' A' ' 139' ' ' PHE . 40.8 tp -74.73 -48.64 24.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.387 -176.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.512 ' HG2' ' O ' ' A' ' 98' ' ' SER . 4.5 ptp180 -61.39 -27.29 68.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.109 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.5 t -64.16 -23.91 67.49 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.13 0.491 . . . . 0.0 110.148 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.1 mt -87.51 -33.38 18.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.194 178.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.506 HD21 HD13 ' B' ' 477' ' ' ILE . 11.1 mp -69.86 -6.69 34.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.834 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 58.9 mt -67.93 -14.67 63.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.419 176.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -84.37 121.52 75.2 Favored Pre-proline 0 C--O 1.235 0.325 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.934 175.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.06 -29.91 90.3 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.884 2.389 . . . . 0.0 112.796 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 65.1 t60 -70.49 -44.61 67.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.736 0.303 . . . . 0.0 110.8 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.44 ' O ' HD23 ' A' ' 110' ' ' LEU . 4.3 tt -61.57 -42.14 98.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.221 0.534 . . . . 0.0 110.067 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -70.56 -32.73 70.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.281 -178.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . 0.529 ' HA ' HE21 ' A' ' 112' ' ' GLN . 0.0 OUTLIER -66.47 -37.54 85.33 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.63 175.673 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 76.1 mt -55.06 -51.26 66.89 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.47 ' HB3' HD11 ' B' ' 478' ' ' ILE . 49.5 mtm -53.77 -54.62 35.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 71.7 t -57.03 -39.49 66.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.544 -178.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -65.21 -41.37 94.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.464 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.515 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 54.9 tp -71.19 -31.98 68.3 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.258 -178.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.446 ' HB2' ' CD1' ' B' ' 478' ' ' ILE . 14.1 t70 -61.07 -38.9 87.86 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.954 -178.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -60.35 -29.37 68.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.557 0.694 . . . . 0.0 111.165 -177.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 66.13 21.31 69.85 Favored Glycine 0 N--CA 1.451 -0.367 0 CA-C-N 114.647 -1.161 . . . . 0.0 113.448 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -72.36 -34.24 67.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.324 0.583 . . . . 0.0 110.297 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.441 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 22.1 p-10 -145.38 40.07 1.2 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.384 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.599 ' N ' ' HD3' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.04 -33.91 5.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.471 -1.24 . . . . 0.0 112.144 177.735 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.7 -52.1 66.54 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.509 -175.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 122' ' ' ASP . 0.2 OUTLIER -76.24 -34.57 59.19 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.359 179.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.527 HD22 ' CE1' ' A' ' 130' ' ' TYR . 89.2 mt -58.32 -44.34 88.59 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.462 -178.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.58 -35.07 60.42 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.932 0.396 . . . . 0.0 111.103 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -84.21 -41.38 17.03 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.684 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -71.1 -17.07 62.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.027 -176.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.527 ' CE1' HD22 ' A' ' 126' ' ' LEU . 3.8 m-30 -87.58 -28.26 22.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.944 0.402 . . . . 0.0 110.857 179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . 0.545 ' HE2' HG12 ' A' ' 137' ' ' VAL . 4.0 mmt -80.89 5.2 16.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.322 -177.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.517 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 28.4 pt20 -104.03 -7.95 19.92 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 176.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -103.03 126.24 32.99 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.403 -176.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.711 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 30.4 Cg_endo -63.59 -14.28 41.65 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.904 2.403 . . . . 0.0 112.516 -178.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.2 mp -73.46 -44.08 58.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.771 0.32 . . . . 0.0 110.416 176.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.418 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 36.9 t80 -88.8 -29.87 19.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.111 0.481 . . . . 0.0 110.126 -170.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.711 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 18.6 m -59.7 -48.59 86.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.786 177.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.511 ' N ' HG23 ' A' ' 137' ' ' VAL . 36.7 mt-10 -62.24 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.367 176.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . 0.465 ' CD2' HD11 ' A' ' 101' ' ' LEU . 61.8 t80 -54.06 -49.18 69.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.695 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.672 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.72 -47.35 81.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.935 178.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -61.1 -31.25 70.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.506 0.67 . . . . 0.0 110.493 -176.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . 0.426 ' O ' HG13 ' A' ' 146' ' ' ILE . 78.2 m -77.96 -50.14 12.74 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.532 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -65.88 -29.72 70.21 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.551 0.215 . . . . 0.0 111.298 -175.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 57.7 mt -66.57 -23.31 66.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.765 0.316 . . . . 0.0 110.745 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -86.55 -14.67 65.27 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.063 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 142' ' ' CYS . 25.4 mt -91.86 -31.62 4.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.858 0.361 . . . . 0.0 110.906 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.458 ' HB ' HG11 ' A' ' 87' ' ' VAL . 23.0 m -106.8 4.95 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -177.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.402 ' HG3' ' H ' ' A' ' 148' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 121.862 0.839 . . . . 0.0 113.202 -172.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . 0.574 ' O ' ' HB2' ' B' ' 467' ' ' ARG . 42.4 mm . . . . . 0 C--O 1.223 -0.303 0 N-CA-C 111.397 0.147 . . . . 0.0 111.397 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -60.66 -47.63 85.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.074 0.464 . . . . 0.0 110.3 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 15.5 t60 -71.81 -43.51 65.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.187 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.533 ' O ' HG12 ' B' ' 470' ' ' ILE . 49.2 mt-10 -69.78 -22.96 63.29 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.016 -174.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . 0.574 ' HB2' ' O ' ' B' ' 463' ' ' ILE . 30.8 ttp180 -62.94 -42.74 99.91 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.188 0.595 . . . . 0.0 111.301 177.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -80.41 -18.38 49.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.405 0.621 . . . . 0.0 109.884 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . 0.515 ' HB ' ' HA ' ' B' ' 466' ' ' GLU . 2.1 t -67.35 -32.0 55.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.386 171.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.533 HG12 ' O ' ' B' ' 466' ' ' GLU . 32.5 mm -60.14 -31.87 49.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.565 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . 0.539 ' O ' ' HG3' ' B' ' 475' ' ' ARG . 85.9 mt -53.9 -44.13 70.24 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.823 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.655 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.4 mp0 -64.8 -41.51 95.75 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.461 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 38.1 m -61.56 -53.28 58.46 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.226 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.476 ' O ' HG13 ' B' ' 478' ' ' ILE . 78.6 t -51.78 -57.78 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.881 176.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.539 ' HG3' ' O ' ' B' ' 471' ' ' LEU . 43.0 mtp180 -73.9 -20.24 60.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.326 -0.397 . . . . 0.0 112.039 -169.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.42 -46.16 70.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.033 0.444 . . . . 0.0 109.967 174.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.506 HD13 HD21 ' A' ' 105' ' ' LEU . 74.8 mt -65.36 -54.6 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.034 -178.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . 0.476 HG13 ' O ' ' B' ' 474' ' ' VAL . 53.5 mt -53.43 -31.57 19.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.967 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 22.7 tptm -56.56 -48.43 77.37 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.275 -174.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.855 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.77 -175.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 . . . . . 0 C--O 1.233 0.216 0 CA-C-O 121.127 0.489 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 24.2 t -75.26 132.01 34.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.416 -173.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.8 m -70.02 153.81 42.74 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.725 176.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.03 -41.49 87.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.867 0.365 . . . . 0.0 110.083 -175.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -55.06 -39.21 68.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.552 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -71.57 -38.35 70.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.907 0.384 . . . . 0.0 110.259 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.9 mt -65.14 -35.07 79.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.251 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -53.73 -32.27 51.5 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.113 178.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -70.5 -18.38 62.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.741 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.08 -52.1 60.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.63 0.252 . . . . 0.0 111.047 -177.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.45 -16.21 62.58 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.129 -0.557 . . . . 0.0 112.932 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 32.8 mm-40 -83.11 -24.1 32.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.819 0.342 . . . . 0.0 110.687 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.525 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.9 t -74.61 113.33 11.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.323 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -24.55 65.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.469 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.5 m -72.7 -41.07 65.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.7 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.437 ' O ' HD13 ' A' ' 105' ' ' LEU . 61.3 tp -67.43 -54.39 20.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.414 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.607 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 6.8 ptp180 -60.55 -24.94 65.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.229 -179.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.3 t -58.85 -30.07 67.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.208 0.528 . . . . 0.0 110.2 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 mt -86.71 -32.74 20.3 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.005 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.547 HD21 HD13 ' B' ' 477' ' ' ILE . 9.2 mp -61.59 -20.72 63.63 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.476 178.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 80.8 mt -68.14 -12.64 61.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.185 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -84.69 116.55 65.73 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.075 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.434 ' O ' ' HG2' ' A' ' 111' ' ' ARG . 67.5 Cg_exo -52.63 -36.18 70.74 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 123.802 3.002 . . . . 0.0 113.44 -176.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -67.34 -45.35 76.66 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.09 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 50.1 tp -65.85 -38.29 88.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.95 0.405 . . . . 0.0 111.046 -176.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 108' ' ' PRO . 30.1 ptt180 -69.93 -27.64 64.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.094 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -70.8 -37.81 73.29 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.549 174.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 88.1 mt -58.07 -46.28 85.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.326 176.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.44 ' HG2' HG22 ' B' ' 474' ' ' VAL . 59.0 mtm -58.1 -54.8 42.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.437 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.592 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 32.0 m -66.53 -23.31 31.23 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -175.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -76.47 -45.79 29.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.15 0.5 . . . . 0.0 110.792 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.541 HD12 ' CD2' ' A' ' 130' ' ' TYR . 0.7 OUTLIER -64.48 -49.97 69.28 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.414 -175.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -55.65 -21.4 17.84 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.393 -1.276 . . . . 0.0 111.014 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 75.2 mt-30 -65.11 -29.67 70.55 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.499 0.666 . . . . 0.0 109.4 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.16 17.09 63.2 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 114.44 -1.254 . . . . 0.0 113.891 172.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -54.36 -54.94 33.81 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.585 ' OD2' ' HG2' ' A' ' 125' ' ' LYS . 27.3 t70 -143.48 65.92 1.31 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.791 0.805 . . . . 0.0 109.464 172.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.68 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -55.54 -23.36 26.13 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.92 179.381 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -53.12 -52.95 57.04 Favored 'General case' 0 C--O 1.231 0.131 0 O-C-N 123.319 0.387 . . . . 0.0 111.828 -177.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.585 ' HG2' ' OD2' ' A' ' 122' ' ' ASP . 18.5 pttm -85.38 -30.01 23.97 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.176 -0.61 . . . . 0.0 111.041 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.639 HD22 ' CE1' ' A' ' 130' ' ' TYR . 36.8 mt -60.52 -43.46 97.08 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.854 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.462 ' O ' ' HG2' ' A' ' 131' ' ' MET . 0.0 OUTLIER -55.61 -38.64 69.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.745 0.307 . . . . 0.0 111.546 179.782 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -84.08 -40.09 18.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.934 0.397 . . . . 0.0 110.873 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.501 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.81 -17.6 63.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.846 -176.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.639 ' CE1' HD22 ' A' ' 126' ' ' LEU . 5.2 m-30 -84.95 -28.41 25.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.066 0.46 . . . . 0.0 110.34 -179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . 0.496 ' HE3' HG12 ' A' ' 137' ' ' VAL . 54.9 mmm -78.59 4.35 13.72 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.357 -178.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.501 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 7.2 pt20 -94.31 -14.83 25.02 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -99.65 125.25 41.35 Favored Pre-proline 0 N--CA 1.449 -0.48 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.669 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.707 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 29.0 Cg_endo -63.14 -14.21 40.31 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.056 2.504 . . . . 0.0 112.842 -174.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.401 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.3 mp -75.52 -36.15 60.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.927 0.394 . . . . 0.0 110.264 176.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.541 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 35.8 t80 -89.97 -33.88 16.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.152 -173.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.707 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 21.0 m -58.19 -49.29 82.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.027 178.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.527 ' N ' HG23 ' A' ' 137' ' ' VAL . 72.7 mm-40 -62.58 -41.44 98.95 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.542 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -55.31 -49.8 71.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.659 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.792 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.61 -48.8 75.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.707 177.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -59.39 -30.73 68.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.363 0.601 . . . . 0.0 110.621 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.7 m -76.2 -52.68 9.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.398 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.545 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.4 p -64.5 -30.82 71.85 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 121.121 -0.232 . . . . 0.0 111.487 -174.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.792 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 82.6 mt -60.0 -44.96 94.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.779 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -72.19 -15.17 76.68 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.406 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 65.8 mt -91.19 -36.84 8.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 120.748 0.309 . . . . 0.0 111.315 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 27.7 m -94.55 5.93 7.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -173.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 6.7 mm-40 . . . . . 0 C--N 1.326 -0.447 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 174.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 72.6 mt . . . . . 0 C--O 1.226 -0.147 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -58.2 -44.46 88.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.438 0.637 . . . . 0.0 109.827 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . 0.402 ' HA ' ' ND2' ' B' ' 468' ' ' ASN . 62.9 t60 -65.49 -55.27 18.77 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.293 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.34 -38.0 82.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.133 -173.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -72.23 -42.98 65.1 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 111.642 0.238 . . . . 0.0 111.642 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . 0.402 ' ND2' ' HA ' ' B' ' 465' ' ' HIS . 2.1 p30 -76.01 -23.56 55.21 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.8 t -58.34 -32.38 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.702 174.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.541 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 25.9 mm -62.98 -37.55 79.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.814 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 85.1 mt -53.55 -42.26 67.3 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.223 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -65.44 -43.31 90.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.396 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 53.3 m -62.04 -54.09 46.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.593 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.44 HG22 ' HG2' ' A' ' 114' ' ' MET . 69.2 t -47.88 -54.33 3.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.762 176.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.456 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 26.7 ttm180 -67.93 -35.73 78.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.596 -173.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -43.17 95.35 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.051 0.453 . . . . 0.0 110.133 178.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.547 HD13 HD21 ' A' ' 105' ' ' LEU . 97.5 mt -67.42 -55.28 17.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.638 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 56.9 mt -54.46 -23.44 10.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.025 0.441 . . . . 0.0 111.026 176.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 15.3 tppt? -69.99 -48.88 56.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.927 -175.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . 0.432 ' HD2' ' HB3' ' B' ' 479' ' ' LYS . 2.1 mptp? . . . . . 0 C--N 1.328 -0.363 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.474 -177.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 . . . . . 0 N--CA 1.446 -0.65 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.556 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 27.7 t -99.8 133.69 41.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.295 -174.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.2 m -55.76 134.93 51.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.924 175.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -59.88 -32.86 71.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.263 -176.315 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -60.37 -40.95 92.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.696 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -64.46 -43.07 95.41 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.159 0.504 . . . . 0.0 110.149 177.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 76.8 mt -65.45 -33.91 77.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.409 -178.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 63.0 mttm -62.5 -24.7 67.62 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -74.36 -18.02 60.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.669 0.271 . . . . 0.0 110.791 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.437 HD21 HG13 ' A' ' 147' ' ' VAL . 91.0 mt -62.27 -42.31 99.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.957 0.408 . . . . 0.0 110.479 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -70.63 -19.01 76.16 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.723 -0.672 . . . . 0.0 112.379 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -86.5 -24.75 25.45 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.85 0.357 . . . . 0.0 110.435 -178.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.656 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.5 t -68.49 108.33 3.25 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.52 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.4 -24.67 66.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.051 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.5 m -75.43 -48.64 21.89 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.817 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.2 tp -67.36 -49.3 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.802 -174.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.656 ' HG2' ' O ' ' A' ' 98' ' ' SER . 8.2 ptp180 -60.14 -28.51 67.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.279 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.477 ' O ' ' HB2' ' A' ' 106' ' ' LEU . 22.7 t -66.9 -25.68 66.5 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.043 0.449 . . . . 0.0 110.096 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 27.3 mt -76.51 -33.22 58.62 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.404 HD21 HD13 ' B' ' 477' ' ' ILE . 10.1 mp -66.59 -15.97 63.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.825 177.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 103' ' ' SER . 3.9 mm? -69.12 -13.83 62.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.645 175.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -78.63 116.32 58.59 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.804 175.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.62 -26.59 82.6 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.99 2.46 . . . . 0.0 112.514 -175.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.464 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 66.2 t60 -74.56 -46.14 40.86 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.776 178.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.402 ' HA ' HD12 ' A' ' 113' ' ' LEU . 51.8 tp -64.77 -39.11 93.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.899 0.381 . . . . 0.0 110.916 -176.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -67.14 -33.22 74.97 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 -70.17 -36.42 74.68 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.24 178.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 109' ' ' HIS . 95.3 mt -58.39 -54.31 48.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.908 175.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.443 ' HG2' HG22 ' B' ' 474' ' ' VAL . 70.7 mtp -55.83 -50.42 70.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.163 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.599 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 48.7 t -59.21 -40.24 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.284 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 16.7 m-20 -60.37 -47.23 86.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.171 0.51 . . . . 0.0 111.088 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 55.9 tp -64.2 -37.74 88.54 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.21 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.474 ' HB2' HD12 ' B' ' 478' ' ' ILE . 26.8 t70 -63.94 -35.63 81.32 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.119 -179.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.599 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 74.5 mt-30 -62.45 -28.92 70.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.582 0.706 . . . . 0.0 110.426 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 70.57 27.39 72.61 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 114.443 -1.253 . . . . 0.0 113.61 171.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -56.5 -55.18 37.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.95 0.405 . . . . 0.0 110.4 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.57 ' O ' HD13 ' A' ' 126' ' ' LEU . 27.5 t70 -151.57 77.22 1.23 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.542 0.687 . . . . 0.0 109.723 174.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.677 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.6 OUTLIER -53.68 -23.72 12.31 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.802 -1.09 . . . . 0.0 111.629 178.618 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.9 -51.76 67.92 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -175.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -71.06 -50.06 37.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.8 176.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 122' ' ' ASP . 11.1 mp -51.73 -45.65 63.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -175.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.455 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.1 OUTLIER -54.38 -45.63 72.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.835 0.35 . . . . 0.0 111.658 -179.556 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 42.5 mtm180 -83.44 -35.44 24.99 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.078 -176.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.51 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -73.16 -16.86 61.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.563 -177.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.507 ' HB3' ' CG ' ' A' ' 136' ' ' PHE . 13.1 m-30 -89.16 -27.08 20.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.088 0.471 . . . . 0.0 110.743 177.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . 0.501 ' HE2' HG12 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -79.0 6.29 9.69 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.543 -177.563 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 30.0 pt20 -102.38 -22.85 14.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.845 0.355 . . . . 0.0 110.869 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -103.33 138.6 19.59 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 121.048 0.451 . . . . 0.0 111.37 -175.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.756 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 35.2 Cg_endo -63.42 -13.53 36.74 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.829 3.019 . . . . 0.0 114.043 -171.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.452 HD22 ' CD2' ' A' ' 109' ' ' HIS . 11.0 mp -77.15 -39.15 50.15 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.322 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.507 ' CG ' ' HB3' ' A' ' 130' ' ' TYR . 39.8 t80 -91.51 -33.77 15.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.0 0.428 . . . . 0.0 110.29 -174.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.756 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 15.5 m -56.72 -51.17 70.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.339 179.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.524 ' N ' HG23 ' A' ' 137' ' ' VAL . 39.5 mm-40 -66.48 -35.35 80.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.597 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -56.4 -51.11 69.56 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 173.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.75 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.01 -47.4 83.27 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.702 178.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.72 -33.16 71.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.29 0.567 . . . . 0.0 110.633 -176.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.4 m -76.12 -48.63 19.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.391 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.519 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 25.6 p -67.19 -30.7 70.72 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.91 -174.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.75 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 74.6 mt -58.95 -47.14 86.14 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.833 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.33 -27.82 73.57 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.248 -176.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 69.8 mt -76.62 -42.12 34.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.805 0.336 . . . . 0.0 110.726 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.437 HG13 HD21 ' A' ' 95' ' ' LEU . 23.4 m -90.2 3.55 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -174.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.651 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 7.4 mm-40 . . . . . 0 N--CA 1.465 0.287 0 O-C-N 123.185 0.303 . . . . 0.0 110.473 176.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 82.4 mt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.802 0.334 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -54.99 -40.23 69.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.356 174.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -74.97 -47.28 30.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.566 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.588 ' O ' HG12 ' B' ' 470' ' ' ILE . 40.5 mt-10 -57.29 -45.96 83.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.79 -176.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . 0.455 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 21.8 mtm180 -64.04 -29.57 70.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -177.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -32.63 59.24 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.4 t -66.14 -35.7 75.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.388 176.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.588 HG12 ' O ' ' B' ' 466' ' ' GLU . 30.7 mm -63.06 -33.78 62.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.246 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 90.1 mt -57.45 -48.67 78.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.357 177.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.556 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.1 mp0 -58.88 -36.78 75.21 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.094 178.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 57.5 m -63.96 -58.82 5.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.987 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.443 HG22 ' HG2' ' A' ' 114' ' ' MET . 94.2 t -50.45 -44.55 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.808 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 31.2 mmt180 -62.88 -44.04 97.19 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.015 -177.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -67.56 -50.28 59.23 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.67 -179.348 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.404 HD13 HD21 ' A' ' 105' ' ' LEU . 83.9 mt -60.79 -59.27 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.746 -174.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . 0.474 HD12 ' HB2' ' A' ' 118' ' ' ASP . 67.9 mt -58.81 -23.92 24.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.301 -177.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 5.6 tmtt? -64.57 -42.13 95.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.652 -177.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.655 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.424 ' HA ' ' OE1' ' B' ' 472' ' ' GLN . 37.4 mmt180 . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 121.321 0.581 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.45 HG11 ' HB ' ' A' ' 147' ' ' VAL . 85.2 t -106.7 137.29 38.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.712 -174.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.3 m -71.41 145.78 49.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.17 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.523 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.3 OUTLIER -58.8 -31.95 68.9 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.403 -176.469 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -56.61 -39.08 72.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.755 0.312 . . . . 0.0 110.703 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -70.45 -40.66 73.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.152 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.415 HD12 HD22 ' A' ' 89' ' ' LEU . 62.0 mt -68.41 -31.36 70.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.254 -178.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 62.2 mtpt -60.81 -28.37 68.73 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 178.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 -72.32 -16.61 61.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.724 -0.217 . . . . 0.0 111.548 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.491 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 97.0 mt -55.74 -56.48 19.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.535 -176.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -66.01 -21.98 70.17 Favored Glycine 0 CA--C 1.52 0.379 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.691 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -79.62 -20.52 46.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.058 0.456 . . . . 0.0 110.818 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.9 m -78.8 123.18 26.94 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.364 -177.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.61 -27.85 69.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.929 -173.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.1 m -75.12 -39.66 60.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.039 0.447 . . . . 0.0 110.868 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.552 HD12 HD11 ' A' ' 104' ' ' LEU . 29.4 tp -73.0 -49.09 30.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.521 -172.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.701 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 9.0 ptp180 -57.18 -33.52 67.55 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.919 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 73.6 m -63.08 -42.06 99.56 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.552 HD11 HD12 ' A' ' 101' ' ' LEU . 0.6 OUTLIER -87.94 -19.13 27.69 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.923 -0.711 . . . . 0.0 111.653 -179.192 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 101' ' ' LEU . 7.5 mp -64.82 -20.99 66.7 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.278 0.561 . . . . 0.0 110.622 170.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 97.7 mt -71.16 -12.71 61.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.965 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -78.61 118.49 72.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.868 175.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.94 -34.68 92.65 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.421 2.747 . . . . 0.0 112.86 -177.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.554 ' CD2' HD22 ' A' ' 135' ' ' LEU . 60.9 t60 -66.26 -48.76 69.43 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.694 0.283 . . . . 0.0 110.838 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 104' ' ' LEU . 48.7 tp -63.07 -41.79 99.51 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.101 -176.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -66.32 -34.57 78.28 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.193 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -67.67 -28.56 67.8 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 120.597 0.237 . . . . 0.0 111.086 176.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.93 -53.41 18.01 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.562 ' HG3' HG22 ' B' ' 474' ' ' VAL . 33.6 ttp -56.47 -42.91 79.0 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.021 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.411 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 20.5 t -62.94 -45.91 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 120.699 0.285 . . . . 0.0 111.22 177.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -62.99 -40.95 99.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.02 0.438 . . . . 0.0 111.243 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.416 HD23 HG21 ' B' ' 474' ' ' VAL . 46.1 tp -62.63 -37.21 85.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.6 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.401 ' HB2' HD12 ' B' ' 478' ' ' ILE . 6.9 t70 -62.99 -34.63 77.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.412 -178.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 60.7 mt-30 -58.91 -27.0 64.84 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.826 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . 0.573 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 65.78 16.93 64.38 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.33 -0.85 . . . . 0.0 113.856 170.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -72.68 -42.96 63.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.311 0.576 . . . . 0.0 109.584 -175.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.42 ' OD1' ' HG2' ' A' ' 125' ' ' LYS . 4.2 t70 -150.04 51.43 0.91 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 173.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.573 ' HG3' ' HA2' ' A' ' 120' ' ' GLY . 0.0 OUTLIER -56.55 -20.71 22.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.66 -1.155 . . . . 0.0 110.582 175.242 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.477 ' N ' ' HD2' ' A' ' 123' ' ' LYS . . . -57.01 -53.81 53.86 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.271 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.42 ' HG2' ' OD1' ' A' ' 122' ' ' ASP . 65.0 pttt -79.61 -28.42 41.0 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.554 178.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.469 HD22 ' CE1' ' A' ' 130' ' ' TYR . 95.8 mt -63.51 -40.37 96.88 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.589 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.473 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.4 OUTLIER -52.92 -34.28 54.44 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.915 0.388 . . . . 0.0 110.857 177.185 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -79.73 -48.79 13.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.786 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.595 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.35 -20.12 64.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.206 -175.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.528 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.3 m-30 -85.04 -36.44 21.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.106 0.479 . . . . 0.0 110.848 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.67 5.94 14.19 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.144 -176.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.595 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.1 pt20 -100.3 -24.09 14.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.905 0.383 . . . . 0.0 110.14 178.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.57 136.15 19.4 Favored Pre-proline 0 N--CA 1.452 -0.356 0 CA-C-O 121.149 0.499 . . . . 0.0 110.881 178.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.759 ' HA ' HG22 ' A' ' 137' ' ' VAL . 34.1 Cg_endo -64.04 -14.33 42.82 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 123.532 2.821 . . . . 0.0 114.0 -170.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.554 HD22 ' CD2' ' A' ' 109' ' ' HIS . 4.3 mp -69.54 -39.31 77.54 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.942 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.528 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 60.8 t80 -92.2 -30.82 15.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.086 0.47 . . . . 0.0 110.093 -173.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.759 HG22 ' HA ' ' A' ' 134' ' ' PRO . 35.9 m -59.0 -50.9 78.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.262 -178.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.547 ' N ' HG23 ' A' ' 137' ' ' VAL . 11.7 pt-20 -72.24 -28.56 63.22 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.876 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -59.53 -49.0 79.47 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 172.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.813 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.57 -45.58 92.25 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.562 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.69 -32.66 73.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.518 -177.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 69.0 m -70.76 -51.38 27.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.995 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.0 p -65.26 -27.42 68.64 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.966 -175.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.813 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.3 mt -60.36 -54.47 45.24 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 120.745 0.307 . . . . 0.0 110.23 177.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.76 -14.29 57.91 Favored Glycine 0 CA--C 1.516 0.127 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.833 -176.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.419 HD12 ' HA ' ' A' ' 143' ' ' CYS . 64.5 mt -90.67 -30.48 4.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 120.808 0.337 . . . . 0.0 111.142 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.45 ' HB ' HG11 ' A' ' 87' ' ' VAL . 15.2 m -103.38 -18.35 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.546 -176.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 . . . . . 0 C--N 1.325 -0.484 0 CA-C-O 120.82 0.343 . . . . 0.0 110.307 177.411 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 42.7 mt . . . . . 0 C--O 1.231 0.115 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -65.13 -36.98 85.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.311 0.577 . . . . 0.0 109.823 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -68.24 -55.72 11.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.019 173.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.539 ' O ' ' HB ' ' B' ' 469' ' ' VAL . 40.1 mt-10 -56.5 -51.44 68.49 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.503 -0.772 . . . . 0.0 112.493 -172.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . 0.473 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 96.7 mtt180 -67.59 -25.73 65.92 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -174.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -29.99 37.78 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 177.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' B' ' 466' ' ' GLU . 8.5 t -60.93 -38.53 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.921 174.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.524 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 10.6 mm -63.21 -38.5 82.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.304 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . 0.497 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 80.3 mt -58.65 -46.06 87.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.119 177.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.508 HE21 ' HA ' ' B' ' 469' ' ' VAL . 10.3 mt-30 -62.88 -33.2 74.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.581 177.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 63.0 m -69.66 -54.97 11.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.234 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.562 HG22 ' HG3' ' A' ' 114' ' ' MET . 54.6 t -47.08 -50.02 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.19 175.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' B' ' 471' ' ' LEU . 35.8 mmt180 -63.61 -34.45 77.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.895 0.378 . . . . 0.0 111.171 -175.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -75.35 -49.34 19.39 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.569 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.444 HD13 HD21 ' A' ' 105' ' ' LEU . 95.5 mt -60.58 -58.37 7.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.572 -176.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . 0.401 HD12 ' HB2' ' A' ' 118' ' ' ASP . 50.2 mt -56.53 -23.6 17.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.585 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -64.41 -48.65 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -178.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.708 0 CA-C-O 120.895 0.379 . . . . 0.0 111.256 -175.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.561 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 36.4 ptt180 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 91.4 t -100.28 139.08 22.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.895 0.378 . . . . 0.0 110.651 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.1 m -65.42 138.96 58.47 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.341 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.75 -33.17 72.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.219 -176.608 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -63.17 -40.42 97.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.746 177.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.64 -41.82 98.21 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 93.3 mt -67.38 -32.21 72.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.839 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 94.3 mttt -61.35 -20.68 63.26 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -77.25 -17.9 58.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.589 0.233 . . . . 0.0 111.131 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 88.2 mt -62.63 -49.57 74.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.273 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -70.61 -14.86 72.81 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.418 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -91.02 -22.59 20.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.882 0.372 . . . . 0.0 110.961 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.657 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 33.0 t -68.49 116.64 9.27 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.386 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.69 -29.63 70.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.045 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.402 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 57.5 m -77.44 -37.46 51.53 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.813 -177.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.503 HD11 ' CD2' ' A' ' 139' ' ' PHE . 48.5 tp -75.28 -47.09 29.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.312 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -60.03 -31.43 69.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.906 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 21.3 t -66.26 -22.92 66.33 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.202 0.525 . . . . 0.0 110.228 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 100' ' ' THR . 28.0 mt -80.52 -32.55 36.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.687 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.7 mp -69.6 -10.52 58.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.96 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.52 -11.52 53.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.843 174.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -86.0 114.61 58.02 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 173.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.41 ' O ' ' HG2' ' A' ' 111' ' ' ARG . 50.4 Cg_exo -54.72 -30.04 64.85 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.947 2.431 . . . . 0.0 112.608 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -68.26 -45.08 74.15 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.901 178.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 55.3 tp -66.33 -38.61 88.06 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.75 0.31 . . . . 0.0 111.188 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 108' ' ' PRO . 5.5 ptp180 -67.35 -30.99 70.95 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.656 -0.418 . . . . 0.0 109.959 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -73.9 -32.52 63.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.819 177.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.42 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 72.3 mt -59.02 -50.73 72.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.36 176.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 60.0 mtm -56.77 -49.83 74.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.559 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.662 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 60.1 t -59.59 -46.53 93.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.153 -178.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -60.29 -48.26 82.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.024 0.44 . . . . 0.0 111.476 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 61.9 tp -62.98 -36.63 84.15 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.663 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.437 ' OD1' ' HD2' ' B' ' 475' ' ' ARG . 19.3 t70 -66.11 -33.53 76.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.865 -177.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 60.5 mt-30 -60.27 -28.72 68.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.289 0.566 . . . . 0.0 110.628 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.39 29.37 71.78 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.089 -0.959 . . . . 0.0 114.211 169.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -76.28 -55.1 5.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 117.231 0.515 . . . . 0.0 110.026 176.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -131.25 41.12 3.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.357 0.599 . . . . 0.0 110.146 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.658 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.78 -31.62 5.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.607 -1.179 . . . . 0.0 112.109 177.756 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -54.19 -58.16 8.4 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -177.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -80.02 -26.42 39.82 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.01 -178.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.471 HD22 ' CE2' ' A' ' 130' ' ' TYR . 94.9 mt -62.53 -41.54 98.94 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.5 177.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.436 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -51.75 -39.15 58.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 0.0 111.12 178.208 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 54.2 mtp180 -81.6 -43.23 18.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.769 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.64 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.86 -26.95 68.84 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.52 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.471 ' CE2' HD22 ' A' ' 126' ' ' LEU . 3.4 m-30 -80.54 -19.45 45.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.791 0.329 . . . . 0.0 111.078 -178.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 2.5 mmt -77.57 -4.92 48.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.348 -177.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.64 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.5 pt20 -100.99 -8.54 22.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.978 0.418 . . . . 0.0 110.472 178.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.54 ' O ' HG23 ' A' ' 137' ' ' VAL . 0.6 OUTLIER -94.35 118.48 67.04 Favored Pre-proline 0 N--CA 1.45 -0.472 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.74 -175.025 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.613 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 16.0 Cg_endo -56.39 -24.53 52.57 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.92 2.413 . . . . 0.0 112.168 -175.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.474 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.0 mp -71.04 -43.01 68.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.211 0.529 . . . . 0.0 109.993 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.487 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 29.7 t80 -81.97 -31.33 31.24 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.105 -176.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 133' ' ' GLU . 86.9 t -61.98 -43.53 97.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.481 177.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 48.0 mt-10 -65.97 -42.71 89.56 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.08 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . 0.503 ' CD2' HD11 ' A' ' 101' ' ' LEU . 75.5 t80 -57.21 -48.91 77.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.158 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.787 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.79 -48.17 77.99 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.562 -177.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -66.75 -26.8 67.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.192 0.52 . . . . 0.0 110.416 -174.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 94.0 m -79.72 -48.44 13.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.106 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.9 p -64.31 -29.03 70.13 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.55 0.214 . . . . 0.0 111.02 -175.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.787 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 73.8 mt -59.61 -52.83 63.84 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.508 178.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.45 -15.23 63.45 Favored Glycine 0 C--N 1.329 0.188 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.533 -176.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 64.4 mt -88.4 -26.08 5.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 120.766 0.317 . . . . 0.0 111.082 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 13.6 m -103.67 -14.1 8.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.501 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 44.8 mt-10 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.435 176.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 54.9 mt . . . . . 0 CA--C 1.528 0.126 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -58.72 -42.41 88.66 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 110.218 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -70.25 -50.36 40.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.809 177.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.571 ' O ' HG12 ' B' ' 470' ' ' ILE . 37.5 mt-10 -61.25 -48.28 82.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.286 -172.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . 0.436 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 37.2 mtm180 -58.32 -36.43 73.38 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.73 -27.31 55.36 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -179.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . 0.499 ' HA ' ' CG ' ' B' ' 472' ' ' GLN . 2.4 t -72.56 -29.54 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 114.717 -1.129 . . . . 0.0 110.513 177.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.571 HG12 ' O ' ' B' ' 466' ' ' GLU . 17.2 mm -68.62 -34.5 65.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 174.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 91.0 mt -60.48 -41.89 95.17 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.362 176.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.561 ' NE2' ' HA ' ' A' ' 86' ' ' ARG . 4.6 mm-40 -52.2 -48.38 65.1 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.61 0.719 . . . . 0.0 110.061 175.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . 0.429 ' O ' HG13 ' B' ' 477' ' ' ILE . 38.1 m -61.51 -54.06 48.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.684 -179.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 89.8 t -50.89 -49.87 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.684 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 24.1 mmm180 -67.1 -28.21 67.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.521 -176.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -76.33 -50.32 14.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.672 0.273 . . . . 0.0 110.672 178.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.429 HG13 ' O ' ' B' ' 473' ' ' CYS . 70.4 mt -63.11 -62.73 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.125 -173.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 46.3 mt -54.83 -24.7 14.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 21.8 tptm -70.98 -39.43 72.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -175.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.733 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.82 -178.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 . . . . . 0 CA--C 1.521 -0.143 0 CA-C-O 121.084 0.469 . . . . 0.0 110.766 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.471 HG21 ' HB ' ' A' ' 147' ' ' VAL . 14.9 p -72.77 148.02 9.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.327 -0.852 . . . . 0.0 111.181 -174.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.4 m -68.41 144.84 54.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.281 -177.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -26.51 68.35 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.793 -175.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 24.2 pt20 -60.82 -35.3 76.18 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.135 0.493 . . . . 0.0 110.313 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -70.7 -37.57 73.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.144 177.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' B' ' 472' ' ' GLN . 61.0 mt -68.07 -37.58 81.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.149 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -61.7 -20.16 63.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.889 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -75.89 -17.75 59.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.965 0.412 . . . . 0.0 110.553 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.49 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 87.8 mt -65.94 -45.0 83.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.982 -178.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -68.9 -13.83 67.01 Favored Glycine 0 CA--C 1.52 0.344 0 CA-C-N 116.073 -0.512 . . . . 0.0 113.496 -176.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -107.31 5.9 27.96 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.122 0.487 . . . . 0.0 110.934 179.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 67.9 m -93.4 112.53 24.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.844 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.91 -26.24 68.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.543 -178.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 27.4 m -70.45 -42.24 71.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.532 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.49 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 24.0 tp -73.63 -44.83 55.96 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.889 -173.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.505 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 7.8 ptp180 -60.77 -28.32 68.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.233 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.5 t -61.66 -27.29 68.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.371 0.605 . . . . 0.0 109.861 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.448 ' O ' HD13 ' A' ' 110' ' ' LEU . 21.0 mt -83.98 -32.54 24.94 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.132 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.5 mp -75.76 2.67 11.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.14 0.495 . . . . 0.0 110.648 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 73.9 mt -79.39 -9.2 59.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.088 174.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -90.4 117.45 68.02 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.824 176.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.53 -39.55 87.72 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.159 2.573 . . . . 0.0 113.033 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -68.8 -41.96 77.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.81 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.451 ' O ' HD23 ' A' ' 110' ' ' LEU . 4.4 tt -60.15 -40.05 88.53 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -179.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.524 ' O ' HG23 ' A' ' 115' ' ' VAL . 59.7 mtm-85 -66.03 -40.53 91.1 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.419 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -63.88 -36.57 84.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.997 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.444 HD13 ' HB2' ' A' ' 136' ' ' PHE . 90.6 mt -58.62 -47.18 85.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.474 ' HB3' HD11 ' B' ' 478' ' ' ILE . 74.4 mtp -58.66 -47.45 84.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.978 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 111' ' ' ARG . 98.6 t -58.15 -42.49 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 CA-C-O 120.963 0.411 . . . . 0.0 111.188 178.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.413 ' HB2' ' OH ' ' A' ' 130' ' ' TYR . 92.3 m-20 -66.81 -44.55 80.91 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.134 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.566 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 50.7 tp -72.66 -31.09 64.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.415 -177.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.427 ' HB2' HG13 ' B' ' 478' ' ' ILE . 32.8 t70 -54.91 -44.05 73.84 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.027 0.441 . . . . 0.0 110.662 176.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 53.3 mt-30 -67.18 -30.7 70.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.008 -176.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.01 21.92 68.27 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.046 -0.979 . . . . 0.0 113.324 173.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -54.1 -50.09 67.63 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.834 0.35 . . . . 0.0 110.873 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.421 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 23.5 t0 -135.16 66.62 1.52 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.667 0.746 . . . . 0.0 109.367 172.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.648 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -52.74 -30.11 30.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.684 -1.143 . . . . 0.0 111.363 175.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.68 -40.3 96.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.807 0.337 . . . . 0.0 111.18 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -78.87 -47.92 15.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.739 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 82.3 mt -56.77 -47.1 80.87 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.635 -175.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.5 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.5 OUTLIER -56.03 -35.47 66.9 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -177.754 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -83.87 -44.16 14.58 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.114 0.483 . . . . 0.0 110.538 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.543 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.03 -21.17 65.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.025 -176.067 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.566 ' CE2' ' HB2' ' A' ' 117' ' ' LEU . 3.6 m-30 -81.66 -29.15 33.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.875 0.369 . . . . 0.0 111.006 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . 0.591 ' HE2' HG12 ' A' ' 137' ' ' VAL . 2.7 mmt -77.57 -4.33 45.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.349 -176.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.543 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.9 pt20 -100.89 0.2 38.02 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 176.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -105.89 118.42 55.24 Favored Pre-proline 0 N--CA 1.449 -0.516 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.366 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.706 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 19.2 Cg_endo -60.99 -13.24 26.34 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.985 2.456 . . . . 0.0 112.108 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.77 -48.2 48.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.769 173.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.549 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 37.0 t80 -88.62 -29.86 19.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.829 0.347 . . . . 0.0 110.731 -169.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.706 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.9 m -56.52 -45.75 82.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.985 176.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.468 ' N ' HG23 ' A' ' 137' ' ' VAL . 34.5 mm-40 -58.32 -49.31 77.62 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.352 176.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . 0.421 ' HB2' HD11 ' A' ' 110' ' ' LEU . 76.4 t80 -54.14 -49.43 69.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.961 177.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.754 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.61 -52.73 59.6 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.28 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -62.45 -29.5 70.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.293 0.568 . . . . 0.0 110.44 -174.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 97.6 m -81.11 -46.76 14.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.605 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.418 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 29.5 p -65.28 -31.86 73.23 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.4 -177.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.754 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 65.7 mt -59.11 -41.03 87.19 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.693 178.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . 0.411 ' HA2' ' OE2' ' A' ' 148' ' ' GLU . . . -69.41 -28.23 72.71 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.123 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 62.3 mt -80.16 -36.22 16.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-O 121.053 0.454 . . . . 0.0 110.485 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.471 ' HB ' HG21 ' A' ' 87' ' ' VAL . 19.0 m -93.61 7.44 5.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.02 -176.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.635 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 37.1 mt-10 . . . . . 0 C--O 1.233 0.229 0 CA-C-O 120.534 0.207 . . . . 0.0 110.461 174.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 60.5 mt . . . . . 0 CA--C 1.53 0.199 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 70.1 mtm180 -61.33 -46.82 88.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.605 0.717 . . . . 0.0 109.274 177.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -64.72 -48.12 75.8 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.382 177.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.595 ' O ' HG12 ' B' ' 470' ' ' ILE . 40.4 mt-10 -59.36 -47.8 84.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.595 -177.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . 0.5 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 19.8 mtm180 -63.22 -40.76 98.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.73 -25.49 53.57 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -178.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.13 -37.46 79.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.154 171.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.595 HG12 ' O ' ' B' ' 466' ' ' GLU . 36.2 mm -60.01 -36.87 69.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.125 177.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . 0.533 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 93.1 mt -53.24 -49.93 65.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.387 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.482 ' HB3' HD11 ' A' ' 92' ' ' LEU . 1.9 mp0 -63.69 -40.61 97.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.922 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 61.6 m -59.04 -50.89 72.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.025 0.44 . . . . 0.0 110.035 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.643 ' O ' HG12 ' B' ' 478' ' ' ILE . 85.3 t -56.05 -58.45 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.541 175.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.533 ' HG2' ' O ' ' B' ' 471' ' ' LEU . 7.2 ptp180 -71.87 -20.2 61.84 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -169.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.53 -43.84 92.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 171.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 88.5 mt -70.14 -53.71 22.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.139 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . 0.643 HG12 ' O ' ' B' ' 474' ' ' VAL . 10.1 mm -53.3 -31.88 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.664 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 11.7 tppt? -53.23 -38.06 62.62 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.134 -174.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.367 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.485 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 39.8 ptt180 . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 120.872 0.368 . . . . 0.0 110.718 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.421 ' CG2' HG22 ' B' ' 469' ' ' VAL . 88.7 t -109.28 138.02 38.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.5 m -63.57 140.14 58.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.268 0.556 . . . . 0.0 110.887 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.524 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 10.2 tp -58.54 -40.04 81.89 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.05 -177.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -56.71 -37.44 70.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.722 178.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -67.53 -41.73 83.88 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.23 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.473 ' HA ' HD13 ' A' ' 95' ' ' LEU . 83.7 mt -69.69 -32.41 71.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.647 -176.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 9.2 mtpm? -62.82 -26.17 68.62 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -69.47 -21.5 63.7 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.734 0.302 . . . . 0.0 111.14 -177.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 92' ' ' LEU . 8.6 mp -64.54 -41.07 96.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.32 -174.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.69 -20.84 68.61 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.439 177.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -89.61 -22.9 22.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.72 0.295 . . . . 0.0 110.911 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.688 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 37.4 t -67.4 111.1 3.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.545 -177.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.31 -26.81 68.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.679 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.3 m -71.87 -48.04 48.63 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.049 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.3 tp -70.7 -46.72 62.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.793 -173.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.688 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -58.56 -29.83 66.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.876 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 33.7 t -67.16 -24.33 65.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.07 0.462 . . . . 0.0 110.049 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.5 mt -84.02 -36.11 23.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.678 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.479 HD21 HD13 ' B' ' 477' ' ' ILE . 11.2 mp -63.86 -22.53 66.96 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.433 177.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 76.7 mt -63.59 -16.86 62.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.971 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -79.47 120.26 79.73 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -62.41 -22.73 74.46 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 123.19 2.593 . . . . 0.0 113.013 -174.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.519 ' NE2' HD11 ' A' ' 113' ' ' LEU . 70.9 t60 -76.32 -48.9 18.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.009 178.099 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 135' ' ' LEU . 47.5 tp -61.91 -37.18 83.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.911 0.386 . . . . 0.0 111.148 -175.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -67.83 -22.16 65.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.56 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 10.8 mm100 -74.98 -43.15 55.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.739 176.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.541 HD21 ' OE1' ' A' ' 133' ' ' GLU . 10.5 mp -52.19 -43.88 64.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.621 0.248 . . . . 0.0 111.352 176.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.468 ' HG2' HG22 ' B' ' 474' ' ' VAL . 55.8 mtm -59.91 -53.7 54.76 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.302 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.571 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 26.4 m -68.72 -23.98 28.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 111.518 -177.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -75.84 -51.71 11.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.169 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.482 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 60.7 tp -61.05 -34.5 74.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.454 -177.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.429 ' OD2' ' HG2' ' B' ' 475' ' ' ARG . 24.5 t70 -62.66 -35.55 79.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.415 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.571 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 69.0 mt-30 -63.27 -29.6 70.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.498 0.666 . . . . 0.0 111.169 -177.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.92 25.42 71.96 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 114.54 -1.209 . . . . 0.0 114.034 174.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -67.01 -46.47 74.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.295 0.548 . . . . 0.0 110.053 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.533 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 17.8 m-20 -141.63 46.4 1.69 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.697 176.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.68 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -48.32 -32.11 6.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.999 178.371 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.23 -49.89 75.82 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.468 0.175 . . . . 0.0 111.382 -177.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.473 ' HG2' ' HB3' ' A' ' 122' ' ' ASP . 58.6 pttt -75.76 -30.63 59.23 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.143 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 91.9 mt -63.58 -43.67 96.29 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.427 -179.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.6 mmt -50.61 -36.83 36.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.929 0.395 . . . . 0.0 111.169 177.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 30.0 mmm180 -81.74 -47.23 13.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.043 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.582 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.86 -24.34 66.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.972 -176.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.482 ' CE1' ' HB2' ' A' ' 117' ' ' LEU . 3.4 m-30 -78.86 -29.7 44.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.807 0.337 . . . . 0.0 111.098 -178.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 4.7 mmt -73.51 -10.33 59.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.358 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.3 pt20 -98.99 -15.3 19.13 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.104 -179.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.541 ' OE1' HD21 ' A' ' 113' ' ' LEU . 3.7 mt-10 -87.54 119.01 70.55 Favored Pre-proline 0 N--CA 1.451 -0.406 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.611 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 14.1 Cg_endo -56.25 -23.26 44.71 Favored 'Trans proline' 0 CA--C 1.52 -0.185 0 C-N-CA 123.066 2.511 . . . . 0.0 112.453 -173.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.435 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.5 mp -72.56 -42.09 65.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.324 -178.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.49 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 31.0 t80 -76.64 -29.97 56.67 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 133' ' ' GLU . 57.5 t -61.24 -44.7 98.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.048 176.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.611 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 42.0 mt-10 -67.63 -41.34 84.06 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.323 178.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -57.11 -50.93 71.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.11 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.714 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.71 -45.1 87.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.032 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -63.48 -29.77 71.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.381 0.61 . . . . 0.0 110.588 -174.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . 0.445 ' O ' HG13 ' A' ' 146' ' ' ILE . 89.1 m -82.79 -47.86 11.45 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.359 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 29.1 p -62.92 -32.33 73.6 Favored 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 121.177 -0.209 . . . . 0.0 111.383 -174.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 79.3 mt -65.68 -26.87 67.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.809 0.338 . . . . 0.0 111.092 -178.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -85.87 -14.84 66.53 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.013 177.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 142' ' ' CYS . 32.5 mt -91.63 -42.96 13.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.867 0.365 . . . . 0.0 110.892 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.428 ' CG1' HD11 ' A' ' 95' ' ' LEU . 20.4 m -90.61 7.76 4.1 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.884 -174.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 . . . . . 0 C--N 1.326 -0.417 0 CA-C-O 121.128 0.49 . . . . 0.0 110.53 179.712 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 47.9 mt . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . 0.475 ' HD3' ' N ' ' B' ' 465' ' ' HIS . 0.0 OUTLIER -75.19 -28.94 60.2 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.57 -176.21 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . 0.485 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 13.4 t60 -76.24 -45.33 33.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.132 173.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -63.17 -30.48 71.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . 0.444 ' O ' HD23 ' B' ' 471' ' ' LEU . 32.8 mtp180 -63.31 -55.07 27.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.613 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . 0.485 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -70.93 -18.57 62.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.829 0.823 . . . . 0.0 109.997 -174.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . 0.421 HG22 ' CG2' ' A' ' 87' ' ' VAL . 1.3 t -73.08 -20.2 18.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.52 178.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.49 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 35.8 mm -72.84 -37.35 54.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 122.188 0.994 . . . . 0.0 108.4 -178.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . 0.612 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.5 OUTLIER -51.28 -48.86 62.11 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 113.166 -1.834 . . . . 0.0 110.546 177.152 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.485 ' NE2' ' HA ' ' A' ' 86' ' ' ARG . 3.6 mm-40 -46.74 -54.23 10.16 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.798 -1.092 . . . . 0.0 110.498 174.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 33.0 m -60.79 -54.11 49.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.668 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.468 HG22 ' HG2' ' A' ' 114' ' ' MET . 75.7 t -48.61 -54.79 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.905 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.6 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 52.2 mtt180 -74.31 -19.8 60.35 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.883 -0.598 . . . . 0.0 112.402 -171.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -74.54 -45.7 43.91 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 172.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.479 HD13 HD21 ' A' ' 105' ' ' LEU . 92.2 mt -64.46 -55.11 23.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.772 -177.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . 0.42 HG13 ' O ' ' B' ' 474' ' ' VAL . 52.4 mt -54.06 -26.18 14.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.059 0.457 . . . . 0.0 111.084 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.6 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 1.6 tppp? -73.04 -42.11 63.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.926 -172.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.694 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.876 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 121.222 0.534 . . . . 0.0 110.486 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 39.7 t -81.84 131.67 33.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.614 -172.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.3 m -63.98 144.82 56.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.468 176.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.533 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.85 -34.22 74.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.705 -173.892 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -61.24 -40.93 95.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.711 -0.222 . . . . 0.0 110.742 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -63.34 -39.42 94.49 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.576 ' HA ' HD13 ' A' ' 95' ' ' LEU . 88.2 mt -69.06 -32.42 71.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.64 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 97.4 mttt -58.04 -27.32 63.48 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -178.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.444 ' HB2' HG22 ' A' ' 146' ' ' ILE . 24.0 m-80 -72.64 -18.63 61.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.797 0.332 . . . . 0.0 111.277 -178.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.576 HD13 ' HA ' ' A' ' 92' ' ' LEU . 7.4 mp -71.02 -40.58 71.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.113 -175.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -63.05 -21.07 63.33 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.693 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -108.71 6.51 25.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.064 0.459 . . . . 0.0 110.739 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.625 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.9 t -76.96 108.54 10.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.24 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.14 67.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.131 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.1 m -71.7 -43.87 65.18 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.185 0.517 . . . . 0.0 110.78 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.542 HD12 HD11 ' A' ' 104' ' ' LEU . 21.4 tp -71.09 -49.56 43.15 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.446 -171.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.625 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.0 ptp180 -57.72 -32.07 67.05 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.327 -179.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 67.5 m -62.95 -40.23 97.02 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.542 HD11 HD12 ' A' ' 101' ' ' LEU . 0.5 OUTLIER -88.56 -15.75 34.35 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.508 -0.877 . . . . 0.0 112.161 -178.965 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.47 HD13 ' O ' ' A' ' 101' ' ' LEU . 8.7 mp -68.74 -12.06 61.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.194 0.521 . . . . 0.0 110.591 171.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 80.1 mt -73.14 -13.42 61.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.021 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -74.03 123.7 89.47 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.865 176.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.5 -30.34 90.52 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.111 2.54 . . . . 0.0 112.763 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -78.77 -41.29 30.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.657 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 104' ' ' LEU . 5.0 tt -63.18 -42.48 99.39 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -68.06 -27.19 66.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.151 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -70.84 -43.07 69.3 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.187 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.494 HD13 ' HB2' ' A' ' 136' ' ' PHE . 85.8 mt -56.11 -51.77 66.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.315 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 59.7 mtp -54.28 -54.15 44.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.829 -179.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.648 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.8 m -65.89 -34.45 70.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.343 -176.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -62.86 -46.36 88.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.086 0.47 . . . . 0.0 110.61 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.45 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 62.7 tp -64.47 -36.39 84.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.621 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.41 -36.74 84.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.802 177.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.648 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 75.7 mt-30 -68.2 -32.15 72.17 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.868 0.842 . . . . 0.0 110.508 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 66.11 27.08 72.63 Favored Glycine 0 N--CA 1.447 -0.567 0 CA-C-N 114.145 -1.389 . . . . 0.0 113.18 175.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.67 -32.38 59.18 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.176 0.512 . . . . 0.0 110.806 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.499 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 15.4 t0 -160.52 69.23 0.37 Allowed 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 168.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.512 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -55.31 -26.77 42.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.007 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.75 -49.39 73.22 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.057 0.456 . . . . 0.0 110.596 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.0 -38.03 66.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.557 178.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 95.4 mt -61.65 -46.67 88.79 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.162 -177.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -54.88 -33.86 62.4 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.006 0.431 . . . . 0.0 111.187 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -79.34 -49.08 12.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.449 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.679 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.45 -27.03 67.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.057 -176.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.592 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.2 m-30 -79.26 -27.54 42.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.877 0.37 . . . . 0.0 111.436 -176.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . 0.513 ' HE2' HG12 ' A' ' 137' ' ' VAL . 3.3 mmt -86.13 3.42 42.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.821 0.344 . . . . 0.0 111.574 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.679 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.8 pt20 -100.56 -19.61 16.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.039 0.447 . . . . 0.0 109.965 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -105.36 137.45 19.27 Favored Pre-proline 0 N--CA 1.448 -0.548 0 CA-C-O 121.393 0.616 . . . . 0.0 111.688 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.674 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 56.4 Cg_endo -68.45 -11.87 33.19 Favored 'Trans proline' 0 CA--C 1.527 0.144 0 C-N-CA 123.904 3.069 . . . . 0.0 113.974 -173.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 45.5 mt -77.8 -37.62 48.33 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.427 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.592 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 45.5 t80 -88.98 -32.1 17.8 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.573 -173.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.674 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 10.5 m -54.87 -44.89 74.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.831 176.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 25.7 mm-40 -57.62 -50.29 73.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.433 176.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -54.94 -48.93 72.51 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.211 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.762 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.28 -49.55 71.37 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.052 -0.977 . . . . 0.0 111.019 -177.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.71 -31.11 72.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.218 0.532 . . . . 0.0 110.55 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . 0.547 ' O ' HG13 ' A' ' 146' ' ' ILE . 65.4 m -70.61 -47.72 58.72 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.018 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 28.3 p -67.5 -30.98 70.8 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.526 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.762 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.8 mt -65.71 -27.95 68.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.708 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -83.24 -14.67 73.78 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.226 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 142' ' ' CYS . 21.1 mt -91.8 -40.83 12.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.199 0.523 . . . . 0.0 110.505 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 15.3 m -94.75 7.5 6.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.398 -177.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 . . . . . 0 C--O 1.234 0.252 0 CA-C-O 121.369 0.604 . . . . 0.0 112.112 -173.586 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 29.4 mm . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.802 0.334 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -57.76 -35.46 70.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.915 0.388 . . . . 0.0 110.769 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -69.95 -48.9 56.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.962 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.456 ' O ' HG12 ' B' ' 470' ' ' ILE . 6.5 mm-40 -55.91 -50.42 70.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.93 -178.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -59.92 -40.86 90.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.396 -176.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -79.0 -23.46 44.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.382 0.61 . . . . 0.0 109.666 -178.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -65.32 -32.15 56.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.422 173.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.456 HG12 ' O ' ' B' ' 466' ' ' GLU . 26.3 mm -61.94 -29.87 47.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.391 179.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 83.7 mt -63.53 -31.86 73.15 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.881 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -71.7 -35.22 70.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.059 0.457 . . . . 0.0 110.092 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 45.4 m -72.7 -59.08 2.89 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.077 -177.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.41 ' O ' HG13 ' B' ' 478' ' ' ILE . 11.5 p -54.95 -45.34 76.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.085 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 18.8 tpp85 -65.68 -35.17 80.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.634 0.254 . . . . 0.0 110.96 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.06 -47.88 78.42 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 120.687 0.28 . . . . 0.0 110.65 -179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 50.6 mt -67.55 -55.4 17.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.846 -174.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . 0.41 HG13 ' O ' ' B' ' 474' ' ' VAL . 46.3 mt -58.52 -25.55 28.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.156 -175.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.531 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 22.8 tptp -65.09 -34.6 78.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.219 -173.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . 0.46 ' HD2' ' H ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.547 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.884 176.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 . . . . . 0 N--CA 1.451 -0.375 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 24.5 t -80.55 134.72 26.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.099 -173.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.1 m -67.58 144.34 55.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.981 176.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.523 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 1.6 tt -62.32 -33.38 74.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.994 -173.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -56.01 -43.66 77.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.665 174.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -68.66 -28.09 66.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.412 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 90.7 mt -78.68 -35.26 45.43 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.622 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 50.1 mtpt -57.72 -29.49 64.77 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -73.22 -18.66 61.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.606 0.241 . . . . 0.0 111.082 -176.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.512 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 82.1 mt -62.67 -47.16 84.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.032 -175.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.93 -15.36 81.03 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.259 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 93' ' ' LYS . 17.4 mm-40 -95.5 -16.0 22.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.15 0.5 . . . . 0.0 110.397 -177.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.61 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 33.0 t -77.49 121.31 23.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.967 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.45 -27.62 67.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.629 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.6 m -69.24 -45.93 68.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.225 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.512 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 38.8 tp -71.11 -46.97 60.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.57 -173.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 98' ' ' SER . 8.9 ptp180 -60.29 -27.27 67.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.534 -178.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.6 m -62.99 -22.88 67.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.974 0.416 . . . . 0.0 110.662 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 110' ' ' LEU . 17.5 mt -86.57 -34.38 19.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.32 0.581 . . . . 0.0 109.717 178.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.485 HD21 HD13 ' B' ' 477' ' ' ILE . 9.3 mp -64.1 -18.37 64.34 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.612 178.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 63.7 mt -66.06 -21.02 66.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.293 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -78.39 118.1 70.24 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.265 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.4 -36.66 97.54 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.069 2.512 . . . . 0.0 112.589 178.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.3 t60 -68.29 -44.06 76.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.86 0.362 . . . . 0.0 110.558 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 104' ' ' LEU . 4.4 tt -65.59 -46.01 81.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.277 -176.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.419 ' O ' HG23 ' A' ' 115' ' ' VAL . 13.5 ptp180 -64.47 -34.18 77.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.491 -179.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -66.65 -34.97 79.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.947 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.3 mt -59.47 -48.59 81.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.129 0.49 . . . . 0.0 109.717 174.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 68.6 mtp -55.75 -52.09 65.14 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.973 176.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.494 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 84.0 t -60.25 -38.83 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.542 -179.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -64.56 -43.01 95.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.07 0.462 . . . . 0.0 111.071 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 56.4 tp -67.55 -38.41 84.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.57 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.435 ' HB2' HD12 ' B' ' 478' ' ' ILE . 23.8 t0 -63.97 -27.83 69.4 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.084 0.469 . . . . 0.0 111.375 -175.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 70.9 mt-30 -63.19 -29.77 71.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.516 0.674 . . . . 0.0 110.785 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.5 29.3 72.93 Favored Glycine 0 CA--C 1.518 0.226 0 CA-C-N 114.551 -1.204 . . . . 0.0 114.239 172.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -73.1 -55.45 6.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.568 0.699 . . . . 0.0 109.526 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -135.16 50.85 2.12 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.502 176.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.598 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -48.68 -37.57 18.89 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 113.505 -1.679 . . . . 0.0 111.961 179.003 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.16 -46.53 77.1 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.908 0.385 . . . . 0.0 110.866 -176.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -65.57 -41.91 92.39 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.183 177.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.475 HD22 ' CE2' ' A' ' 130' ' ' TYR . 95.5 mt -62.63 -43.67 98.22 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.572 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -34.67 65.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.933 0.397 . . . . 0.0 111.142 -178.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.9 mmm180 -77.01 -46.09 25.04 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.007 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.93 -38.65 86.56 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.421 -178.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.475 ' CE2' HD22 ' A' ' 126' ' ' LEU . 3.2 m-30 -72.31 -21.78 61.28 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.865 -174.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . 0.448 ' HE2' HG12 ' A' ' 137' ' ' VAL . 3.6 mmt -79.43 -1.23 36.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.14 -179.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -98.79 -20.03 17.11 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 175.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -88.17 120.89 70.72 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.733 -175.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.678 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 27.9 Cg_endo -62.2 -14.11 36.13 Favored 'Trans proline' 0 N--CA 1.465 -0.157 0 C-N-CA 122.863 2.375 . . . . 0.0 112.671 -175.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.3 mp -77.32 -40.26 44.88 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.592 176.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.425 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 32.8 t80 -88.74 -31.01 18.63 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.066 -172.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.678 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 16.6 m -58.47 -49.11 83.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.246 177.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.53 ' N ' HG23 ' A' ' 137' ' ' VAL . 11.0 pt-20 -70.96 -36.64 72.64 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.558 179.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -56.29 -48.07 77.36 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 174.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.779 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.46 -49.78 74.07 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.726 178.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -62.09 -30.76 71.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.209 0.528 . . . . 0.0 110.627 -175.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 64.6 m -77.3 -45.29 26.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.537 -179.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.437 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.3 p -69.33 -28.11 65.96 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.861 0.362 . . . . 0.0 110.53 -177.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 83.3 mt -62.13 -31.3 71.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.69 178.163 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . 0.534 ' HA2' ' OE2' ' A' ' 148' ' ' GLU . . . -79.87 -17.69 74.36 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.452 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 49.0 mt -91.16 -26.24 5.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.109 0.48 . . . . 0.0 110.569 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.408 HG13 HD21 ' A' ' 95' ' ' LEU . 17.3 m -104.05 -3.43 9.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.599 -177.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.534 ' OE2' ' HA2' ' A' ' 145' ' ' GLY . 12.7 pt-20 . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.255 0.55 . . . . 0.0 110.393 -178.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 47.3 mm . . . . . 0 CA--C 1.528 0.118 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -58.56 -43.36 89.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.886 0.375 . . . . 0.0 110.772 178.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -64.12 -48.83 74.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.067 175.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.58 ' O ' HG12 ' B' ' 470' ' ' ILE . 43.4 mt-10 -60.14 -43.83 95.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.45 -176.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -58.78 -39.97 82.62 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -30.89 60.23 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.5 t -62.46 -35.51 70.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.584 176.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.58 HG12 ' O ' ' B' ' 466' ' ' GLU . 31.6 mm -63.41 -34.85 69.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.493 178.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 82.8 mt -57.44 -42.5 82.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.691 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -62.78 -43.11 99.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.441 177.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 56.1 m -63.65 -55.5 23.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.752 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.455 ' O ' HG13 ' B' ' 478' ' ' ILE . 75.0 t -51.16 -55.7 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.868 178.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -68.85 -32.13 71.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.582 -172.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.14 -47.03 88.13 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 120.962 0.41 . . . . 0.0 109.941 177.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.485 HD13 HD21 ' A' ' 105' ' ' LEU . 79.6 mt -63.54 -53.34 46.4 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.099 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . 0.455 HG13 ' O ' ' B' ' 474' ' ' VAL . 49.9 mt -58.63 -26.76 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.868 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -57.7 -41.31 81.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.736 -179.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.24 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.872 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 . . . . . 0 N--CA 1.45 -0.454 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.545 HG21 ' HB ' ' A' ' 147' ' ' VAL . 12.0 p -84.16 154.11 3.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.168 -173.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.7 m -59.36 141.33 54.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.467 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 92' ' ' LEU . 3.2 tt -68.03 -30.97 70.32 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.865 -178.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -54.25 -43.97 71.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.48 173.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.438 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 2.8 m-20 -63.31 -35.63 81.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.137 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 89' ' ' LEU . 44.6 mt -71.01 -34.47 71.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.194 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.449 ' NZ ' ' HB3' ' A' ' 93' ' ' LYS . 9.8 mtpm? -59.64 -24.13 63.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.317 -0.401 . . . . 0.0 112.053 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -77.42 -17.44 58.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.177 -179.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.556 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 91.8 mt -62.7 -46.02 90.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.438 -176.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.66 -18.32 69.99 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.622 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -84.67 -16.19 42.73 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.938 0.399 . . . . 0.0 110.608 -179.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.646 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.7 t -78.27 122.07 25.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.084 -176.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.51 -25.2 63.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.428 177.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 97.2 m -72.78 -45.2 59.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.919 178.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.556 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 36.2 tp -69.45 -51.26 37.83 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.766 -172.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.646 ' HG2' ' O ' ' A' ' 98' ' ' SER . 6.2 ptp180 -58.45 -29.5 66.2 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.974 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 33.3 t -62.05 -42.67 99.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -178.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.682 HD21 ' SG ' ' A' ' 142' ' ' CYS . 0.5 OUTLIER -87.96 -16.2 34.46 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.261 -178.608 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.495 HD13 ' O ' ' A' ' 101' ' ' LEU . 9.4 mp -69.36 -12.22 61.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.179 0.514 . . . . 0.0 110.541 171.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 83.1 mt -73.09 -17.63 61.39 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.792 178.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -71.0 118.75 68.44 Favored Pre-proline 0 C--O 1.234 0.256 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.34 -32.37 71.71 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 123.063 2.509 . . . . 0.0 112.755 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -71.56 -49.86 36.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.534 0.206 . . . . 0.0 110.849 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.57 HD21 ' HB2' ' A' ' 139' ' ' PHE . 33.2 tp -63.51 -43.17 97.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 120.774 0.321 . . . . 0.0 111.077 -176.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -66.15 -30.59 71.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.182 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . 0.557 ' HA ' HE21 ' A' ' 112' ' ' GLN . 0.0 OUTLIER -72.33 -39.3 68.29 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.654 175.86 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 72.4 mt -56.72 -50.24 72.78 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.405 ' HG2' HG23 ' B' ' 474' ' ' VAL . 57.5 mtp -53.94 -55.51 26.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.904 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.625 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 34.5 m -67.21 -23.89 31.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -176.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 57.3 m-20 -72.22 -38.81 68.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.189 0.519 . . . . 0.0 110.69 177.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.27 -43.61 81.4 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.521 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -61.61 -16.55 49.31 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.604 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.625 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 77.6 mt-30 -74.43 -29.73 61.61 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.4 14.93 60.62 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 114.578 -1.192 . . . . 0.0 113.908 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -55.14 -55.03 35.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.475 0.655 . . . . 0.0 110.186 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -135.09 55.8 1.87 Allowed 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.909 175.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.635 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -49.96 -30.52 10.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.933 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.86 -53.06 61.08 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.724 0.297 . . . . 0.0 111.09 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -75.72 -28.75 58.67 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.494 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.487 HD22 ' CE2' ' A' ' 130' ' ' TYR . 94.6 mt -64.25 -48.71 74.74 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.41 178.016 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.95 -40.21 60.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.951 0.405 . . . . 0.0 111.403 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -79.26 -44.84 20.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.972 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.588 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.99 -26.88 65.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.693 -176.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.487 ' CE2' HD22 ' A' ' 126' ' ' LEU . 4.3 m-30 -76.85 -29.44 55.86 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.93 0.395 . . . . 0.0 110.992 -178.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . 0.424 ' HA ' ' CE ' ' A' ' 131' ' ' MET . 1.4 mmt -76.33 -2.79 33.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.89 -175.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.588 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.3 pt20 -103.96 -8.11 19.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.085 0.469 . . . . 0.0 110.416 176.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.472 ' O ' HG23 ' A' ' 137' ' ' VAL . 7.3 mt-10 -95.08 118.85 66.48 Favored Pre-proline 0 N--CA 1.449 -0.522 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 -178.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.472 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 19.7 Cg_endo -58.47 -21.39 53.8 Favored 'Trans proline' 0 CA--C 1.519 -0.244 0 C-N-CA 122.826 2.351 . . . . 0.0 111.976 -177.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.37 -39.02 81.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.28 177.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -87.86 -29.15 21.13 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.225 -178.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 133' ' ' GLU . 86.4 t -62.82 -44.06 99.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.696 177.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 14.0 pt-20 -67.76 -32.88 73.79 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.404 179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . 0.57 ' HB2' HD21 ' A' ' 110' ' ' LEU . 30.6 t80 -61.91 -52.73 62.91 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.062 0.458 . . . . 0.0 109.948 174.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.702 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -59.6 -42.75 93.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.175 -178.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -62.72 -33.04 74.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.418 0.628 . . . . 0.0 110.427 -175.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . 0.682 ' SG ' HD21 ' A' ' 104' ' ' LEU . 89.4 m -75.74 -47.93 23.94 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.167 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.544 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 22.4 p -67.58 -32.81 73.82 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.933 -176.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.3 mt -69.56 -27.16 64.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.063 -179.099 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -79.29 -20.64 69.09 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.465 -0.874 . . . . 0.0 111.807 177.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 65.5 mt -91.04 -35.89 7.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.84 0.352 . . . . 0.0 111.342 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.545 ' HB ' HG21 ' A' ' 87' ' ' VAL . 30.9 m -83.2 5.24 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.309 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 C--N 1.323 -0.545 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 170.559 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 43.0 mm . . . . . 0 C--O 1.234 0.282 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -70.83 -25.28 62.77 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.198 -176.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . 0.514 ' HD2' ' OE1' ' B' ' 466' ' ' GLU . 49.8 t60 -74.17 -50.92 17.18 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.366 174.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.574 ' O ' HG12 ' B' ' 470' ' ' ILE . 54.7 mm-40 -54.86 -44.63 74.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.07 -175.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -59.0 -35.51 73.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.994 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -31.1 54.94 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -178.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.1 -36.67 78.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.722 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.574 HG12 ' O ' ' B' ' 466' ' ' GLU . 28.3 mm -60.99 -36.91 75.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.346 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 90.3 mt -57.13 -44.24 83.13 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.809 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.48 ' HB3' HD11 ' A' ' 92' ' ' LEU . 2.1 mp0 -62.71 -38.9 92.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.663 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . 0.425 ' O ' HG13 ' B' ' 477' ' ' ILE . 60.5 m -66.72 -59.9 3.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.175 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.405 HG23 ' HG2' ' A' ' 114' ' ' MET . 10.3 p -54.36 -43.78 63.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.04 -179.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.529 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 73.6 mtp180 -67.65 -30.29 69.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.523 0.202 . . . . 0.0 111.373 -177.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . 0.413 ' CZ ' ' HE2' ' B' ' 480' ' ' LYS . 0.5 OUTLIER -68.77 -46.83 67.74 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.09 0.471 . . . . 0.0 109.929 176.42 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.456 HD13 HD21 ' A' ' 105' ' ' LEU . 56.5 mt -64.55 -51.82 62.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.257 -175.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 61.8 mt -56.59 -24.85 19.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.758 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.529 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 13.4 ttmm -71.23 -32.85 69.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.87 -173.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . 0.413 ' HE2' ' CZ ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.597 0 C-N-CA 119.795 -0.762 . . . . 0.0 112.308 176.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.0 ptp180 . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.4 p -110.46 160.89 9.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.771 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.0 m -72.41 164.58 26.12 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.783 0.325 . . . . 0.0 111.593 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.442 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -69.82 -38.76 76.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.503 -176.652 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -53.1 -42.05 65.56 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.116 0.484 . . . . 0.0 110.877 177.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.46 ' O ' HG12 ' A' ' 147' ' ' VAL . 3.1 m-20 -67.02 -23.08 65.87 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.999 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.51 ' HA ' HD13 ' A' ' 95' ' ' LEU . 81.2 mt -87.17 -34.37 19.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.098 0.475 . . . . 0.0 110.753 177.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 2.6 mmmp? -56.72 -36.51 69.8 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.432 HD21 ' HA ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -73.76 -15.81 61.19 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -174.273 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.51 HD13 ' HA ' ' A' ' 92' ' ' LEU . 8.3 mp -63.46 -42.9 98.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.81 0.338 . . . . 0.0 110.834 -178.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -71.08 -13.26 72.72 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.711 176.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -94.27 -11.3 30.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.238 0.542 . . . . 0.0 109.779 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.644 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.4 t -81.61 113.08 19.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.578 -176.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.83 -25.65 67.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.62 178.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 63.3 m -71.29 -46.06 61.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.054 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.419 HD11 ' CD2' ' A' ' 139' ' ' PHE . 61.1 tp -72.3 -45.98 57.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.563 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -58.59 -31.05 67.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.116 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.432 ' HA ' HD23 ' A' ' 106' ' ' LEU . 37.6 t -62.54 -22.5 66.36 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.228 0.537 . . . . 0.0 110.423 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.452 HD11 ' SG ' ' A' ' 142' ' ' CYS . 21.7 mt -84.44 -31.71 24.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.876 178.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.24 -2.1 17.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.203 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.2 mm? -67.28 -18.43 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.836 0.351 . . . . 0.0 110.235 172.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -84.84 115.41 60.78 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.902 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.36 -37.89 92.98 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.776 2.317 . . . . 0.0 111.879 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.483 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 66.7 t60 -60.28 -46.95 88.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.724 177.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.448 ' O ' HD23 ' A' ' 110' ' ' LEU . 4.4 tt -59.67 -40.72 88.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.176 0.512 . . . . 0.0 109.64 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 111' ' ' ARG . 23.2 mtm180 -66.38 -40.32 89.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.447 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.63 -37.18 85.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.675 176.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 109' ' ' HIS . 86.1 mt -58.02 -52.22 66.41 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 175.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.41 ' HG2' HG22 ' B' ' 474' ' ' VAL . 65.5 mtp -53.41 -51.72 61.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.871 176.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.598 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 56.8 t -58.38 -46.65 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.351 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -60.48 -42.8 97.02 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.032 0.444 . . . . 0.0 111.488 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.507 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 54.3 tp -68.01 -36.02 79.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.887 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.12 -24.27 63.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.064 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.598 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 77.4 mt-30 -61.98 -30.65 71.08 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.725 0.774 . . . . 0.0 110.612 177.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.49 25.82 74.67 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 114.336 -1.302 . . . . 0.0 113.368 174.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -76.73 -55.39 5.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.208 0.527 . . . . 0.0 109.826 -178.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.513 ' OD2' ' HE2' ' A' ' 125' ' ' LYS . 4.5 p-10 -135.01 43.12 2.73 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.887 177.052 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.646 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.59 -35.68 9.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.974 177.054 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.41 -42.16 98.75 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.014 0.435 . . . . 0.0 110.97 -177.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.513 ' HE2' ' OD2' ' A' ' 122' ' ' ASP . 35.7 ttpt -72.79 -44.99 60.86 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.2 0.524 . . . . 0.0 110.059 175.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.444 HD22 ' HE2' ' A' ' 130' ' ' TYR . 95.1 mt -56.72 -38.72 72.73 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.326 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.7 mmt -51.2 -40.0 57.74 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 110.959 177.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 24.0 mmm180 -79.32 -40.41 30.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.826 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.574 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.76 -27.28 67.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.692 -177.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.507 ' CE1' ' HB2' ' A' ' 117' ' ' LEU . 3.3 m-30 -81.87 -29.32 32.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.977 0.418 . . . . 0.0 111.21 -176.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . 0.494 ' HE2' HG12 ' A' ' 137' ' ' VAL . 15.0 mmt -77.32 4.98 9.45 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.539 -177.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.574 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 20.7 pt20 -107.07 -9.54 16.16 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -99.27 120.08 58.95 Favored Pre-proline 0 N--CA 1.452 -0.362 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.769 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.69 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 27.7 Cg_endo -62.38 -13.76 34.75 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.797 2.332 . . . . 0.0 112.224 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.0 mp -72.84 -46.39 53.25 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.611 176.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.498 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 32.3 t80 -87.04 -31.4 20.55 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.493 -169.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.69 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.7 m -56.93 -48.29 81.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.879 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 37.4 mt-10 -65.56 -42.57 91.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.638 178.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . 0.419 ' CD2' HD11 ' A' ' 101' ' ' LEU . 60.0 t80 -53.89 -50.05 67.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.376 0.607 . . . . 0.0 109.609 176.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.757 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.35 -46.32 87.14 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.098 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.31 -28.93 69.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.31 0.576 . . . . 0.0 110.948 -174.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . 0.452 ' SG ' HD11 ' A' ' 104' ' ' LEU . 91.5 m -80.84 -41.83 22.56 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.685 -177.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 27.9 p -69.79 -27.34 64.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.616 0.246 . . . . 0.0 111.151 -177.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.757 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 81.6 mt -59.64 -44.9 93.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.059 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -65.11 -17.66 63.81 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.615 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 20.6 mt -91.7 -31.56 4.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.765 0.316 . . . . 0.0 111.054 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.46 HG12 ' O ' ' A' ' 91' ' ' ASN . 13.6 m -98.48 -17.41 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 . . . . . 0 C--N 1.326 -0.43 0 CA-C-O 120.917 0.389 . . . . 0.0 110.286 178.135 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . 0.579 ' HA ' ' HG2' ' B' ' 466' ' ' GLU . 27.3 mt . . . . . 0 CA--C 1.53 0.174 0 CA-C-O 120.883 0.373 . . . . 0.0 111.596 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 84.2 mtm180 -66.89 -35.3 79.7 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . 0.493 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 19.0 t60 -73.38 -47.67 40.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.672 -177.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.581 ' O ' HG12 ' B' ' 470' ' ' ILE . 12.3 pt-20 -63.21 -36.91 85.22 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.779 -176.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -61.77 -40.82 96.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.418 . . . . 0.0 112.039 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . 0.493 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.6 p-10 -81.8 -23.52 36.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -177.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.17 -36.82 77.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.679 173.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.581 HG12 ' O ' ' B' ' 466' ' ' GLU . 26.5 mm -60.58 -34.35 58.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.28 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 73.0 mt -59.61 -43.55 93.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.167 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -62.62 -41.31 98.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.876 177.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 55.1 m -63.42 -57.3 10.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.437 -178.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.41 HG22 ' HG2' ' A' ' 114' ' ' MET . 98.3 t -51.22 -45.33 31.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.602 175.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.601 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 0.8 OUTLIER -60.74 -42.2 96.87 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.317 -178.17 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -67.07 -45.98 75.7 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.673 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.18 -57.22 10.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.93 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 44.9 mt -60.32 -21.13 21.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.782 0.325 . . . . 0.0 111.253 -177.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.601 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 19.3 tptm -67.91 -42.31 81.33 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.77 -177.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.518 0 N-CA-C 112.43 0.529 . . . . 0.0 112.43 -178.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? . . . . . 0 CA--C 1.519 -0.229 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.497 HG21 ' HB ' ' A' ' 147' ' ' VAL . 11.2 p -81.35 148.79 5.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.772 -175.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 25.2 m -55.54 139.9 42.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.227 -176.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.505 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -61.43 -35.95 78.98 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.04 -179.235 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -60.62 -39.95 90.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.65 177.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -60.71 -38.82 86.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.811 177.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.477 HD12 HD22 ' A' ' 89' ' ' LEU . 61.2 mt -69.96 -36.62 75.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.054 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 9.2 mtpm? -59.93 -17.79 40.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.21 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -83.29 -17.36 42.79 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.597 0.237 . . . . 0.0 111.378 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 84.8 mt -61.28 -44.22 97.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.83 0.348 . . . . 0.0 111.245 -176.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -71.1 -14.46 73.72 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.384 -179.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -87.94 -18.18 29.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.877 0.37 . . . . 0.0 110.503 -178.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.643 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 28.0 t -80.68 115.81 20.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.763 -177.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.72 -21.47 65.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.48 176.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 29.5 m -74.3 -43.71 55.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.927 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 63.2 tp -73.38 -48.38 34.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.424 -175.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.643 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.8 ptp180 -58.77 -29.6 66.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.072 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 28.9 t -63.11 -31.32 72.43 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-O 121.127 0.489 . . . . 0.0 109.956 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.1 mt -75.45 -38.14 59.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.898 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.444 HD21 HD13 ' B' ' 477' ' ' ILE . 11.1 mp -66.8 -17.98 65.15 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.819 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 62.1 mt -65.81 -19.01 65.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.741 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -75.61 120.84 83.52 Favored Pre-proline 0 C--O 1.236 0.352 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 173.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.73 -25.55 79.47 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.674 2.249 . . . . 0.0 112.29 -178.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -71.24 -48.8 48.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.093 178.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 58.2 tp -65.77 -37.27 85.88 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 120.86 0.362 . . . . 0.0 111.103 -175.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -69.15 -27.94 65.99 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.161 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . 0.474 ' HA ' HG22 ' A' ' 115' ' ' VAL . 8.6 mm100 -70.44 -38.85 74.6 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.391 174.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 94.5 mt -59.35 -47.21 86.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.194 0.521 . . . . 0.0 110.054 174.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 69.9 mtp -57.66 -51.95 67.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.668 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.614 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 32.9 m -65.79 -31.51 54.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.516 -177.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -64.69 -45.89 84.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.941 0.401 . . . . 0.0 110.635 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.9 tp -66.69 -40.3 88.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.21 -178.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -63.28 -41.38 98.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.76 -178.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.614 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 48.5 mt-30 -68.76 -29.09 67.4 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.521 0.677 . . . . 0.0 110.592 -177.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 83.15 29.84 32.79 Favored Glycine 0 C--N 1.318 -0.472 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.96 174.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -52.2 -54.62 28.74 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.218 0.533 . . . . 0.0 110.207 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.643 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 9.9 t0 -155.79 65.97 0.6 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 172.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.417 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -56.13 -27.23 53.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.211 -177.388 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.56 -47.3 86.8 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.105 0.479 . . . . 0.0 110.478 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -75.25 -42.14 55.83 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.662 177.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 87.7 mt -58.45 -44.24 89.15 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.485 -175.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.439 ' SD ' HD21 ' B' ' 471' ' ' LEU . 0.8 OUTLIER -52.25 -37.83 56.44 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.995 0.426 . . . . 0.0 111.421 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -84.06 -42.38 16.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.81 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.573 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.07 -21.64 64.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.983 -176.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.478 ' HB3' ' CD1' ' A' ' 136' ' ' PHE . 4.4 m-30 -82.77 -26.37 31.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.893 0.377 . . . . 0.0 111.203 -178.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . 0.505 ' HE2' HG12 ' A' ' 137' ' ' VAL . 2.7 mmt -81.58 3.2 25.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.04 0.448 . . . . 0.0 111.501 -175.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 24.7 pt20 -102.84 -7.15 21.81 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.851 174.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.401 ' O ' HG22 ' A' ' 137' ' ' VAL . 6.4 mt-10 -99.49 122.66 50.88 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.324 -176.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.716 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 28.7 Cg_endo -62.01 -14.54 37.93 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.061 2.507 . . . . 0.0 112.867 -177.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 51.6 mt -82.75 -33.94 27.28 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.316 176.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.478 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 34.7 t80 -89.62 -31.14 17.68 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.107 -176.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.716 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 14.0 m -60.88 -48.44 88.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.08 177.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.479 ' N ' HG23 ' A' ' 137' ' ' VAL . 40.9 mm-40 -66.3 -36.5 83.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.849 176.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -56.46 -49.1 75.62 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 173.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.698 ' HA ' ' SG ' ' A' ' 143' ' ' CYS . . . -64.0 -43.0 96.98 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.507 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.46 -36.55 73.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.375 0.607 . . . . 0.0 110.292 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 65.1 m -77.05 -49.82 14.49 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.08 -0.963 . . . . 0.0 111.403 -179.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.698 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.5 p -64.21 -36.84 85.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.775 -176.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 46.2 mt -67.95 -34.58 76.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.409 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -73.92 -17.12 79.28 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.163 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 82.4 mt -90.97 -49.02 13.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.689 0.28 . . . . 0.0 110.775 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.497 ' HB ' HG21 ' A' ' 87' ' ' VAL . 16.3 m -86.62 1.8 5.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 -172.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 . . . . . 0 C--N 1.325 -0.461 0 CA-C-O 120.94 0.4 . . . . 0.0 111.266 179.01 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 65.9 mt . . . . . 0 C--O 1.225 -0.201 0 CA-C-O 120.754 0.311 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -56.37 -44.15 79.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.689 178.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . 0.569 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 58.7 t60 -67.71 -45.29 75.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.778 176.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -60.14 -38.45 83.11 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.566 -179.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 21.6 ttp180 -67.95 -42.92 80.22 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.713 -176.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . 0.569 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.6 p-10 -76.66 -16.51 59.52 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.675 0.75 . . . . 0.0 110.047 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . 0.502 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 1.4 t -74.67 -21.76 17.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.286 177.195 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . . . . . . . . . 36.8 mm -68.94 -32.82 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-O 122.338 1.066 . . . . 0.0 109.062 -175.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . 0.623 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.6 OUTLIER -50.96 -54.83 20.9 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 113.017 -1.901 . . . . 0.0 110.768 179.145 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.502 ' NE2' ' HA ' ' B' ' 469' ' ' VAL . 2.4 mp0 -50.83 -44.81 59.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.938 176.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 50.6 m -62.81 -56.36 18.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.511 -179.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 92.4 t -52.01 -53.88 16.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.016 178.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 50.2 mtp180 -72.65 -27.33 62.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.623 -171.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -67.17 -46.63 73.38 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.053 0.454 . . . . 0.0 109.867 176.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.444 HD13 HD21 ' A' ' 105' ' ' LEU . 79.3 mt -63.03 -54.92 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.729 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 41.9 mt -56.33 -28.16 25.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.047 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 25.3 tptp -56.94 -39.46 74.55 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.976 -177.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.524 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.029 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 71.5 mtm180 . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.6 p -99.83 155.79 4.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.455 -174.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.0 m -69.29 151.82 45.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.244 0.545 . . . . 0.0 111.204 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.42 HD22 HD12 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -63.79 -33.38 75.53 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.905 -174.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -56.35 -39.66 73.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.864 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -68.6 -37.87 80.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.54 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.42 HD12 HD22 ' A' ' 89' ' ' LEU . 84.7 mt -68.9 -36.95 78.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.983 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 98.4 mttt -58.76 -27.08 64.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.742 178.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -72.53 -18.02 61.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.162 -178.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.437 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 94.0 mt -61.98 -54.41 42.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.161 -177.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -63.02 -21.22 63.43 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 121.145 -0.55 . . . . 0.0 113.07 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -76.35 -20.72 56.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.02 0.438 . . . . 0.0 110.744 -178.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 15.0 m -89.0 117.13 27.8 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.706 -175.021 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.16 -27.68 68.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.584 -176.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 60.3 m -70.03 -42.67 72.65 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.092 -178.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.437 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 43.6 tp -69.84 -49.77 49.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.539 -176.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.62 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 8.1 ptp180 -60.35 -27.23 67.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.649 -177.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.5 t -61.36 -28.98 69.61 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.368 0.604 . . . . 0.0 109.858 176.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.6 mt -80.18 -32.02 38.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.965 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.594 HD21 HD13 ' B' ' 477' ' ' ILE . 9.5 mp -66.56 -22.56 66.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.551 0.691 . . . . 0.0 110.173 177.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 63.4 mt -72.97 -9.15 58.41 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.997 -179.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -79.84 121.23 82.03 Favored Pre-proline 0 C--O 1.233 0.236 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 175.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -63.16 -19.9 69.76 Favored 'Trans proline' 0 CA--C 1.528 0.218 0 C-N-CA 122.777 2.318 . . . . 0.0 112.679 -179.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 112' ' ' GLN . 71.1 t60 -81.87 -49.89 9.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.717 0.294 . . . . 0.0 110.746 175.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.517 HD11 ' HB2' ' A' ' 139' ' ' PHE . 2.6 tt -62.93 -41.84 99.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.488 -174.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -61.77 -29.94 70.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.515 177.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 6.6 mm-40 -64.15 -49.19 73.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.262 175.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.559 HD21 ' OE2' ' A' ' 133' ' ' GLU . 8.9 mp -52.04 -44.97 64.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.948 0.404 . . . . 0.0 110.646 174.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 73.9 mtp -57.45 -59.28 5.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.199 178.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.66 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 26.4 m -66.49 -27.62 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.652 -175.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -71.2 -53.53 14.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.976 0.417 . . . . 0.0 110.986 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 59.7 tp -62.11 -39.56 92.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.011 -176.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -66.71 -27.94 68.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.66 -0.246 . . . . 0.0 111.653 -173.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 72.6 mt-30 -64.06 -29.66 70.78 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.682 0.754 . . . . 0.0 110.374 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . 0.409 ' HA2' ' HB3' ' A' ' 123' ' ' LYS . . . 68.71 29.04 72.72 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.603 173.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.31 -49.5 27.19 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 5.4 m-20 -136.72 42.61 2.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.944 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.654 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.99 -33.05 7.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.576 -1.193 . . . . 0.0 112.377 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -56.26 -55.6 31.35 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.682 0.277 . . . . 0.0 111.667 -176.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -75.04 -29.98 60.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.782 0.325 . . . . 0.0 110.375 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.462 HD22 ' CE1' ' A' ' 130' ' ' TYR . 97.6 mt -65.73 -40.9 92.64 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.875 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.408 ' SD ' HD21 ' B' ' 471' ' ' LEU . 0.0 OUTLIER -55.41 -34.54 64.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.067 0.46 . . . . 0.0 110.64 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -78.87 -49.7 12.45 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.005 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.526 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.09 -16.54 64.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.345 -175.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.462 ' CE1' HD22 ' A' ' 126' ' ' LEU . 3.4 m-30 -88.75 -28.75 20.3 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.765 0.317 . . . . 0.0 111.059 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 3.2 mmt -71.14 -4.95 28.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.407 -178.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 28.3 pt20 -98.76 -18.44 17.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.258 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.559 ' OE2' HD21 ' A' ' 113' ' ' LEU . 4.2 mt-10 -88.86 123.06 68.49 Favored Pre-proline 0 CA--C 1.515 -0.387 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -176.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.42 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 12.6 Cg_endo -55.88 -25.1 50.91 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.169 2.58 . . . . 0.0 112.604 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.31 -45.22 66.69 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.201 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.411 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 28.2 t80 -73.74 -31.68 63.48 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -178.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 133' ' ' GLU . 82.9 t -62.54 -42.77 97.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.336 176.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 8.3 mm-40 -66.67 -45.91 77.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.341 175.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . 0.517 ' HB2' HD11 ' A' ' 110' ' ' LEU . 69.8 t80 -57.54 -48.64 78.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.646 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.786 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.76 -49.52 74.7 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.111 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -60.21 -33.84 72.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.413 0.625 . . . . 0.0 110.294 -176.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . 0.445 ' O ' HG13 ' A' ' 146' ' ' ILE . 99.6 m -69.56 -50.3 46.04 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.723 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.0 p -69.49 -29.06 66.62 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.638 -176.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.6 mt -60.89 -40.32 92.59 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.061 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -74.05 -29.78 62.17 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.414 -0.898 . . . . 0.0 111.985 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 142' ' ' CYS . 62.6 mt -77.5 -37.05 24.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.67 -0.265 . . . . 0.0 111.234 -177.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 143' ' ' CYS . 23.0 m -87.33 2.92 5.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.399 -178.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 19.0 mm-40 . . . . . 0 C--N 1.324 -0.52 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 168.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . 0.439 ' HA ' ' HB2' ' B' ' 466' ' ' GLU . 65.7 mt . . . . . 0 N--CA 1.455 -0.179 0 N-CA-C 111.465 0.172 . . . . 0.0 111.465 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -55.25 -49.81 71.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.312 0.577 . . . . 0.0 109.444 174.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . 0.472 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 29.0 t60 -70.24 -45.45 66.46 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.165 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.439 ' HB2' ' HA ' ' B' ' 463' ' ' ILE . 39.5 mt-10 -64.19 -22.83 67.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.242 -174.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 38.9 ttt180 -80.15 -41.38 25.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 178.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . 0.472 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -84.47 -17.48 38.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.534 0.683 . . . . 0.0 110.597 -174.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 3.4 p -78.3 -19.39 13.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.343 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.411 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 39.4 mm -69.11 -31.07 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 122.427 1.108 . . . . 0.0 108.737 -175.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . 0.62 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.6 OUTLIER -54.81 -52.63 62.1 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 112.929 -1.941 . . . . 0.0 110.284 179.358 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -53.09 -44.5 67.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.932 174.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 50.7 m -61.28 -55.52 30.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.433 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 94.1 t -51.67 -51.58 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.908 176.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -64.6 -40.75 96.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.616 -173.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.47 -43.57 96.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 0.0 110.447 178.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.594 HD13 HD21 ' A' ' 105' ' ' LEU . 78.2 mt -65.57 -55.42 19.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.274 -178.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 47.0 mt -56.97 -25.14 21.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.067 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -58.89 -47.06 86.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.111 -176.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . 0.479 ' HD2' ' H ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.651 0 C-N-CA 119.903 -0.719 . . . . 0.0 112.073 -179.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 . . . . . 0 N--CA 1.45 -0.446 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.451 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 45.2 t -98.6 128.74 49.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.863 0.363 . . . . 0.0 110.502 -175.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.0 m -68.74 150.07 48.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.526 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.62 -34.41 74.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.374 -173.842 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -60.05 -39.89 87.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 0.0 110.296 178.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.41 -38.83 81.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.098 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.517 ' HA ' HD13 ' A' ' 95' ' ' LEU . 94.3 mt -69.46 -35.17 75.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.934 -177.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 96.6 mttt -59.31 -30.99 68.75 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -177.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -68.58 -19.59 64.48 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.513 0.196 . . . . 0.0 111.148 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.517 HD13 ' HA ' ' A' ' 92' ' ' LEU . 8.7 mp -64.1 -39.15 93.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.955 0.407 . . . . 0.0 110.623 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -72.48 -19.12 78.8 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.597 175.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -83.86 -24.6 30.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.032 0.444 . . . . 0.0 110.371 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.654 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 48.3 t -77.39 111.73 13.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.77 -177.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.2 -21.31 62.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.313 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 58.8 m -71.43 -46.79 59.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.96 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.515 HD11 ' CD1' ' A' ' 139' ' ' PHE . 59.5 tp -68.25 -51.08 49.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.968 -175.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.654 ' HG2' ' O ' ' A' ' 98' ' ' SER . 6.3 ptp180 -59.96 -28.19 67.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.682 -178.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.49 ' HA ' HD23 ' A' ' 106' ' ' LEU . 33.7 t -62.2 -23.62 66.73 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.095 0.474 . . . . 0.0 110.399 178.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.3 mt -82.38 -24.79 34.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.028 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 102' ' ' ARG . 10.2 mp -75.74 -8.68 57.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.51 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.4 mm? -67.48 -22.92 65.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.889 172.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -71.25 113.88 23.02 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.858 177.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' A' ' 111' ' ' ARG . 25.1 Cg_endo -61.68 -24.29 77.48 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.938 2.425 . . . . 0.0 112.846 -175.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 47.1 t60 -78.47 -42.46 29.71 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.824 0.345 . . . . 0.0 110.376 177.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.6 tt -65.36 -42.97 92.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.035 -176.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.457 ' HD3' ' HA ' ' A' ' 108' ' ' PRO . 12.7 ptm180 -67.56 -31.62 71.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.648 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . 0.451 ' HA ' HE21 ' A' ' 112' ' ' GLN . 0.0 OUTLIER -63.52 -43.02 98.39 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.426 173.545 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 86.0 mt -57.34 -49.34 76.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.412 ' HG2' HG22 ' B' ' 474' ' ' VAL . 75.0 mtp -54.89 -49.32 71.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.073 177.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 45.8 t -60.56 -39.9 82.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.032 0.444 . . . . 0.0 111.343 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.497 ' HA ' ' NE2' ' A' ' 119' ' ' GLN . 74.4 m-20 -68.32 -38.61 81.73 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.268 -178.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.56 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 59.7 tp -73.66 -44.66 56.19 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.61 -178.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.438 ' OD1' ' HD3' ' B' ' 475' ' ' ARG . 30.9 t70 -71.0 -27.99 64.09 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -171.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.497 ' NE2' ' HA ' ' A' ' 116' ' ' ASN . 11.0 pt20 -68.29 -17.54 64.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.279 0.562 . . . . 0.0 110.675 178.26 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 67.39 29.42 74.16 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.442 -0.799 . . . . 0.0 113.864 170.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -76.87 -51.99 10.27 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.954 0.377 . . . . 0.0 111.167 179.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.46 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 17.6 m-20 -132.89 37.06 3.46 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.252 0.549 . . . . 0.0 110.518 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.646 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -46.11 -34.29 4.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.557 -1.201 . . . . 0.0 112.521 179.269 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.2 -46.9 88.14 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.834 0.349 . . . . 0.0 111.462 -176.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.437 ' HE2' ' HB3' ' A' ' 122' ' ' ASP . 3.9 mppt? -81.44 -35.33 30.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.138 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 85.4 mt -59.8 -44.25 94.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.046 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.476 ' HB3' ' NH2' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -54.75 -29.85 54.92 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.796 0.331 . . . . 0.0 111.822 179.314 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -83.19 -50.32 8.56 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.98 0.419 . . . . 0.0 110.441 176.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.752 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.34 -29.97 71.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.104 -176.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.594 ' HB3' ' CD1' ' A' ' 136' ' ' PHE . 3.5 m-30 -73.37 -21.92 60.41 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 122.172 -0.33 . . . . 0.0 111.367 -177.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . 0.484 ' SD ' ' HG2' ' B' ' 467' ' ' ARG . 3.3 mmt -85.19 -5.26 59.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.899 0.38 . . . . 0.0 110.892 -177.125 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.752 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.6 pt20 -103.6 -6.63 21.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.896 0.379 . . . . 0.0 110.22 176.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.516 ' O ' HG23 ' A' ' 137' ' ' VAL . 4.1 mt-10 -92.31 120.3 67.68 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.184 -177.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.537 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 22.5 Cg_endo -60.74 -21.0 68.32 Favored 'Trans proline' 0 N--CA 1.464 -0.21 0 C-N-CA 122.754 2.303 . . . . 0.0 112.339 -175.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 63.4 mt -82.08 -43.96 17.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.706 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.594 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 47.1 t80 -73.48 -31.21 63.63 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.601 -0.44 . . . . 0.0 109.998 -177.018 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 133' ' ' GLU . 78.0 t -60.67 -39.98 83.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.483 176.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 17.7 mm-40 -63.18 -46.67 86.0 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.965 0.412 . . . . 0.0 110.129 177.373 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . 0.515 ' CD1' HD11 ' A' ' 101' ' ' LEU . 58.7 t80 -57.93 -50.23 74.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.376 178.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.765 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.45 -48.69 74.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.497 -176.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -63.99 -30.33 71.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.159 0.504 . . . . 0.0 110.295 -176.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 61.4 m -70.27 -51.07 33.28 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.819 178.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.453 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 24.3 p -66.7 -25.2 66.42 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.242 -176.222 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.765 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 79.1 mt -57.42 -44.0 84.27 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.913 0.387 . . . . 0.0 110.805 177.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . 0.421 ' O ' ' HG2' ' A' ' 148' ' ' GLU . . . -76.75 -14.59 82.39 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.309 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 41.1 mt -91.46 -29.32 4.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.751 0.31 . . . . 0.0 111.026 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 23.0 m -100.64 5.3 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 CA-C-O 120.698 0.285 . . . . 0.0 110.559 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 145' ' ' GLY . 4.9 pt-20 . . . . . 0 N--CA 1.441 -0.89 0 CA-C-O 121.321 0.582 . . . . 0.0 109.704 178.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 77.6 mt . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . 0.617 ' HD2' ' H ' ' B' ' 464' ' ' ARG . 0.0 OUTLIER -76.74 -29.43 56.17 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.608 -0.837 . . . . 0.0 109.901 -175.31 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . 0.573 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 45.2 t60 -65.55 -48.28 72.99 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.524 171.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.404 ' O ' HG12 ' B' ' 470' ' ' ILE . 37.8 mt-10 -62.48 -22.36 66.19 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.407 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . 0.484 ' HG2' ' SD ' ' A' ' 131' ' ' MET . 28.4 mtp-105 -79.0 -44.78 21.57 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 176.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . 0.573 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -78.53 -19.68 52.39 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.411 -175.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . 0.49 HG13 ' O ' ' B' ' 465' ' ' HIS . 31.4 m -71.28 -22.51 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.973 0.416 . . . . 0.0 110.523 176.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.404 HG12 ' O ' ' B' ' 466' ' ' GLU . 31.3 mm -66.42 -30.75 50.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.886 177.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 77.8 mt -60.3 -38.09 82.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.789 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.451 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.2 mp0 -68.44 -40.0 81.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.067 0.461 . . . . 0.0 110.102 176.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.5 m -62.15 -57.29 12.09 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.509 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.412 HG22 ' HG2' ' A' ' 114' ' ' MET . 96.3 t -53.08 -49.6 49.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.514 176.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.524 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 1.8 tpp180 -59.87 -44.27 94.26 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.689 0.281 . . . . 0.0 111.259 -175.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -62.49 -47.06 85.65 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.8 -177.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 72.1 mt -65.6 -54.5 27.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.146 -178.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 11.2 mt -57.02 -28.89 30.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.182 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.524 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 21.5 tptm -59.13 -40.25 84.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.053 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.433 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.258 -179.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 121.042 0.449 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.526 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 61.8 t -101.46 139.88 21.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.631 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.429 ' O ' ' HB2' ' A' ' 91' ' ' ASN . 30.1 m -59.82 134.77 57.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.998 0.427 . . . . 0.0 110.196 178.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.516 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 3.9 tt -65.02 -33.64 76.52 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.642 -173.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -58.51 -37.78 76.31 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.396 175.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.436 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 4.1 m-20 -65.49 -38.57 90.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.988 176.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 78.1 mt -68.89 -34.01 74.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.177 -178.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 56.7 mtpt -59.66 -24.47 63.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.081 -179.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -74.54 -19.28 60.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.215 -0.194 . . . . 0.0 111.206 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.36 -42.78 99.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.932 0.396 . . . . 0.0 110.915 -177.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.45 -9.84 81.96 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.441 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -103.06 -24.47 13.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.658 0.266 . . . . 0.0 111.34 -178.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.537 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 23.8 p -71.42 115.92 11.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.921 -176.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.07 -26.96 69.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.308 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 35.9 m -70.17 -44.34 68.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.887 0.375 . . . . 0.0 110.937 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.42 HD11 ' CD2' ' A' ' 139' ' ' PHE . 46.5 tp -72.23 -49.13 37.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.522 -174.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.537 ' HG2' ' O ' ' A' ' 98' ' ' SER . 2.4 ptp180 -58.43 -29.56 66.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.17 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.416 ' HA ' HD23 ' A' ' 106' ' ' LEU . 34.0 t -65.71 -22.82 66.65 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.918 0.39 . . . . 0.0 110.256 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 24.2 mt -84.2 -28.37 27.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.226 0.536 . . . . 0.0 109.65 178.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.533 ' O ' ' HD2' ' A' ' 111' ' ' ARG . 9.7 mp -74.03 2.64 8.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.154 178.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.2 mm? -75.7 -19.73 58.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.893 0.378 . . . . 0.0 110.056 171.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -80.17 114.36 46.22 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.572 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -55.82 -39.77 89.16 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.501 2.801 . . . . 0.0 113.137 -177.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -69.03 -41.42 77.71 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.762 0.315 . . . . 0.0 110.624 -178.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.424 ' O ' HD23 ' A' ' 110' ' ' LEU . 3.8 tt -60.45 -41.53 94.27 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 105' ' ' LEU . 57.1 mtp85 -62.78 -44.28 96.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.912 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.81 -24.81 67.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.497 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 65.7 mt -79.16 -51.58 9.33 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 121.646 0.736 . . . . 0.0 109.079 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.576 ' HG3' HG13 ' B' ' 474' ' ' VAL . 44.0 ttp -59.55 -43.86 93.41 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.39 -1.277 . . . . 0.0 111.211 -177.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.628 ' HA ' HD13 ' B' ' 478' ' ' ILE . 33.4 m -68.01 -23.98 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.88 0.372 . . . . 0.0 111.744 -178.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 28.2 m-20 -72.69 -42.35 64.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.282 0.563 . . . . 0.0 110.673 177.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.485 HD23 HG21 ' B' ' 474' ' ' VAL . 27.9 tp -60.42 -37.27 80.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.041 -177.24 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.525 ' HB2' HD12 ' B' ' 478' ' ' ILE . 17.0 t70 -67.53 -32.22 72.86 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.867 0.365 . . . . 0.0 110.979 -178.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 68.8 mt-30 -60.75 -28.89 69.04 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.497 -178.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . 0.56 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 70.51 20.54 77.16 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.039 -0.982 . . . . 0.0 114.06 169.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -69.01 -50.59 47.5 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.451 0.643 . . . . 0.0 109.691 -178.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.483 ' OD2' ' HE2' ' A' ' 125' ' ' LYS . 13.4 p-10 -141.01 40.21 1.8 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.648 179.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.617 ' HD2' ' H ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -52.78 -26.99 16.0 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.794 -1.094 . . . . 0.0 112.033 179.429 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.617 ' H ' ' HD2' ' A' ' 123' ' ' LYS . . . -67.6 -39.13 84.8 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.25 0.547 . . . . 0.0 110.137 -177.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.504 ' C ' ' HD2' ' A' ' 125' ' ' LYS . 5.1 tmmm? -79.45 -45.03 20.2 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.07 177.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.532 HD22 ' CE1' ' A' ' 130' ' ' TYR . 94.5 mt -56.25 -38.11 70.68 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.463 -178.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.58 -44.89 56.94 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.953 0.406 . . . . 0.0 111.385 177.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -84.18 -36.34 22.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.801 -178.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.504 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -70.24 -16.81 63.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.638 -178.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.532 ' CE1' HD22 ' A' ' 126' ' ' LEU . 7.3 m-30 -87.45 -22.1 25.16 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.934 0.397 . . . . 0.0 110.737 178.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 5.8 mmt -77.85 -6.11 53.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.963 -177.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.9 pt20 -99.59 -4.23 31.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.948 0.404 . . . . 0.0 110.235 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.522 ' O ' HG23 ' A' ' 137' ' ' VAL . 3.9 mt-10 -104.65 119.89 52.15 Favored Pre-proline 0 N--CA 1.452 -0.356 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.459 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 16.1 Cg_endo -57.11 -24.53 58.9 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.976 2.451 . . . . 0.0 112.363 -175.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.523 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.1 mp -67.01 -51.66 52.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.347 -179.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.476 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 27.7 t80 -75.64 -28.04 58.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -174.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 133' ' ' GLU . 99.4 t -59.38 -43.26 89.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.331 175.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 44.8 mt-10 -64.74 -46.85 80.48 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.818 0.342 . . . . 0.0 110.173 178.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . 0.42 ' CD2' HD11 ' A' ' 101' ' ' LEU . 71.4 t80 -56.98 -47.09 81.61 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.556 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.697 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -68.16 -45.55 73.21 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.72 -176.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.73 -32.47 73.79 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.996 0.427 . . . . 0.0 110.331 -176.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 91.2 m -77.01 -42.77 37.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.686 -176.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.443 ' HA ' HD12 ' A' ' 146' ' ' ILE . 27.8 p -64.95 -27.07 68.59 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.212 -177.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 82.2 mt -63.2 -39.34 94.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.767 0.318 . . . . 0.0 110.927 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -74.25 -14.76 80.43 Favored Glycine 0 C--O 1.225 -0.418 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.088 178.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.443 HD12 ' HA ' ' A' ' 143' ' ' CYS . 50.7 mt -90.78 -40.34 12.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.972 0.415 . . . . 0.0 110.493 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.436 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 29.7 m -87.15 12.57 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.883 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 7.7 pt-20 . . . . . 0 C--O 1.236 0.342 0 O-C-N 124.115 0.885 . . . . 0.0 112.146 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . 0.487 ' O ' ' HG3' ' B' ' 467' ' ' ARG . 71.5 mt . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 120.36 0.124 . . . . 0.0 111.329 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . 0.499 ' C ' ' HD2' ' B' ' 464' ' ' ARG . 1.4 ppt_? -70.63 -37.53 73.81 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -177.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . 0.543 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 49.8 t60 -65.88 -46.92 76.61 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.387 176.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.624 ' O ' HG12 ' B' ' 470' ' ' ILE . 39.7 mt-10 -58.91 -36.5 74.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.695 -179.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' B' ' 463' ' ' ILE . 19.1 mtm180 -66.67 -46.8 74.48 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . 0.543 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.9 p-10 -75.16 -19.01 60.07 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.934 -177.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.0 t -66.8 -34.88 72.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.347 170.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.624 HG12 ' O ' ' B' ' 466' ' ' GLU . 35.1 mm -65.12 -29.63 47.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 96.8 mt -56.05 -41.17 74.61 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.598 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.526 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.4 mp0 -64.79 -44.11 91.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.76 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . 0.415 ' O ' HG13 ' B' ' 477' ' ' ILE . 42.6 m -63.01 -52.95 60.97 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.268 0.556 . . . . 0.0 110.626 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.576 HG13 ' HG3' ' A' ' 114' ' ' MET . 24.5 t -56.45 -55.11 20.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.663 178.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.64 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 53.2 mtm180 -68.99 -20.18 64.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.232 -174.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . 0.427 ' O ' ' HD2' ' B' ' 480' ' ' LYS . 2.4 t80 -73.82 -55.28 6.41 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.193 176.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.415 HG13 ' O ' ' B' ' 473' ' ' CYS . 62.2 mt -60.54 -59.15 4.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-O 120.917 0.389 . . . . 0.0 111.242 -173.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . 0.628 HD13 ' HA ' ' A' ' 115' ' ' VAL . 46.3 mt -53.71 -30.49 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.872 -176.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.64 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 1.5 ttmm -81.65 -19.04 42.53 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -166.214 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . 0.427 ' HD2' ' O ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 C-N-CA 118.946 -1.102 . . . . 0.0 112.659 167.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.2 ptt180 . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 121.042 0.449 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.655 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 48.8 t -109.72 136.0 46.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.58 -175.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.605 ' OG ' ' HG2' ' A' ' 90' ' ' GLN . 37.0 t -63.25 144.02 57.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.565 176.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.42 -21.36 66.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.846 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.605 ' HG2' ' OG ' ' A' ' 88' ' ' SER . 11.6 pt20 -66.5 -39.88 88.94 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 177.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -69.79 -35.24 74.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.11 177.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.3 mt -70.31 -37.94 74.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.763 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -61.73 -22.53 65.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.814 0.34 . . . . 0.0 111.849 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -78.69 -17.98 55.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.535 -178.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 95.9 mt -61.31 -47.07 87.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.698 -179.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -69.35 -12.21 65.87 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.744 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -86.44 -24.45 25.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.738 0.304 . . . . 0.0 110.899 -177.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.57 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 82.0 p -80.43 124.58 29.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.96 0.409 . . . . 0.0 110.432 -177.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.22 -26.65 65.82 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.075 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.7 m -68.22 -48.14 65.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.067 -178.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -67.8 -49.99 59.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.463 -175.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.57 ' HG2' ' O ' ' A' ' 98' ' ' SER . 7.9 ptp180 -60.63 -27.87 68.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.402 -178.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.3 t -68.62 -23.35 64.43 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.275 0.56 . . . . 0.0 110.001 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.1 mt -81.33 -32.51 32.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.811 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.8 mp -72.19 -5.29 34.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.349 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 57.1 mt -76.69 -8.31 57.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.229 176.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -87.48 117.84 69.08 Favored Pre-proline 0 C--N 1.332 -0.157 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 173.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -58.52 -32.15 95.88 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.825 2.35 . . . . 0.0 112.613 -178.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.8 t60 -66.86 -43.45 83.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.96 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 54.3 tp -63.3 -35.3 79.89 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.913 0.387 . . . . 0.0 110.008 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 -59.92 -42.97 95.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.075 177.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . 0.576 ' HA ' HE21 ' A' ' 112' ' ' GLN . 0.0 OUTLIER -64.26 -45.61 87.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.13 178.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.41 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 91.9 mt -56.3 -47.04 79.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.155 0.502 . . . . 0.0 110.351 178.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.468 ' HG2' HG22 ' B' ' 474' ' ' VAL . 71.4 mtp -58.75 -50.82 72.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.926 177.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.607 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 52.2 t -59.27 -41.97 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 120.804 0.335 . . . . 0.0 111.301 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -64.28 -45.24 88.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.262 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 48.5 tp -67.02 -39.94 87.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.298 -177.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.475 ' CB ' HD12 ' B' ' 478' ' ' ILE . 16.9 t70 -62.39 -33.53 74.95 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.961 -175.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 63.1 mt-30 -60.26 -26.86 66.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.265 0.555 . . . . 0.0 110.501 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . 0.505 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 68.2 23.67 74.74 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.096 -0.956 . . . . 0.0 114.075 170.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -78.9 -45.83 19.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.132 0.491 . . . . 0.0 110.029 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.493 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 10.4 m-20 -132.44 31.65 4.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.756 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.668 ' HD2' ' N ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -53.22 -28.02 24.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.184 -0.916 . . . . 0.0 112.099 -179.013 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.668 ' N ' ' HD2' ' A' ' 123' ' ' LYS . . . -64.11 -38.43 91.03 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.369 0.604 . . . . 0.0 110.753 -175.455 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.424 ' HE3' ' HB3' ' A' ' 122' ' ' ASP . 46.6 mtmt -87.21 -42.02 13.28 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.004 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 86.2 mt -55.0 -42.04 72.02 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.404 -178.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.62 -41.53 55.04 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -82.34 -39.79 22.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.511 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.48 -32.28 73.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.251 -178.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.41 ' HE1' ' O ' ' A' ' 113' ' ' LEU . 3.4 m-30 -78.34 -17.35 56.65 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.01 -177.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . 0.615 ' HE2' HG12 ' A' ' 137' ' ' VAL . 3.6 mmt -76.85 -4.22 42.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.251 -177.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -88.38 -20.01 25.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.104 0.478 . . . . 0.0 109.854 175.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -92.2 121.66 66.23 Favored Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.658 -172.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.717 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 28.4 Cg_endo -63.17 -14.06 39.44 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.107 2.538 . . . . 0.0 112.502 -178.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 52.7 mt -80.04 -34.6 38.13 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.88 177.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -89.58 -35.01 16.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.227 -175.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.717 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.8 m -57.62 -48.68 82.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.223 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.473 ' N ' HG23 ' A' ' 137' ' ' VAL . 27.3 mm-40 -61.34 -42.15 98.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.423 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -57.19 -50.96 71.22 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.219 0.533 . . . . 0.0 109.665 176.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.775 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.06 -45.37 92.53 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.976 179.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -63.02 -32.86 74.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.286 0.565 . . . . 0.0 110.493 -175.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 90.9 m -79.69 -44.87 20.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.611 -177.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.47 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -66.4 -28.27 68.5 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.157 -175.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.9 mt -58.82 -51.03 71.74 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.688 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.12 -21.45 65.99 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.322 -176.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 52.3 mt -86.99 -35.15 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.676 0.274 . . . . 0.0 110.853 -179.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.449 ' HB ' HG11 ' A' ' 87' ' ' VAL . 18.7 m -95.88 -5.75 10.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -175.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 25.0 mt-10 . . . . . 0 C--N 1.327 -0.373 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.949 175.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . 0.46 ' O ' ' HD2' ' B' ' 467' ' ' ARG . 50.3 mm . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -58.87 -47.39 85.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.237 0.542 . . . . 0.0 110.398 177.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . 0.487 ' HD2' ' OE1' ' B' ' 466' ' ' GLU . 46.6 t60 -64.47 -43.11 95.23 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.051 178.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.489 ' O ' HG12 ' B' ' 470' ' ' ILE . 7.9 mm-40 -63.59 -22.67 67.02 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.408 -178.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . 0.571 ' HE ' ' HA ' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -84.14 -41.19 17.32 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.155 176.649 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -31.09 71.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.689 0.281 . . . . 0.0 110.623 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 31.5 m -69.59 -21.82 24.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-O 120.791 0.329 . . . . 0.0 110.907 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 466' ' ' GLU . 42.8 mm -66.64 -32.77 59.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.224 178.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 71.6 mt -58.79 -45.05 90.74 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.291 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.655 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.5 mp0 -62.24 -39.9 94.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.586 177.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . 0.59 ' O ' HG12 ' B' ' 477' ' ' ILE . 59.9 m -64.12 -57.71 8.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.356 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.468 HG22 ' HG2' ' A' ' 114' ' ' MET . 85.4 t -52.02 -50.28 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.12 176.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 22.8 ttm180 -66.65 -33.16 75.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.225 -174.359 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -61.23 -45.57 94.01 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 175.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.59 HG12 ' O ' ' B' ' 473' ' ' CYS . 9.2 mm -57.95 -63.5 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 121.765 0.793 . . . . 0.0 109.228 178.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . 0.475 HD12 ' CB ' ' A' ' 118' ' ' ASP . 16.6 mt -56.32 -30.05 29.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.167 -1.379 . . . . 0.0 112.065 -174.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 80.7 tttt -60.31 -44.3 95.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.516 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.655 -177.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? . . . . . 0 N--CA 1.454 -0.259 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -88.58 146.95 5.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.545 -176.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.0 m -63.87 144.69 56.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.312 0.577 . . . . 0.0 111.249 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 tt -66.13 -30.39 70.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.107 -0.952 . . . . 0.0 110.156 -176.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -58.79 -36.91 75.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.347 176.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -68.09 -40.06 82.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.0 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.421 HD11 ' HB3' ' B' ' 472' ' ' GLN . 83.7 mt -65.14 -34.49 78.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.439 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.415 ' HA ' ' CE2' ' B' ' 476' ' ' TYR . 10.4 mtpm? -59.1 -25.21 63.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.016 179.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -72.29 -16.81 61.91 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.455 ' HB2' ' CE1' ' B' ' 476' ' ' TYR . 93.1 mt -62.01 -51.93 66.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.769 0.318 . . . . 0.0 110.719 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -64.08 -19.3 63.56 Favored Glycine 0 CA--C 1.519 0.34 0 C-N-CA 121.02 -0.61 . . . . 0.0 112.47 176.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -79.3 -16.43 56.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.725 0.298 . . . . 0.0 110.751 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.535 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 31.0 t -83.23 120.07 25.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.06 0.457 . . . . 0.0 111.051 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.96 -27.95 67.04 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.401 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 77.3 m -70.33 -47.38 61.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.884 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.592 HD12 HD11 ' A' ' 104' ' ' LEU . 17.4 tp -65.72 -50.15 65.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.92 -174.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.8 ptp180 -58.09 -25.1 60.91 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.142 -0.223 . . . . 0.0 111.44 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 73.9 m -74.15 -39.35 63.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.592 HD11 HD12 ' A' ' 101' ' ' LEU . 0.7 OUTLIER -87.12 -15.51 38.23 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.908 177.94 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.71 HD21 HD13 ' B' ' 477' ' ' ILE . 7.3 mp -68.95 -4.34 16.3 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.109 0.481 . . . . 0.0 110.774 168.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 97.1 mt -81.95 -11.73 58.73 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.774 177.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.575 ' O ' ' HG3' ' A' ' 111' ' ' ARG . 56.4 m-80 -75.88 115.21 44.29 Favored Pre-proline 0 N--CA 1.463 0.192 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 175.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.42 -26.3 82.41 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.556 2.171 . . . . 0.0 112.193 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -69.62 -47.09 64.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.261 177.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 58.5 tp -64.01 -34.6 78.37 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.343 0.592 . . . . 0.0 110.145 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.575 ' HG3' ' O ' ' A' ' 107' ' ' ASN . 70.5 mtp85 -65.05 -42.47 94.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.679 177.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -64.01 -39.79 94.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.062 177.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 84.0 mt -59.04 -48.45 81.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.828 178.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.543 ' HG2' HG22 ' B' ' 474' ' ' VAL . 44.2 mtm -57.77 -53.02 62.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.575 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.572 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.1 m -65.7 -28.86 45.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.714 -175.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -69.14 -46.77 66.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.084 0.469 . . . . 0.0 110.518 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.587 HD11 ' SD ' ' A' ' 127' ' ' MET . 33.8 tp -63.3 -38.94 93.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.861 -178.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.538 ' OD1' ' HG2' ' B' ' 475' ' ' ARG . 9.4 t70 -63.71 -30.34 71.45 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.851 -177.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.572 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 74.4 mt-30 -60.09 -29.63 68.71 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.503 0.668 . . . . 0.0 109.819 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.35 18.72 73.65 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 114.62 -1.173 . . . . 0.0 113.902 171.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -67.07 -55.36 14.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.202 0.501 . . . . 0.0 110.227 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -133.71 45.22 2.68 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.368 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.596 ' O ' ' HG2' ' A' ' 127' ' ' MET . 0.0 OUTLIER -56.92 -29.5 63.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.462 -178.037 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.45 -38.41 84.08 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.812 0.339 . . . . 0.0 111.412 -177.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.597 ' HD2' ' H ' ' A' ' 125' ' ' LYS . 0.0 OUTLIER -87.4 -33.9 18.95 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.477 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.451 HD22 ' CE2' ' A' ' 130' ' ' TYR . 97.4 mt -60.69 -36.02 77.74 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.729 -179.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . 0.596 ' HG2' ' O ' ' A' ' 123' ' ' LYS . 73.9 mmm -53.6 -43.91 68.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.975 0.417 . . . . 0.0 110.454 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.8 mmm180 -72.44 -38.79 68.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.981 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.89 -24.55 63.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.419 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.451 ' CE2' HD22 ' A' ' 126' ' ' LEU . 2.5 m-30 -88.82 -30.62 18.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.834 0.35 . . . . 0.0 110.699 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 1.3 mmt -68.75 -10.36 56.07 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.503 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.8 pt20 -95.65 -9.65 31.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.87 0.367 . . . . 0.0 110.499 -178.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.573 ' O ' HG23 ' A' ' 137' ' ' VAL . 3.4 mt-10 -91.97 121.88 66.13 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.749 -175.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.52 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 18.3 Cg_endo -59.31 -20.19 54.33 Favored 'Trans proline' 0 C--O 1.226 -0.113 0 C-N-CA 122.963 2.442 . . . . 0.0 112.585 -177.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.1 mt -80.33 -41.18 25.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.99 0.424 . . . . 0.0 110.535 178.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -78.59 -32.38 47.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.087 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' ' 133' ' ' GLU . 79.6 t -59.91 -42.01 87.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.781 177.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 17.5 mm-40 -69.25 -42.97 74.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.106 178.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -58.35 -49.22 77.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.695 178.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.793 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -61.64 -47.43 85.42 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.98 -177.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -63.91 -33.21 75.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.163 0.506 . . . . 0.0 110.263 -178.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . 0.445 ' O ' HG13 ' A' ' 146' ' ' ILE . 65.3 m -67.4 -51.46 51.59 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.761 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.451 ' O ' HG22 ' A' ' 147' ' ' VAL . 26.1 p -64.64 -33.15 75.26 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.704 -0.225 . . . . 0.0 111.203 -177.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.793 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.5 mt -62.71 -36.92 84.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.934 0.397 . . . . 0.0 110.825 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -77.19 -15.32 81.68 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.355 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 142' ' ' CYS . 67.6 mt -91.71 -38.9 11.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.069 0.462 . . . . 0.0 110.964 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.451 HG22 ' O ' ' A' ' 143' ' ' CYS . 19.3 m -95.57 11.35 4.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.108 -177.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.421 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 2.8 pt-20 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.456 179.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 4.2 mp . . . . . 0 CA--C 1.526 0.032 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -70.5 -39.71 74.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.17 0.51 . . . . 0.0 109.768 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 47.6 t60 -62.48 -51.19 68.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.083 174.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.662 ' O ' HG12 ' B' ' 470' ' ' ILE . 34.5 mt-10 -61.59 -43.67 98.43 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.198 -175.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -55.46 -40.08 71.16 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 177.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -31.49 52.85 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -177.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.4 t -63.66 -36.0 74.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.266 175.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.662 HG12 ' O ' ' B' ' 466' ' ' GLU . 34.0 mm -60.86 -38.57 79.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.879 176.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 87.2 mt -59.29 -37.06 76.75 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.421 ' HB3' HD11 ' A' ' 92' ' ' LEU . 1.6 mp0 -68.12 -44.23 76.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.689 176.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 60.4 m -63.15 -56.1 19.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.104 -177.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.543 HG22 ' HG2' ' A' ' 114' ' ' MET . 73.9 t -48.85 -52.66 9.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.762 176.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.538 ' HG2' ' OD1' ' A' ' 118' ' ' ASP . 88.4 mtm180 -69.68 -23.05 63.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.918 -174.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . 0.455 ' CE1' ' HB2' ' A' ' 95' ' ' LEU . 0.8 OUTLIER -71.17 -47.36 58.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.969 0.414 . . . . 0.0 110.013 176.559 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.71 HD13 HD21 ' A' ' 105' ' ' LEU . 74.5 mt -64.89 -54.16 33.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.513 -177.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . 0.431 HD13 ' HA ' ' A' ' 115' ' ' VAL . 50.5 mt -54.39 -26.45 15.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.694 178.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 3.6 ttmp? -70.81 -31.15 67.8 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.908 -173.325 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.551 0 C-N-CA 119.785 -0.766 . . . . 0.0 112.581 175.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.325 0 CA-C-O 121.34 0.591 . . . . 0.0 111.847 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.9 p -107.3 157.82 7.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.467 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.8 m -64.07 147.59 51.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.224 0.535 . . . . 0.0 111.251 -176.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.507 HD22 HD12 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -67.68 -31.68 71.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.218 -174.846 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -57.97 -41.13 82.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.369 176.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.433 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 5.3 m-20 -64.41 -40.27 95.46 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.227 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.507 HD12 HD22 ' A' ' 89' ' ' LEU . 83.3 mt -67.71 -36.62 80.96 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.889 -178.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -62.81 -19.06 63.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -79.02 -17.76 54.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.61 0.243 . . . . 0.0 111.034 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.424 HD21 HG13 ' A' ' 147' ' ' VAL . 95.4 mt -61.82 -52.69 63.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.816 0.341 . . . . 0.0 111.327 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -64.27 -22.81 67.63 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.794 -176.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -97.38 -15.31 20.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.275 0.537 . . . . 0.0 111.576 -175.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.51 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 68.3 m -71.8 116.11 11.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.51 -29.06 65.99 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.707 -174.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 18.7 m -68.79 -48.54 63.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.958 0.409 . . . . 0.0 110.902 -178.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.406 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 41.9 tp -68.88 -48.05 64.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.668 -172.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.575 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 7.8 ptp180 -60.3 -28.38 68.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.479 -178.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 71.1 m -66.69 -25.63 66.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.99 0.424 . . . . 0.0 110.789 177.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.441 ' O ' HD23 ' A' ' 110' ' ' LEU . 22.6 mt -81.48 -33.26 32.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.406 HD21 HD13 ' B' ' 477' ' ' ILE . 11.0 mp -67.48 -12.68 60.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.531 177.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 70.3 mt -77.54 -8.0 57.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.348 177.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 108' ' ' PRO . 88.3 m-20 -84.21 115.01 58.17 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.705 176.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 107' ' ' ASN . 50.0 Cg_exo -54.33 -36.65 87.6 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.451 2.767 . . . . 0.0 113.373 -175.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 60.3 t60 -69.15 -45.01 71.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.594 0.235 . . . . 0.0 110.866 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 104' ' ' LEU . 49.8 tp -62.12 -38.2 88.03 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.132 0.491 . . . . 0.0 109.999 -178.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.42 ' O ' HG22 ' A' ' 115' ' ' VAL . 58.7 mtp180 -56.11 -49.79 72.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.048 174.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . 0.416 ' HA ' ' NE2' ' A' ' 112' ' ' GLN . 6.7 mm-40 -63.04 -24.16 67.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.924 -179.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 77.4 mt -78.6 -53.24 7.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -177.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' MET . . . . . 0.578 ' HG3' HG13 ' B' ' 474' ' ' VAL . 42.0 ttp -61.28 -42.21 98.27 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.367 -1.288 . . . . 0.0 111.58 -177.29 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 111' ' ' ARG . 26.3 m -72.95 -28.88 27.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.38 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -62.59 -46.2 89.37 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.145 0.497 . . . . 0.0 110.652 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.1 tp -56.46 -33.89 66.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.399 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -65.92 -32.27 73.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.564 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.66 -29.04 69.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.54 0.686 . . . . 0.0 110.553 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 71.94 19.04 78.06 Favored Glycine 0 C--N 1.322 -0.248 0 CA-C-N 114.89 -1.05 . . . . 0.0 113.775 172.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -70.07 -56.01 8.02 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.988 0.423 . . . . 0.0 110.076 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.599 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 20.4 m-20 -123.52 41.37 3.49 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.468 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.85 -33.16 48.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.026 -177.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.55 -38.99 65.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.156 0.503 . . . . 0.0 110.896 -177.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.6 mtpt -79.08 -38.84 35.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.502 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 89.6 mt -61.79 -39.09 90.48 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.962 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.88 -35.85 58.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.872 0.368 . . . . 0.0 111.326 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -84.1 -45.43 13.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.227 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.696 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -64.09 -31.96 73.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.749 -177.403 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.553 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 5.2 m-30 -72.39 -22.49 61.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.151 0.5 . . . . 0.0 110.411 -178.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' MET . . . . . 0.58 ' HE2' HG12 ' A' ' 137' ' ' VAL . 1.6 mmt -85.74 1.39 49.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.995 -178.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.696 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 17.7 pt20 -101.19 -14.13 17.84 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 175.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -91.13 120.03 68.64 Favored Pre-proline 0 N--CA 1.451 -0.388 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.331 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.709 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 29.0 Cg_endo -62.6 -13.61 34.71 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.98 2.453 . . . . 0.0 112.32 -179.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 86.9 mt -83.52 -32.29 25.98 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.07 178.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.553 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 47.4 t80 -90.43 -34.36 15.65 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.303 -177.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.709 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 8.6 m -57.11 -46.16 84.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.414 178.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.457 ' N ' HG23 ' A' ' 137' ' ' VAL . 5.7 mm-40 -62.31 -43.93 97.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.45 177.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -55.1 -49.74 70.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.818 175.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.756 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.81 -47.99 81.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.946 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -61.82 -33.45 74.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.4 0.619 . . . . 0.0 110.524 -176.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.6 m -76.8 -40.92 46.45 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.49 -177.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' CYS . . . . . 0.514 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -73.07 -29.47 62.98 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.607 -177.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.4 mt -60.52 -44.09 96.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.604 178.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.38 -20.68 69.78 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.333 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 56.6 mt -87.85 -30.48 5.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.842 0.353 . . . . 0.0 110.568 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.433 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 23.2 m -102.31 8.98 9.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -176.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 42.6 mm-40 . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 120.644 0.259 . . . . 0.0 110.725 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 59.8 mt . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.492 0.187 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -58.66 -42.12 87.67 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 70.8 t60 -65.96 -46.78 76.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.06 177.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 466' ' ' GLU . . . . . 0.598 ' O ' HG12 ' B' ' 470' ' ' ILE . 6.1 mm-40 -56.01 -50.22 71.5 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.059 -178.081 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 36.2 mtm180 -65.26 -33.08 75.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.618 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.05 -31.44 62.87 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.4 t -66.13 -36.32 77.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.223 174.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 470' ' ' ILE . . . . . 0.598 HG12 ' O ' ' B' ' 466' ' ' GLU . 43.2 mm -61.1 -35.96 69.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.201 176.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 471' ' ' LEU . . . . . 0.469 ' O ' ' HG3' ' B' ' 475' ' ' ARG . 93.3 mt -56.44 -48.48 76.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.12 176.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 472' ' ' GLN . . . . . 0.442 ' HB3' HD11 ' A' ' 92' ' ' LEU . 2.4 mp0 -59.46 -40.47 86.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.039 177.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.0 m -61.84 -55.47 29.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.976 0.417 . . . . 0.0 110.055 178.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 474' ' ' VAL . . . . . 0.578 HG13 ' HG3' ' A' ' 114' ' ' MET . 45.8 t -51.75 -50.42 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.597 177.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 475' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' B' ' 471' ' ' LEU . 82.8 mtp180 -64.47 -39.0 92.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.286 -175.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 476' ' ' TYR . . . . . 0.419 ' O ' ' HG3' ' B' ' 480' ' ' LYS . 0.9 OUTLIER -67.72 -45.84 73.88 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 120.867 0.365 . . . . 0.0 110.502 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 477' ' ' ILE . . . . . 0.406 HD13 HD21 ' A' ' 105' ' ' LEU . 97.5 mt -63.97 -60.54 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.434 -175.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 56.3 mt -53.65 -28.1 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.763 0.316 . . . . 0.0 111.326 -178.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -76.45 -32.55 58.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.078 -173.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 480' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.612 0 C-N-CA 120.02 -0.672 . . . . 0.0 112.108 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.839 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.54 ' HA ' ' OD1' ' A' ' 85' ' ' ASP . 7.6 Cg_exo -73.1 65.12 4.24 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.39 2.727 . . . . 0.0 112.577 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 -89.75 -55.11 3.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.799 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 22.7 ptp -88.83 8.94 26.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.224 0.535 . . . . 0.0 110.315 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.54 ' OD1' ' HA ' ' A' ' 82' ' ' PRO . 8.8 m-20 -78.76 -13.5 59.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.653 171.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 -90.52 132.6 35.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.417 -0.811 . . . . 0.0 109.784 177.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.508 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 38.3 t -89.01 143.59 10.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.069 -173.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.0 m -75.84 142.98 42.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.929 176.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.9 mt -55.24 -31.56 61.6 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.208 -0.906 . . . . 0.0 113.138 -173.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -53.31 -51.05 63.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.946 0.403 . . . . 0.0 110.816 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.485 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 6.2 m-20 -63.81 -35.83 81.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.717 -178.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 84.7 mt -72.66 -39.37 67.18 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.448 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.522 ' HA ' ' CZ ' ' B' ' 476' ' ' TYR . 97.3 mttt -66.94 -26.34 66.79 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.929 0.395 . . . . 0.0 110.985 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -69.99 -17.69 63.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.994 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.496 HD21 HG13 ' A' ' 147' ' ' VAL . 73.4 mt -65.14 -46.88 79.12 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.917 0.389 . . . . 0.0 110.409 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.39 -20.12 71.26 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.578 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -84.59 -23.87 29.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.849 0.357 . . . . 0.0 110.434 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.624 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 43.7 t -70.91 115.42 10.03 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.095 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.11 -30.05 67.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.173 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.9 m -72.99 -45.18 59.38 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.984 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.2 tt -74.3 -44.4 52.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.899 -172.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 98' ' ' SER . 2.8 ptp180 -56.99 -32.27 65.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.95 178.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.502 ' HA ' HD23 ' A' ' 106' ' ' LEU . 71.3 m -68.89 -18.06 64.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.864 0.364 . . . . 0.0 111.275 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 139' ' ' PHE . 17.2 mt -78.08 -33.7 50.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.105 0.479 . . . . 0.0 109.718 178.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -63.2 -18.05 63.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.193 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.502 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.4 mm? -68.94 -10.79 59.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.358 178.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -86.13 118.86 71.15 Favored Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -62.08 -26.64 78.37 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.98 2.453 . . . . 0.0 112.615 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -76.29 -46.65 26.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.913 0.387 . . . . 0.0 110.165 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.427 HD11 ' HB2' ' A' ' 139' ' ' PHE . 3.9 tt -62.04 -42.81 99.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.267 -176.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 8.9 ptp180 -67.21 -31.04 71.15 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.828 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . 0.562 ' HA ' HE21 ' A' ' 112' ' ' GLN . 0.0 OUTLIER -70.37 -38.61 74.8 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.659 -0.246 . . . . 0.0 110.366 176.169 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.437 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 81.3 mt -57.36 -50.92 71.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.159 0.504 . . . . 0.0 109.929 174.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.451 ' HG2' HG22 ' B' ' 474' ' ' VAL . 62.2 mtp -52.01 -57.0 10.81 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.72 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.715 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 27.4 m -64.04 -36.28 76.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.729 -176.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -64.6 -47.69 77.68 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.018 0.437 . . . . 0.0 110.927 178.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 62.3 tp -60.93 -40.35 92.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.058 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -66.4 -41.07 89.87 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.685 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.715 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 71.8 mt-30 -64.1 -28.31 69.69 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.595 0.712 . . . . 0.0 110.27 -178.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 75.69 31.45 56.21 Favored Glycine 0 N--CA 1.444 -0.815 0 CA-C-N 114.687 -1.142 . . . . 0.0 113.703 168.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -51.43 -42.25 61.39 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.059 0.457 . . . . 0.0 109.958 178.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.496 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 10.1 t70 -162.72 72.81 0.34 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 170.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.708 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.6 OUTLIER -53.76 -26.53 23.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.99 178.903 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.31 -54.69 43.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.411 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -25.95 27.25 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.291 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.55 HD22 ' CE2' ' A' ' 130' ' ' TYR . 95.4 mt -62.48 -43.36 99.01 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.438 178.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.575 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.4 OUTLIER -57.2 -28.49 62.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.921 0.391 . . . . 0.0 111.432 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -84.42 -49.16 8.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.922 0.391 . . . . 0.0 110.509 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.475 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -67.96 -16.35 64.02 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.302 -176.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.55 ' CE2' HD22 ' A' ' 126' ' ' LEU . 3.0 m-30 -88.78 -23.26 22.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.734 0.302 . . . . 0.0 111.722 -179.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -84.09 -0.18 50.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.085 0.469 . . . . 0.0 111.03 -176.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.475 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.5 pt20 -101.81 -16.22 16.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.963 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.43 ' O ' HG23 ' A' ' 137' ' ' VAL . 2.4 mt-10 -93.65 118.77 67.51 Favored Pre-proline 0 N--CA 1.449 -0.505 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.713 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 12.1 Cg_endo -55.54 -25.87 51.72 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.072 2.515 . . . . 0.0 112.658 -173.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.6 mt -66.64 -45.23 79.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.964 0.411 . . . . 0.0 110.658 -178.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.425 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 37.0 t80 -76.88 -29.06 55.63 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 -177.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 133' ' ' GLU . 75.2 t -62.9 -42.56 96.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.292 176.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.713 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 33.8 mm-40 -60.64 -46.66 89.47 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.895 0.379 . . . . 0.0 110.016 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . 0.509 ' HA ' ' CD1' ' A' ' 104' ' ' LEU . 77.1 t80 -59.57 -47.39 85.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.771 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.775 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.74 -47.22 84.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.185 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -67.94 -27.37 66.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.12 0.486 . . . . 0.0 110.395 -176.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 69.7 m -75.71 -44.17 43.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.407 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 27.6 p -69.74 -30.61 68.25 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.816 -176.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 86.1 mt -59.27 -48.12 82.82 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.966 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.42 -21.65 66.8 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.634 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 54.6 mt -91.02 -32.66 5.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.568 0.223 . . . . 0.0 111.361 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.496 HG13 HD21 ' A' ' 95' ' ' LEU . 14.9 m -102.53 -16.88 7.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -174.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -84.27 113.85 51.01 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-O 120.737 0.303 . . . . 0.0 111.571 -178.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 88.4 Cg_endo -81.78 -8.66 12.26 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.432 2.088 . . . . 0.0 110.401 171.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 2.2 m -65.93 114.93 5.5 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.681 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -72.8 163.15 28.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.299 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -85.99 66.22 9.48 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 121.59 0.709 . . . . 0.0 110.336 -178.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 51.12 -94.37 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 113.707 -1.588 . . . . 0.0 112.848 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -128.08 26.73 5.75 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.397 -176.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 44.6 m . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.669 -0.682 . . . . 0.0 110.519 178.569 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 11.3 t70 . . . . . 0 N--CA 1.482 1.129 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 41.0 mm -63.27 -30.67 50.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.22 -172.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -60.72 -41.36 95.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.572 0.701 . . . . 0.0 109.448 177.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -75.71 -49.38 18.46 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.805 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.548 ' O ' HG12 ' B' ' 470' ' ' ILE . 45.6 mt-10 -57.66 -47.93 80.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.171 -173.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . 0.575 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 78.3 mtm180 -60.37 -35.49 75.83 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -177.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.98 -31.22 58.88 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.99 -35.37 73.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.323 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.548 HG12 ' O ' ' B' ' 466' ' ' GLU . 24.6 mm -61.84 -35.92 70.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.101 177.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 86.8 mt -60.46 -38.02 82.85 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.829 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.508 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 1.8 mp0 -68.15 -41.11 82.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.877 0.37 . . . . 0.0 110.579 177.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.1 m -63.96 -56.11 17.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.806 -178.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.451 HG22 ' HG2' ' A' ' 114' ' ' MET . 82.7 t -52.3 -51.06 34.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.971 178.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 32.3 ttm180 -66.37 -33.33 75.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.492 -172.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . 0.522 ' CZ ' ' HA ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -63.72 -46.89 83.37 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.097 0.475 . . . . 0.0 109.948 176.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 75.6 mt -64.12 -51.02 74.17 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.511 -176.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.447 HG13 ' O ' ' B' ' 474' ' ' VAL . 40.5 mt -58.21 -23.68 22.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.96 0.41 . . . . 0.0 110.918 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.538 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 20.7 tptp -74.73 -35.31 62.66 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.254 -175.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.03 -16.11 11.67 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 119.916 -0.714 . . . . 0.0 112.406 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -91.96 -60.5 1.84 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.07 0.462 . . . . 0.0 111.963 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -90.33 -77.85 0.39 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.525 -167.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -110.18 -48.71 3.15 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.555 -171.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.538 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 80.28 13.07 82.42 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.693 -178.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 2.3 pp -69.67 160.79 30.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.175 0.512 . . . . 0.0 112.127 -175.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -127.99 65.2 1.37 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.903 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 21.9 p -82.52 -28.02 31.33 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.927 -178.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . 0.518 HD22 ' N ' ' B' ' 488' ' ' ASN . 0.8 OUTLIER -84.77 72.71 10.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.627 -177.199 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 32.3 t -140.18 152.16 45.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.984 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -85.06 75.59 10.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.343 0.592 . . . . 0.0 110.252 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -89.99 8.28 33.24 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.749 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 28.5 t -73.77 122.68 22.79 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.15 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -98.55 21.48 11.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.216 0.531 . . . . 0.0 110.661 -179.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -76.89 -32.74 57.66 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.108 177.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 60.1 t . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.635 -0.698 . . . . 0.0 110.531 179.094 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 111.669 -0.573 . . . . 0.0 111.669 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.429 ' HA ' ' OD1' ' A' ' 85' ' ' ASP . 37.2 Cg_endo -66.9 99.53 0.47 Allowed 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.662 2.241 . . . . 0.0 112.304 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -168.09 -75.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.428 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 15.7 tpt -95.56 2.59 54.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.738 0.78 . . . . 0.0 109.93 -177.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.429 ' OD1' ' HA ' ' A' ' 82' ' ' PRO . 20.8 p-10 -88.87 12.85 14.08 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.055 -177.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -58.07 131.65 51.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.25 174.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.423 HG21 HG13 ' B' ' 469' ' ' VAL . 46.5 t -68.99 130.53 34.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.059 -176.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.5 m -67.89 156.8 36.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.049 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.617 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -59.48 -42.07 91.24 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 -176.671 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -52.94 -38.29 61.84 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.99 0.424 . . . . 0.0 111.249 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.428 HD21 ' HA ' ' A' ' 149' ' ' PRO . 5.6 m-20 -80.46 -17.76 50.72 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.176 -177.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.416 ' HA ' HD13 ' A' ' 95' ' ' LEU . 84.2 mt -86.8 -35.35 19.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.316 176.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.617 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 53.2 mtpt -54.47 -37.1 64.84 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -175.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.453 HD22 HG22 ' A' ' 146' ' ' ILE . 0.0 OUTLIER -71.84 -17.07 62.17 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -175.721 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 92' ' ' LEU . 9.6 mp -60.3 -48.7 80.63 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -66.81 -21.46 71.26 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.263 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -85.09 -23.25 28.59 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.97 0.414 . . . . 0.0 110.609 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.646 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 42.6 t -65.68 118.21 9.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.259 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.62 -27.24 68.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.265 -177.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 80.2 m -75.12 -43.2 54.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.062 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 20.0 tp -75.64 -44.29 43.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.763 -171.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.646 ' HG2' ' O ' ' A' ' 98' ' ' SER . 7.6 ptp180 -58.91 -30.68 67.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.062 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.1 m -65.47 -24.86 67.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.029 0.443 . . . . 0.0 110.876 177.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.9 mt -83.63 -32.63 25.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.824 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.48 -21.96 66.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.457 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 74.6 mt -71.63 -13.15 61.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.848 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -81.37 113.94 45.53 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.928 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.504 ' HA ' ' NE ' ' A' ' 111' ' ' ARG . 48.9 Cg_exo -56.06 -37.02 96.92 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.088 2.526 . . . . 0.0 113.388 -177.012 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.503 ' CD2' HD22 ' A' ' 135' ' ' LEU . 47.7 t60 -69.27 -41.39 76.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.044 0.449 . . . . 0.0 110.384 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.515 HD11 ' HB2' ' A' ' 139' ' ' PHE . 2.5 tt -64.71 -46.64 81.45 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.985 -177.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.504 ' NE ' ' HA ' ' A' ' 108' ' ' PRO . 16.3 ptt180 -68.15 -28.47 67.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.872 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -44.32 95.85 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.168 0.508 . . . . 0.0 109.737 173.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.86 -47.25 85.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.183 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.472 ' HG2' HG22 ' B' ' 474' ' ' VAL . 51.1 mtp -56.7 -50.79 71.11 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.208 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.61 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.2 m -65.4 -32.27 57.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.861 -0.335 . . . . 0.0 111.136 -178.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -65.94 -41.27 91.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.054 0.454 . . . . 0.0 110.704 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.447 HD11 ' SD ' ' A' ' 127' ' ' MET . 32.9 tp -68.14 -37.38 80.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.759 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.446 ' OD1' HG21 ' B' ' 478' ' ' ILE . 36.7 t70 -64.29 -29.57 70.65 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.778 0.323 . . . . 0.0 111.472 -177.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.61 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 68.4 mt-30 -63.53 -28.37 69.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.375 0.607 . . . . 0.0 110.721 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.27 27.78 72.8 Favored Glycine 0 CA--C 1.516 0.154 0 CA-C-N 114.832 -1.076 . . . . 0.0 114.106 170.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -85.0 -53.79 5.06 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.177 0.513 . . . . 0.0 110.29 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -124.04 33.45 5.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.527 -176.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.676 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.1 OUTLIER -45.77 -38.27 6.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.847 -1.069 . . . . 0.0 112.08 177.023 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.16 -41.5 79.33 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 121.01 0.433 . . . . 0.0 111.527 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -85.4 -36.36 20.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.523 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.44 HD22 ' CE1' ' A' ' 130' ' ' TYR . 96.2 mt -57.48 -42.48 82.69 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.63 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.62 ' HG2' ' O ' ' A' ' 123' ' ' LYS . 69.4 mmm -53.16 -39.63 63.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.902 0.382 . . . . 0.0 110.768 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 -70.74 -48.9 52.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.307 0.575 . . . . 0.0 110.208 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.605 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -70.64 -19.45 62.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.221 -0.9 . . . . 0.0 112.328 -174.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.57 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.5 m-30 -85.47 -26.22 26.43 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.84 0.352 . . . . 0.0 110.618 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.466 ' HE2' HG12 ' A' ' 137' ' ' VAL . 19.2 mmt -80.75 0.54 34.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.202 -179.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.605 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.6 pt20 -105.73 -5.15 20.17 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.864 0.364 . . . . 0.0 110.296 177.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.401 ' O ' HG22 ' A' ' 137' ' ' VAL . 2.3 mt-10 -106.23 121.41 45.56 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.705 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 23.8 Cg_endo -61.42 -13.12 27.29 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.298 2.665 . . . . 0.0 113.085 -176.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.503 HD22 ' CD2' ' A' ' 109' ' ' HIS . 6.8 mp -77.3 -40.34 44.69 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.135 177.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.57 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 40.4 t80 -89.06 -33.16 17.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.105 0.479 . . . . 0.0 110.229 -172.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.705 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 9.5 m -58.31 -47.73 86.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.385 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.465 ' N ' HG23 ' A' ' 137' ' ' VAL . 10.8 pt-20 -67.63 -34.96 78.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.775 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . 0.515 ' HB2' HD11 ' A' ' 110' ' ' LEU . 45.3 t80 -58.06 -49.6 76.33 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 173.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.764 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -61.23 -46.42 90.48 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.73 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.49 -32.24 72.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.379 0.609 . . . . 0.0 110.885 -176.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 95.2 m -82.71 -38.42 23.35 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.093 -176.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.476 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 25.7 p -73.65 -27.02 61.04 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.246 -176.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.764 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 93.6 mt -60.06 -38.23 82.21 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.098 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -71.87 -16.81 76.52 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.387 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.453 HG22 HD22 ' A' ' 94' ' ' ASN . 25.1 mt -91.26 -28.77 4.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.729 0.299 . . . . 0.0 110.896 -178.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 31.0 m -96.7 2.61 10.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -57.04 111.82 3.83 Favored Pre-proline 0 N--CA 1.465 0.296 0 C-N-CA 121.127 -0.229 . . . . 0.0 110.484 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . 0.428 ' HA ' HD21 ' A' ' 91' ' ' ASN . 55.6 Cg_endo -71.12 -20.45 28.57 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.456 2.104 . . . . 0.0 111.782 -178.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 14.7 m -88.94 91.19 8.73 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.055 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -106.3 22.42 15.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.291 0.567 . . . . 0.0 109.831 177.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -65.73 123.86 20.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.762 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -70.24 147.11 50.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.404 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 61.31 40.96 13.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.964 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 25.7 p . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.647 179.473 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 8.4 t70 . . . . . 0 N--CA 1.482 1.169 0 CA-C-O 120.979 0.418 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 57.6 mt -68.03 -33.95 64.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.63 -171.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -57.56 -45.71 84.81 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.469 0.652 . . . . 0.0 109.287 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 63.8 t60 -67.7 -55.87 11.51 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.499 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.479 ' O ' ' HB ' ' B' ' 469' ' ' VAL . 38.4 mt-10 -56.68 -46.5 81.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.588 -172.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -74.12 -28.47 61.36 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.363 -175.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -27.02 48.62 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . 0.479 ' HB ' ' O ' ' B' ' 466' ' ' GLU . 2.4 t -61.23 -33.96 58.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.606 173.01 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.418 HG12 ' O ' ' B' ' 466' ' ' GLU . 30.1 mm -65.4 -28.07 43.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.797 -178.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.81 -29.91 70.47 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.124 0.487 . . . . 0.0 110.344 177.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -81.27 -40.59 23.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.01 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 61.2 m -62.09 -56.85 14.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.816 -177.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.687 ' O ' HG12 ' B' ' 478' ' ' ILE . 88.5 t -54.12 -50.57 54.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.402 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -64.69 -36.89 85.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.984 -171.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -43.78 88.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.24 0.543 . . . . 0.0 109.743 175.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.504 ' O ' ' HD3' ' B' ' 480' ' ' LYS . 78.1 mt -65.91 -53.84 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.227 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.757 HG22 ' H ' ' B' ' 484' ' ' GLY . 8.0 mm -54.5 -31.64 23.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.702 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.521 ' HA ' ' CA ' ' B' ' 484' ' ' GLY . 45.6 tptt -55.08 -39.69 69.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.63 -174.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . 0.504 ' HD3' ' O ' ' B' ' 477' ' ' ILE . 0.0 OUTLIER -113.3 -9.15 13.44 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.019 178.501 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.66 -60.78 1.85 Allowed 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . 0.603 ' HB2' HG23 ' B' ' 478' ' ' ILE . 92.9 m-85 -115.41 -86.08 0.61 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 119.791 -0.763 . . . . 0.0 112.908 -174.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . 0.543 ' H ' HG22 ' B' ' 478' ' ' ILE . 73.6 m-85 -108.07 -50.77 2.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.517 0.199 . . . . 0.0 111.256 -171.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.757 ' H ' HG22 ' B' ' 478' ' ' ILE . . . 77.21 45.62 11.24 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.518 -0.849 . . . . 0.0 111.481 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 92.2 mt -70.45 162.38 28.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.246 0.546 . . . . 0.0 111.175 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -121.62 -21.01 6.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.648 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 54.1 p 52.03 25.1 2.97 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 114.869 -1.06 . . . . 0.0 112.886 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . 0.416 HD22 ' HA ' ' B' ' 488' ' ' ASN . 1.9 t-20 -95.21 5.72 51.01 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.108 0.48 . . . . 0.0 110.414 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 9.8 m -59.32 127.25 31.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.682 178.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -80.13 -14.01 58.82 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.268 0.556 . . . . 0.0 111.038 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -89.17 20.4 3.74 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.341 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 24.5 t -140.43 112.55 7.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.238 177.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -70.46 118.91 13.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.976 0.417 . . . . 0.0 110.552 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -75.23 -37.2 61.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.75 -178.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 6.0 m . . . . . 0 C--O 1.249 1.048 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.086 -179.21 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.767 0 N-CA-C 111.625 -0.59 . . . . 0.0 111.625 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.49 45.79 1.68 Allowed 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 122.917 2.412 . . . . 0.0 112.707 -177.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -131.27 17.55 4.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.436 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.573 ' O ' ' HE1' ' B' ' 465' ' ' HIS . 47.1 ttp 55.38 45.85 24.55 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.678 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -71.81 -24.06 61.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.403 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.512 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 7.4 ptp180 -111.82 155.21 23.93 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.144 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.655 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 26.0 t -110.12 145.26 16.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.109 -176.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.0 m -62.56 142.16 58.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.072 0.463 . . . . 0.0 110.819 178.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.452 HD22 HD12 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -59.29 -33.18 70.76 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.548 -176.416 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -58.13 -40.86 82.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.791 177.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.423 ' HB2' HG12 ' A' ' 87' ' ' VAL . 3.5 m-20 -65.78 -42.92 90.21 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.589 ' HA ' HD13 ' A' ' 95' ' ' LEU . 83.7 mt -66.61 -34.64 78.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.845 -175.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -56.23 -32.95 64.94 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -66.18 -24.59 66.66 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.813 0.339 . . . . 0.0 111.702 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.589 HD13 ' HA ' ' A' ' 92' ' ' LEU . 7.5 mp -64.69 -38.03 89.61 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.768 0.318 . . . . 0.0 111.065 -175.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.56 -26.22 71.83 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.67 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -100.71 4.41 43.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.147 0.499 . . . . 0.0 110.856 -178.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.512 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 71.1 m -84.93 107.24 16.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.172 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.39 -29.95 69.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.242 -177.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.2 m -70.64 -39.73 73.49 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 -177.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.465 HD11 ' CD2' ' A' ' 139' ' ' PHE . 40.8 tp -74.73 -48.64 24.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.387 -176.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.512 ' HG2' ' O ' ' A' ' 98' ' ' SER . 4.5 ptp180 -61.39 -27.29 68.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.109 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.5 t -64.16 -23.91 67.49 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.13 0.491 . . . . 0.0 110.148 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.1 mt -87.51 -33.38 18.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.194 178.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.506 HD21 HD13 ' B' ' 477' ' ' ILE . 11.1 mp -69.86 -6.69 34.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.834 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 58.9 mt -67.93 -14.67 63.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.419 176.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -84.37 121.52 75.2 Favored Pre-proline 0 C--O 1.235 0.325 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.934 175.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.06 -29.91 90.3 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.884 2.389 . . . . 0.0 112.796 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 65.1 t60 -70.49 -44.61 67.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.736 0.303 . . . . 0.0 110.8 178.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.44 ' O ' HD23 ' A' ' 110' ' ' LEU . 4.3 tt -61.57 -42.14 98.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.221 0.534 . . . . 0.0 110.067 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -70.56 -32.73 70.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.281 -178.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . 0.529 ' HA ' HE21 ' A' ' 112' ' ' GLN . 0.0 OUTLIER -66.47 -37.54 85.33 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.63 175.673 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 76.1 mt -55.06 -51.26 66.89 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.47 ' HB3' HD11 ' B' ' 478' ' ' ILE . 49.5 mtm -53.77 -54.62 35.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 71.7 t -57.03 -39.49 66.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.544 -178.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -65.21 -41.37 94.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.464 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.515 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 54.9 tp -71.19 -31.98 68.3 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.258 -178.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.495 ' OD1' ' HB2' ' B' ' 485' ' ' LEU . 14.1 t70 -61.07 -38.9 87.86 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.954 -178.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -60.35 -29.37 68.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.557 0.694 . . . . 0.0 111.165 -177.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 66.13 21.31 69.85 Favored Glycine 0 N--CA 1.451 -0.367 0 CA-C-N 114.647 -1.161 . . . . 0.0 113.448 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -72.36 -34.24 67.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.324 0.583 . . . . 0.0 110.297 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.441 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 22.1 p-10 -145.38 40.07 1.2 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.384 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.599 ' N ' ' HD3' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.04 -33.91 5.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.471 -1.24 . . . . 0.0 112.144 177.735 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.7 -52.1 66.54 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.509 -175.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 122' ' ' ASP . 0.2 OUTLIER -76.24 -34.57 59.19 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.359 179.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.527 HD22 ' CE1' ' A' ' 130' ' ' TYR . 89.2 mt -58.32 -44.34 88.59 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.462 -178.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.58 -35.07 60.42 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.932 0.396 . . . . 0.0 111.103 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -84.21 -41.38 17.03 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.684 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -71.1 -17.07 62.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.027 -176.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.527 ' CE1' HD22 ' A' ' 126' ' ' LEU . 3.8 m-30 -87.58 -28.26 22.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.944 0.402 . . . . 0.0 110.857 179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.545 ' HE2' HG12 ' A' ' 137' ' ' VAL . 4.0 mmt -80.89 5.2 16.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.322 -177.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.517 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 28.4 pt20 -104.03 -7.95 19.92 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 176.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -103.03 126.24 32.99 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.403 -176.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.711 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 30.4 Cg_endo -63.59 -14.28 41.65 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.904 2.403 . . . . 0.0 112.516 -178.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.2 mp -73.46 -44.08 58.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.771 0.32 . . . . 0.0 110.416 176.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.418 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 36.9 t80 -88.8 -29.87 19.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.111 0.481 . . . . 0.0 110.126 -170.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.711 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 18.6 m -59.7 -48.59 86.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.786 177.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.511 ' N ' HG23 ' A' ' 137' ' ' VAL . 36.7 mt-10 -62.24 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.367 176.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . 0.465 ' CD2' HD11 ' A' ' 101' ' ' LEU . 61.8 t80 -54.06 -49.18 69.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.695 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.672 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.72 -47.35 81.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.935 178.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -61.1 -31.25 70.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.506 0.67 . . . . 0.0 110.493 -176.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.426 ' O ' HG13 ' A' ' 146' ' ' ILE . 78.2 m -77.96 -50.14 12.74 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.532 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -65.88 -29.72 70.21 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.551 0.215 . . . . 0.0 111.298 -175.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 57.7 mt -66.57 -23.31 66.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.765 0.316 . . . . 0.0 110.745 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -86.55 -14.67 65.27 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.063 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 142' ' ' CYS . 25.4 mt -91.86 -31.62 4.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.858 0.361 . . . . 0.0 110.906 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.458 ' HB ' HG11 ' A' ' 87' ' ' VAL . 23.0 m -106.8 4.95 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -177.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.402 ' HG3' ' H ' ' A' ' 148' ' ' GLU . 0.0 OUTLIER -50.48 129.26 25.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.862 0.839 . . . . 0.0 113.202 -172.801 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -83.37 -2.1 10.46 Favored 'Trans proline' 0 N--CA 1.459 -0.548 0 C-N-CA 123.046 2.497 . . . . 0.0 111.294 174.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 43.3 t -138.72 112.11 8.14 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.867 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.66 6.56 17.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.734 0.778 . . . . 0.0 110.167 177.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -115.38 21.75 13.81 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.671 -1.149 . . . . 0.0 109.317 176.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 58.62 -171.23 0.11 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.035 -178.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -135.4 71.52 1.43 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.287 178.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 48.3 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.498 -0.763 . . . . 0.0 110.627 -178.292 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 12.0 t70 . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.805 0.336 . . . . 0.0 110.122 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . 0.574 ' O ' ' HB2' ' B' ' 467' ' ' ARG . 42.4 mm -63.14 -34.38 66.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.397 -174.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -60.66 -47.63 85.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.074 0.464 . . . . 0.0 110.3 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . 0.573 ' HE1' ' O ' ' A' ' 84' ' ' MET . 15.5 t60 -71.81 -43.51 65.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.187 177.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.533 ' O ' HG12 ' B' ' 470' ' ' ILE . 49.2 mt-10 -69.78 -22.96 63.29 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.016 -174.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . 0.574 ' HB2' ' O ' ' B' ' 463' ' ' ILE . 30.8 ttp180 -62.94 -42.74 99.91 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.188 0.595 . . . . 0.0 111.301 177.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -80.41 -18.38 49.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.405 0.621 . . . . 0.0 109.884 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . 0.515 ' HB ' ' HA ' ' B' ' 466' ' ' GLU . 2.1 t -67.35 -32.0 55.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.386 171.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.533 HG12 ' O ' ' B' ' 466' ' ' GLU . 32.5 mm -60.14 -31.87 49.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.565 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . 0.539 ' O ' ' HG3' ' B' ' 475' ' ' ARG . 85.9 mt -53.9 -44.13 70.24 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.823 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.655 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.4 mp0 -64.8 -41.51 95.75 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.461 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 38.1 m -61.56 -53.28 58.46 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.226 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.476 ' O ' HG13 ' B' ' 478' ' ' ILE . 78.6 t -51.78 -57.78 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.881 176.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.539 ' HG3' ' O ' ' B' ' 471' ' ' LEU . 43.0 mtp180 -73.9 -20.24 60.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.326 -0.397 . . . . 0.0 112.039 -169.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.42 -46.16 70.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.033 0.444 . . . . 0.0 109.967 174.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.506 HD13 HD21 ' A' ' 105' ' ' LEU . 74.8 mt -65.36 -54.6 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.034 -178.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.614 HG22 ' H ' ' B' ' 484' ' ' GLY . 53.5 mt -53.43 -31.57 19.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.967 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.606 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 22.7 tptm -56.56 -48.43 77.37 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.275 -174.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.17 -10.91 13.83 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.77 -175.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' B' ' 477' ' ' ILE . 1.3 m-20 -89.6 -52.29 5.09 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 178.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -110.11 -88.38 0.5 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -172.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -111.65 -50.19 2.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.895 0.379 . . . . 0.0 111.217 -172.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.614 ' H ' HG22 ' B' ' 478' ' ' ILE . . . 71.63 51.07 17.31 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.472 -0.87 . . . . 0.0 111.565 -174.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.495 ' HB2' ' OD1' ' A' ' 118' ' ' ASP . 85.4 mt -71.78 141.83 49.7 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.849 0.357 . . . . 0.0 110.431 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -143.41 -27.03 0.56 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.889 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 9.0 t -99.78 -6.59 26.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.713 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . 0.458 ' HA ' ' HD3' ' B' ' 491' ' ' LYS . 0.9 OUTLIER -95.74 -5.34 42.29 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.716 -0.394 . . . . 0.0 111.021 -178.298 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 16.1 p -108.29 133.95 51.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.259 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . 60.83 34.6 19.65 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.463 0.649 . . . . 0.0 110.455 -178.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . 0.458 ' HD3' ' HA ' ' B' ' 488' ' ' ASN . 21.6 pttm -85.53 37.56 0.7 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.331 -177.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 8.9 t -81.7 54.64 2.45 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.235 0.541 . . . . 0.0 110.169 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -83.42 67.21 9.24 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.057 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -81.18 88.73 6.01 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.853 -175.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 40.3 t . . . . . 0 C--O 1.25 1.097 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.411 177.951 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.675 0 N-CA-C 112.198 -0.361 . . . . 0.0 112.198 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.48 -28.09 83.07 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.004 2.469 . . . . 0.0 112.569 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.0 t-80 -101.1 89.14 3.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.029 0.443 . . . . 0.0 110.065 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 16.4 ptp -128.95 54.46 1.79 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.81 0.814 . . . . 0.0 109.878 177.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -83.52 -6.5 59.47 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.85 -176.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -63.8 144.08 57.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.127 0.489 . . . . 0.0 110.478 177.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 24.2 t -75.26 132.01 34.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.416 -173.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.8 m -70.02 153.81 42.74 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.725 176.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.03 -41.49 87.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.867 0.365 . . . . 0.0 110.083 -175.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -55.06 -39.21 68.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.552 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -71.57 -38.35 70.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.907 0.384 . . . . 0.0 110.259 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.9 mt -65.14 -35.07 79.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.251 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -53.73 -32.27 51.5 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.113 178.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -70.5 -18.38 62.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.741 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.08 -52.1 60.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.63 0.252 . . . . 0.0 111.047 -177.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.45 -16.21 62.58 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.129 -0.557 . . . . 0.0 112.932 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 32.8 mm-40 -83.11 -24.1 32.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.819 0.342 . . . . 0.0 110.687 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.525 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.9 t -74.61 113.33 11.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.323 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -24.55 65.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.469 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.5 m -72.7 -41.07 65.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.7 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.437 ' O ' HD13 ' A' ' 105' ' ' LEU . 61.3 tp -67.43 -54.39 20.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.414 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.607 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 6.8 ptp180 -60.55 -24.94 65.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.229 -179.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.3 t -58.85 -30.07 67.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.208 0.528 . . . . 0.0 110.2 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 mt -86.71 -32.74 20.3 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.005 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.547 HD21 HD13 ' B' ' 477' ' ' ILE . 9.2 mp -61.59 -20.72 63.63 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.476 178.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 80.8 mt -68.14 -12.64 61.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.185 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -84.69 116.55 65.73 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.075 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.434 ' O ' ' HG2' ' A' ' 111' ' ' ARG . 67.5 Cg_exo -52.63 -36.18 70.74 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 123.802 3.002 . . . . 0.0 113.44 -176.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -67.34 -45.35 76.66 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.09 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 50.1 tp -65.85 -38.29 88.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.95 0.405 . . . . 0.0 111.046 -176.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 108' ' ' PRO . 30.1 ptt180 -69.93 -27.64 64.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.094 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -70.8 -37.81 73.29 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.549 174.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 88.1 mt -58.07 -46.28 85.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.326 176.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.44 ' HG2' HG22 ' B' ' 474' ' ' VAL . 59.0 mtm -58.1 -54.8 42.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.437 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.592 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 32.0 m -66.53 -23.31 31.23 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -175.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -76.47 -45.79 29.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.15 0.5 . . . . 0.0 110.792 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.541 HD12 ' CD2' ' A' ' 130' ' ' TYR . 0.7 OUTLIER -64.48 -49.97 69.28 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.414 -175.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' B' ' 488' ' ' ASN . 14.4 t70 -55.65 -21.4 17.84 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.393 -1.276 . . . . 0.0 111.014 -176.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 75.2 mt-30 -65.11 -29.67 70.55 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.499 0.666 . . . . 0.0 109.4 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.16 17.09 63.2 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 114.44 -1.254 . . . . 0.0 113.891 172.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -54.36 -54.94 33.81 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.585 ' OD2' ' HG2' ' A' ' 125' ' ' LYS . 27.3 t70 -143.48 65.92 1.31 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.791 0.805 . . . . 0.0 109.464 172.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.68 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -55.54 -23.36 26.13 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.92 179.381 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -53.12 -52.95 57.04 Favored 'General case' 0 C--O 1.231 0.131 0 O-C-N 123.319 0.387 . . . . 0.0 111.828 -177.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.585 ' HG2' ' OD2' ' A' ' 122' ' ' ASP . 18.5 pttm -85.38 -30.01 23.97 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.176 -0.61 . . . . 0.0 111.041 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.639 HD22 ' CE1' ' A' ' 130' ' ' TYR . 36.8 mt -60.52 -43.46 97.08 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.854 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.462 ' O ' ' HG2' ' A' ' 131' ' ' MET . 0.0 OUTLIER -55.61 -38.64 69.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.745 0.307 . . . . 0.0 111.546 179.782 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -84.08 -40.09 18.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.934 0.397 . . . . 0.0 110.873 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.501 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.81 -17.6 63.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.846 -176.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.639 ' CE1' HD22 ' A' ' 126' ' ' LEU . 5.2 m-30 -84.95 -28.41 25.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.066 0.46 . . . . 0.0 110.34 -179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.496 ' HE3' HG12 ' A' ' 137' ' ' VAL . 54.9 mmm -78.59 4.35 13.72 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.357 -178.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.501 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 7.2 pt20 -94.31 -14.83 25.02 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -99.65 125.25 41.35 Favored Pre-proline 0 N--CA 1.449 -0.48 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.669 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.707 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 29.0 Cg_endo -63.14 -14.21 40.31 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.056 2.504 . . . . 0.0 112.842 -174.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.401 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.3 mp -75.52 -36.15 60.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.927 0.394 . . . . 0.0 110.264 176.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.541 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 35.8 t80 -89.97 -33.88 16.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.152 -173.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.707 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 21.0 m -58.19 -49.29 82.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.027 178.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.527 ' N ' HG23 ' A' ' 137' ' ' VAL . 72.7 mm-40 -62.58 -41.44 98.95 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.542 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -55.31 -49.8 71.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.659 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.792 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.61 -48.8 75.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.707 177.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -59.39 -30.73 68.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.363 0.601 . . . . 0.0 110.621 -175.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.7 m -76.2 -52.68 9.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.398 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.545 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.4 p -64.5 -30.82 71.85 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 121.121 -0.232 . . . . 0.0 111.487 -174.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.792 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 82.6 mt -60.0 -44.96 94.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.779 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -72.19 -15.17 76.68 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.406 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 65.8 mt -91.19 -36.84 8.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 120.748 0.309 . . . . 0.0 111.315 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 27.7 m -94.55 5.93 7.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -173.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 6.7 mm-40 -62.87 116.19 22.45 Favored Pre-proline 0 C--N 1.326 -0.447 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 174.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -72.25 -6.31 18.83 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 122.646 2.23 . . . . 0.0 112.337 -178.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 14.2 t 69.19 101.51 0.06 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.012 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -80.22 114.29 19.02 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.368 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -126.46 164.24 21.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.243 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -65.25 143.39 57.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.876 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -136.71 102.77 5.0 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.218 -177.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 21.5 m . . . . . 0 C--O 1.251 1.178 0 CA-C-O 118.575 -0.726 . . . . 0.0 110.088 179.067 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 7.7 t70 . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 121.184 0.516 . . . . 0.0 110.427 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 72.6 mt -67.36 -35.49 73.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.773 -172.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -58.2 -44.46 88.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.438 0.637 . . . . 0.0 109.827 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . 0.402 ' HA ' ' ND2' ' B' ' 468' ' ' ASN . 62.9 t60 -65.49 -55.27 18.77 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.293 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.34 -38.0 82.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.133 -173.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -72.23 -42.98 65.1 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 111.642 0.238 . . . . 0.0 111.642 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . 0.402 ' ND2' ' HA ' ' B' ' 465' ' ' HIS . 2.1 p30 -76.01 -23.56 55.21 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.8 t -58.34 -32.38 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.702 174.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.541 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 25.9 mm -62.98 -37.55 79.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.814 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 85.1 mt -53.55 -42.26 67.3 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.223 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -65.44 -43.31 90.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.396 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 53.3 m -62.04 -54.09 46.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.593 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.44 HG22 ' HG2' ' A' ' 114' ' ' MET . 69.2 t -47.88 -54.33 3.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.762 176.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.456 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 26.7 ttm180 -67.93 -35.73 78.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.596 -173.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -43.17 95.35 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.051 0.453 . . . . 0.0 110.133 178.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.547 HD13 HD21 ' A' ' 105' ' ' LEU . 97.5 mt -67.42 -55.28 17.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.638 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 56.9 mt -54.46 -23.44 10.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.025 0.441 . . . . 0.0 111.026 176.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.603 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 15.3 tppt? -69.99 -48.88 56.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.927 -175.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . 0.432 ' HD2' ' HB3' ' B' ' 479' ' ' LYS . 2.1 mptp? -103.53 -16.8 15.44 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.474 -177.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -90.32 -51.86 5.22 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.784 -175.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -100.43 -83.38 0.44 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -173.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -111.9 -48.63 3.04 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -167.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.603 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 95.98 15.08 43.5 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.344 -0.931 . . . . 0.0 112.008 -173.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 1.9 pp -75.9 175.52 8.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.362 0.601 . . . . 0.0 112.516 -174.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -143.38 51.48 1.37 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.017 177.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 2.6 t -57.06 -45.7 83.02 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -170.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . 0.425 ' HB3' HH22 ' B' ' 475' ' ' ARG . 0.6 OUTLIER -92.81 84.76 5.02 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.207 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 29.2 m -144.7 130.77 19.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.943 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -93.5 3.19 55.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.93 0.395 . . . . 0.0 111.023 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 8.4 ptmm? -82.34 49.33 1.41 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.529 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 5.5 p -85.11 61.37 6.83 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.547 0.689 . . . . 0.0 110.481 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 54.5 pttt -132.53 33.88 3.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.677 -177.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -96.85 -4.68 39.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.402 178.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.407 HG22 ' H ' ' B' ' 495' ' ' VAL . 4.1 m . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.521 177.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.661 0 N-CA-C 112.233 -0.347 . . . . 0.0 112.233 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.78 77.26 3.77 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 123.176 2.584 . . . . 0.0 112.306 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.469 ' H ' ' CD2' ' A' ' 83' ' ' HIS . 6.8 p80 -78.76 67.76 4.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.609 0.718 . . . . 0.0 110.597 178.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 96.2 mmm -84.04 35.38 0.53 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.321 -176.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.458 ' HA ' ' CE1' ' B' ' 465' ' ' HIS . 13.7 m-20 -81.56 -29.12 33.55 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 171.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -81.94 136.32 35.31 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.139 175.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.556 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 27.7 t -99.8 133.69 41.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.295 -174.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.2 m -55.76 134.93 51.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.924 175.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -59.88 -32.86 71.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.263 -176.315 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -60.37 -40.95 92.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.696 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -64.46 -43.07 95.41 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.159 0.504 . . . . 0.0 110.149 177.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 76.8 mt -65.45 -33.91 77.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.409 -178.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 63.0 mttm -62.5 -24.7 67.62 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -74.36 -18.02 60.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.669 0.271 . . . . 0.0 110.791 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.437 HD21 HG13 ' A' ' 147' ' ' VAL . 91.0 mt -62.27 -42.31 99.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.957 0.408 . . . . 0.0 110.479 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -70.63 -19.01 76.16 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.723 -0.672 . . . . 0.0 112.379 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -86.5 -24.75 25.45 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.85 0.357 . . . . 0.0 110.435 -178.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.656 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.5 t -68.49 108.33 3.25 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.52 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.4 -24.67 66.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.051 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.5 m -75.43 -48.64 21.89 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.817 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.2 tp -67.36 -49.3 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.802 -174.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.656 ' HG2' ' O ' ' A' ' 98' ' ' SER . 8.2 ptp180 -60.14 -28.51 67.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.279 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.477 ' O ' ' HB2' ' A' ' 106' ' ' LEU . 22.7 t -66.9 -25.68 66.5 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.043 0.449 . . . . 0.0 110.096 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 27.3 mt -76.51 -33.22 58.62 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.404 HD21 HD13 ' B' ' 477' ' ' ILE . 10.1 mp -66.59 -15.97 63.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.825 177.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 103' ' ' SER . 3.9 mm? -69.12 -13.83 62.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.645 175.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -78.63 116.32 58.59 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.804 175.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.62 -26.59 82.6 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.99 2.46 . . . . 0.0 112.514 -175.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.464 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 66.2 t60 -74.56 -46.14 40.86 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.776 178.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.402 ' HA ' HD12 ' A' ' 113' ' ' LEU . 51.8 tp -64.77 -39.11 93.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.899 0.381 . . . . 0.0 110.916 -176.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -67.14 -33.22 74.97 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 -70.17 -36.42 74.68 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.24 178.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 109' ' ' HIS . 95.3 mt -58.39 -54.31 48.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.908 175.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.443 ' HG2' HG22 ' B' ' 474' ' ' VAL . 70.7 mtp -55.83 -50.42 70.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.163 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.599 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 48.7 t -59.21 -40.24 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.284 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 16.7 m-20 -60.37 -47.23 86.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.171 0.51 . . . . 0.0 111.088 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 55.9 tp -64.2 -37.74 88.54 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.21 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.474 ' HB2' HD12 ' B' ' 478' ' ' ILE . 26.8 t70 -63.94 -35.63 81.32 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.119 -179.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.599 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 74.5 mt-30 -62.45 -28.92 70.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.582 0.706 . . . . 0.0 110.426 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 70.57 27.39 72.61 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 114.443 -1.253 . . . . 0.0 113.61 171.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -56.5 -55.18 37.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.95 0.405 . . . . 0.0 110.4 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.57 ' O ' HD13 ' A' ' 126' ' ' LEU . 27.5 t70 -151.57 77.22 1.23 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.542 0.687 . . . . 0.0 109.723 174.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.677 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.6 OUTLIER -53.68 -23.72 12.31 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.802 -1.09 . . . . 0.0 111.629 178.618 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.9 -51.76 67.92 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -175.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -71.06 -50.06 37.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.8 176.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 122' ' ' ASP . 11.1 mp -51.73 -45.65 63.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -175.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.455 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.1 OUTLIER -54.38 -45.63 72.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.835 0.35 . . . . 0.0 111.658 -179.556 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 42.5 mtm180 -83.44 -35.44 24.99 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.078 -176.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.51 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -73.16 -16.86 61.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.563 -177.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.507 ' HB3' ' CG ' ' A' ' 136' ' ' PHE . 13.1 m-30 -89.16 -27.08 20.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.088 0.471 . . . . 0.0 110.743 177.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.501 ' HE2' HG12 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -79.0 6.29 9.69 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.543 -177.563 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 30.0 pt20 -102.38 -22.85 14.03 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.845 0.355 . . . . 0.0 110.869 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -103.33 138.6 19.59 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 121.048 0.451 . . . . 0.0 111.37 -175.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.756 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 35.2 Cg_endo -63.42 -13.53 36.74 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.829 3.019 . . . . 0.0 114.043 -171.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.452 HD22 ' CD2' ' A' ' 109' ' ' HIS . 11.0 mp -77.15 -39.15 50.15 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.322 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.507 ' CG ' ' HB3' ' A' ' 130' ' ' TYR . 39.8 t80 -91.51 -33.77 15.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.0 0.428 . . . . 0.0 110.29 -174.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.756 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 15.5 m -56.72 -51.17 70.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.339 179.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.524 ' N ' HG23 ' A' ' 137' ' ' VAL . 39.5 mm-40 -66.48 -35.35 80.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.597 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -56.4 -51.11 69.56 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 173.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.75 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.01 -47.4 83.27 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.702 178.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.72 -33.16 71.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.29 0.567 . . . . 0.0 110.633 -176.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.4 m -76.12 -48.63 19.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.391 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.519 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 25.6 p -67.19 -30.7 70.72 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.91 -174.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.75 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 74.6 mt -58.95 -47.14 86.14 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.833 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.33 -27.82 73.57 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.248 -176.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 69.8 mt -76.62 -42.12 34.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.805 0.336 . . . . 0.0 110.726 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.437 HG13 HD21 ' A' ' 95' ' ' LEU . 23.4 m -90.2 3.55 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -174.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.651 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 7.4 mm-40 -53.64 114.44 6.27 Favored Pre-proline 0 N--CA 1.465 0.287 0 O-C-N 123.185 0.303 . . . . 0.0 110.473 176.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.74 -11.02 23.82 Favored 'Trans proline' 0 N--CA 1.464 -0.217 0 C-N-CA 122.644 2.23 . . . . 0.0 112.077 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 42.7 m -98.27 176.58 5.67 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.794 -178.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 64.35 62.57 0.81 Allowed 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.629 0.58 . . . . 0.0 110.297 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 71.44 125.23 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.898 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -97.08 -2.19 43.76 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.691 -173.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -80.35 43.45 0.64 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.48 -177.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 9.4 p . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.586 179.611 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 N--CA 1.483 1.19 0 CA-C-O 120.498 0.189 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 82.4 mt -63.4 -35.08 70.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.363 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -54.99 -40.23 69.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.356 174.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . 0.458 ' CE1' ' HA ' ' A' ' 85' ' ' ASP . 57.5 t60 -74.97 -47.28 30.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.566 177.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.588 ' O ' HG12 ' B' ' 470' ' ' ILE . 40.5 mt-10 -57.29 -45.96 83.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.79 -176.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . 0.455 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 21.8 mtm180 -64.04 -29.57 70.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -177.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -32.63 59.24 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.4 t -66.14 -35.7 75.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.388 176.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.588 HG12 ' O ' ' B' ' 466' ' ' GLU . 30.7 mm -63.06 -33.78 62.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.246 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 90.1 mt -57.45 -48.67 78.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.357 177.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.556 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.1 mp0 -58.88 -36.78 75.21 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.094 178.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 57.5 m -63.96 -58.82 5.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.987 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.443 HG22 ' HG2' ' A' ' 114' ' ' MET . 94.2 t -50.45 -44.55 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.808 175.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 31.2 mmt180 -62.88 -44.04 97.19 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.015 -177.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 93' ' ' LYS . 0.9 OUTLIER -67.56 -50.28 59.23 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.67 -179.348 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.611 ' O ' ' HB2' ' B' ' 481' ' ' ASP . 83.9 mt -60.79 -59.27 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.746 -174.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.487 HG23 ' HB2' ' B' ' 482' ' ' PHE . 67.9 mt -58.81 -23.92 24.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.301 -177.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.523 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 5.6 tmtt? -64.57 -42.13 95.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.652 -177.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.72 -14.35 12.01 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . 0.611 ' HB2' ' O ' ' B' ' 477' ' ' ILE . 0.4 OUTLIER -89.41 -40.31 12.81 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -179.301 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . 0.487 ' HB2' HG23 ' B' ' 478' ' ' ILE . 89.4 m-85 -116.27 -91.81 0.53 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -174.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -112.81 -49.53 2.93 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.979 -0.289 . . . . 0.0 110.862 -173.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.523 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 64.94 45.93 90.9 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.002 -177.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.414 ' HB3' ' HB2' ' B' ' 488' ' ' ASN . 80.8 mt -70.59 139.44 51.43 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.478 -0.361 . . . . 0.0 110.6 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -113.57 -35.99 5.05 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.418 -177.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 13.6 t -129.39 24.17 5.5 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.43 0.633 . . . . 0.0 110.91 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . 0.414 ' HB2' ' HB3' ' B' ' 485' ' ' LEU . 13.7 m120 -117.93 104.43 10.9 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.7 -176.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . 0.412 ' HB3' ' HG3' ' B' ' 491' ' ' LYS . 70.9 m -92.31 147.86 22.59 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.122 176.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -120.06 20.77 12.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.172 0.511 . . . . 0.0 110.828 -178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . 0.434 ' O ' ' HD3' ' B' ' 491' ' ' LYS . 0.1 OUTLIER -83.1 163.93 20.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.208 -179.588 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 6.8 p -161.64 168.63 23.07 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.069 176.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 89.8 mttt 54.93 64.46 1.8 Allowed 'General case' 0 C--O 1.232 0.177 0 O-C-N 123.64 0.587 . . . . 0.0 111.107 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -62.29 -40.24 95.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.625 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 44.0 t . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.79 -0.624 . . . . 0.0 109.863 -179.767 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.666 0 N-CA-C 112.106 -0.398 . . . . 0.0 112.106 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -61.75 -33.14 86.15 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.736 2.291 . . . . 0.0 112.546 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -127.48 115.18 18.49 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.829 0.347 . . . . 0.0 110.235 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 27.3 ttt -155.44 67.25 0.64 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.255 0.55 . . . . 0.0 109.572 177.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -89.59 -27.34 20.28 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.315 -176.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.424 ' HA ' ' OE1' ' B' ' 472' ' ' GLN . 37.4 mmt180 -89.62 132.89 34.9 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.321 0.581 . . . . 0.0 110.368 179.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.45 HG11 ' HB ' ' A' ' 147' ' ' VAL . 85.2 t -106.7 137.29 38.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.712 -174.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.3 m -71.41 145.78 49.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.17 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.523 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.3 OUTLIER -58.8 -31.95 68.9 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.403 -176.469 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -56.61 -39.08 72.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.755 0.312 . . . . 0.0 110.703 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -70.45 -40.66 73.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.152 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.415 HD12 HD22 ' A' ' 89' ' ' LEU . 62.0 mt -68.41 -31.36 70.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.254 -178.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 62.2 mtpt -60.81 -28.37 68.73 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 178.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 -72.32 -16.61 61.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.724 -0.217 . . . . 0.0 111.548 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.491 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 97.0 mt -55.74 -56.48 19.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.535 -176.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -66.01 -21.98 70.17 Favored Glycine 0 CA--C 1.52 0.379 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.691 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -79.62 -20.52 46.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.058 0.456 . . . . 0.0 110.818 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.9 m -78.8 123.18 26.94 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.364 -177.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.61 -27.85 69.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.929 -173.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.1 m -75.12 -39.66 60.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.039 0.447 . . . . 0.0 110.868 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.552 HD12 HD11 ' A' ' 104' ' ' LEU . 29.4 tp -73.0 -49.09 30.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.521 -172.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.701 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 9.0 ptp180 -57.18 -33.52 67.55 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.919 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 73.6 m -63.08 -42.06 99.56 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.552 HD11 HD12 ' A' ' 101' ' ' LEU . 0.6 OUTLIER -87.94 -19.13 27.69 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.923 -0.711 . . . . 0.0 111.653 -179.192 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 101' ' ' LEU . 7.5 mp -64.82 -20.99 66.7 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.278 0.561 . . . . 0.0 110.622 170.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 97.7 mt -71.16 -12.71 61.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.965 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -78.61 118.49 72.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.868 175.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.94 -34.68 92.65 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.421 2.747 . . . . 0.0 112.86 -177.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.554 ' CD2' HD22 ' A' ' 135' ' ' LEU . 60.9 t60 -66.26 -48.76 69.43 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.694 0.283 . . . . 0.0 110.838 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 104' ' ' LEU . 48.7 tp -63.07 -41.79 99.51 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.101 -176.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -66.32 -34.57 78.28 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.193 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -67.67 -28.56 67.8 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 120.597 0.237 . . . . 0.0 111.086 176.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.93 -53.41 18.01 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.562 ' HG3' HG22 ' B' ' 474' ' ' VAL . 33.6 ttp -56.47 -42.91 79.0 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.021 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.411 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 20.5 t -62.94 -45.91 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 120.699 0.285 . . . . 0.0 111.22 177.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -62.99 -40.95 99.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.02 0.438 . . . . 0.0 111.243 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.416 HD23 HG21 ' B' ' 474' ' ' VAL . 46.1 tp -62.63 -37.21 85.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.6 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.401 ' HB2' HD12 ' B' ' 478' ' ' ILE . 6.9 t70 -62.99 -34.63 77.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.412 -178.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 60.7 mt-30 -58.91 -27.0 64.84 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.826 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.573 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 65.78 16.93 64.38 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-N 115.33 -0.85 . . . . 0.0 113.856 170.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -72.68 -42.96 63.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.311 0.576 . . . . 0.0 109.584 -175.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.42 ' OD1' ' HG2' ' A' ' 125' ' ' LYS . 4.2 t70 -150.04 51.43 0.91 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 173.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.573 ' HG3' ' HA2' ' A' ' 120' ' ' GLY . 0.0 OUTLIER -56.55 -20.71 22.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.66 -1.155 . . . . 0.0 110.582 175.242 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.477 ' N ' ' HD2' ' A' ' 123' ' ' LYS . . . -57.01 -53.81 53.86 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.271 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.42 ' HG2' ' OD1' ' A' ' 122' ' ' ASP . 65.0 pttt -79.61 -28.42 41.0 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.554 178.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.469 HD22 ' CE1' ' A' ' 130' ' ' TYR . 95.8 mt -63.51 -40.37 96.88 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.589 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.473 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.4 OUTLIER -52.92 -34.28 54.44 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.915 0.388 . . . . 0.0 110.857 177.185 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -79.73 -48.79 13.05 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.786 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.595 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.35 -20.12 64.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.206 -175.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.528 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.3 m-30 -85.04 -36.44 21.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.106 0.479 . . . . 0.0 110.848 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.67 5.94 14.19 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.144 -176.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.595 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.1 pt20 -100.3 -24.09 14.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.905 0.383 . . . . 0.0 110.14 178.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.57 136.15 19.4 Favored Pre-proline 0 N--CA 1.452 -0.356 0 CA-C-O 121.149 0.499 . . . . 0.0 110.881 178.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.759 ' HA ' HG22 ' A' ' 137' ' ' VAL . 34.1 Cg_endo -64.04 -14.33 42.82 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 123.532 2.821 . . . . 0.0 114.0 -170.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.554 HD22 ' CD2' ' A' ' 109' ' ' HIS . 4.3 mp -69.54 -39.31 77.54 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.942 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.528 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 60.8 t80 -92.2 -30.82 15.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.086 0.47 . . . . 0.0 110.093 -173.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.759 HG22 ' HA ' ' A' ' 134' ' ' PRO . 35.9 m -59.0 -50.9 78.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.262 -178.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.547 ' N ' HG23 ' A' ' 137' ' ' VAL . 11.7 pt-20 -72.24 -28.56 63.22 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.876 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -59.53 -49.0 79.47 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 172.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.813 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.57 -45.58 92.25 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.562 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.69 -32.66 73.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.518 -177.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 69.0 m -70.76 -51.38 27.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.995 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.0 p -65.26 -27.42 68.64 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.966 -175.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.813 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.3 mt -60.36 -54.47 45.24 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-O 120.745 0.307 . . . . 0.0 110.23 177.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.76 -14.29 57.91 Favored Glycine 0 CA--C 1.516 0.127 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.833 -176.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.419 HD12 ' HA ' ' A' ' 143' ' ' CYS . 64.5 mt -90.67 -30.48 4.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 120.808 0.337 . . . . 0.0 111.142 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.45 ' HB ' HG11 ' A' ' 87' ' ' VAL . 15.2 m -103.38 -18.35 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.546 -176.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -69.3 120.57 77.71 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 120.82 0.343 . . . . 0.0 110.307 177.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.26 -21.69 67.65 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 123.15 2.567 . . . . 0.0 112.029 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 26.9 t -79.39 90.05 5.01 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 174.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -75.1 128.63 35.98 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.996 0.427 . . . . 0.0 110.419 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -81.33 134.57 35.6 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 176.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -74.99 133.22 41.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.101 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -122.27 -161.87 0.96 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.372 -174.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 15.3 p . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.615 -0.707 . . . . 0.0 110.304 179.203 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 12.6 t70 . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 121.006 0.431 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 42.7 mt -65.87 -34.76 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.637 -171.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -65.13 -36.98 85.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.311 0.577 . . . . 0.0 109.823 178.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -68.24 -55.72 11.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.019 173.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.539 ' O ' ' HB ' ' B' ' 469' ' ' VAL . 40.1 mt-10 -56.5 -51.44 68.49 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.503 -0.772 . . . . 0.0 112.493 -172.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . 0.473 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 96.7 mtt180 -67.59 -25.73 65.92 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -174.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -29.99 37.78 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 177.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' B' ' 466' ' ' GLU . 8.5 t -60.93 -38.53 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.921 174.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.524 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 10.6 mm -63.21 -38.5 82.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.304 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . 0.497 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 80.3 mt -58.65 -46.06 87.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.119 177.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.508 HE21 ' HA ' ' B' ' 469' ' ' VAL . 10.3 mt-30 -62.88 -33.2 74.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.581 177.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 63.0 m -69.66 -54.97 11.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.234 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.562 HG22 ' HG3' ' A' ' 114' ' ' MET . 54.6 t -47.08 -50.02 7.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.19 175.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' B' ' 471' ' ' LEU . 35.8 mmt180 -63.61 -34.45 77.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.895 0.378 . . . . 0.0 111.171 -175.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -75.35 -49.34 19.39 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.569 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.542 ' O ' ' HB2' ' B' ' 481' ' ' ASP . 95.5 mt -60.58 -58.37 7.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.572 -176.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.53 HG22 ' H ' ' B' ' 484' ' ' GLY . 50.2 mt -56.53 -23.6 17.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.585 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.617 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 40.9 ttmt -64.41 -48.65 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -178.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.24 -13.54 15.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.895 0.379 . . . . 0.0 111.256 -175.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . 0.542 ' HB2' ' O ' ' B' ' 477' ' ' ILE . 0.6 OUTLIER -88.5 -50.13 6.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.738 177.128 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . 0.451 ' HB2' HG23 ' B' ' 478' ' ' ILE . 97.2 m-85 -119.09 -87.02 0.64 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -171.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -112.47 -50.2 2.91 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -167.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.617 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 83.82 50.23 4.49 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.258 -173.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 73.6 mt -88.32 149.08 23.96 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.741 0.305 . . . . 0.0 110.823 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 60.86 21.0 11.21 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.792 -178.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 60.4 p -144.96 -41.91 0.24 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.175 -176.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -119.59 121.89 40.35 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.453 178.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 45.9 m -56.54 126.06 24.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.077 179.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -77.91 77.16 4.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.493 0.663 . . . . 0.0 111.254 -175.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.42 24.71 0.95 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.815 178.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 20.6 m -95.17 25.18 4.42 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.412 0.625 . . . . 0.0 110.333 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -118.14 136.05 53.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.188 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -83.16 -30.63 27.68 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.292 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 3.6 p . . . . . 0 C--O 1.25 1.104 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.818 -179.793 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.779 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -57.57 -48.52 16.8 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.735 2.29 . . . . 0.0 111.878 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 -98.08 74.47 2.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.917 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 16.0 tpt -84.88 -3.54 58.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.81 0.814 . . . . 0.0 109.779 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.527 ' HB3' ' ND2' ' B' ' 468' ' ' ASN . 23.2 m-20 -81.63 3.12 26.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.643 179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.561 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 36.4 ptt180 -76.09 138.61 40.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.285 177.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 91.4 t -100.28 139.08 22.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.895 0.378 . . . . 0.0 110.651 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.1 m -65.42 138.96 58.47 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.341 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.75 -33.17 72.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.219 -176.608 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -63.17 -40.42 97.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.746 177.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.64 -41.82 98.21 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 93.3 mt -67.38 -32.21 72.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.839 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 94.3 mttt -61.35 -20.68 63.26 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -77.25 -17.9 58.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.589 0.233 . . . . 0.0 111.131 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 88.2 mt -62.63 -49.57 74.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.273 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -70.61 -14.86 72.81 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.418 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -91.02 -22.59 20.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.882 0.372 . . . . 0.0 110.961 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.657 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 33.0 t -68.49 116.64 9.27 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.386 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.69 -29.63 70.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.045 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.402 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 57.5 m -77.44 -37.46 51.53 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.813 -177.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.503 HD11 ' CD2' ' A' ' 139' ' ' PHE . 48.5 tp -75.28 -47.09 29.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.312 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -60.03 -31.43 69.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.906 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 21.3 t -66.26 -22.92 66.33 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.202 0.525 . . . . 0.0 110.228 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 100' ' ' THR . 28.0 mt -80.52 -32.55 36.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.687 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.7 mp -69.6 -10.52 58.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.96 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.52 -11.52 53.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.843 174.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -86.0 114.61 58.02 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 173.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.41 ' O ' ' HG2' ' A' ' 111' ' ' ARG . 50.4 Cg_exo -54.72 -30.04 64.85 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.947 2.431 . . . . 0.0 112.608 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -68.26 -45.08 74.15 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.901 178.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 55.3 tp -66.33 -38.61 88.06 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.75 0.31 . . . . 0.0 111.188 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 108' ' ' PRO . 5.5 ptp180 -67.35 -30.99 70.95 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.656 -0.418 . . . . 0.0 109.959 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -73.9 -32.52 63.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.819 177.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.42 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 72.3 mt -59.02 -50.73 72.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.36 176.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 60.0 mtm -56.77 -49.83 74.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.559 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.662 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 60.1 t -59.59 -46.53 93.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.153 -178.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -60.29 -48.26 82.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.024 0.44 . . . . 0.0 111.476 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 61.9 tp -62.98 -36.63 84.15 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.663 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.437 ' OD1' ' HD2' ' B' ' 475' ' ' ARG . 19.3 t70 -66.11 -33.53 76.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.865 -177.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 60.5 mt-30 -60.27 -28.72 68.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.289 0.566 . . . . 0.0 110.628 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.39 29.37 71.78 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.089 -0.959 . . . . 0.0 114.211 169.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -76.28 -55.1 5.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 117.231 0.515 . . . . 0.0 110.026 176.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -131.25 41.12 3.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.357 0.599 . . . . 0.0 110.146 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.658 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.78 -31.62 5.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.607 -1.179 . . . . 0.0 112.109 177.756 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -54.19 -58.16 8.4 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -177.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -80.02 -26.42 39.82 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.01 -178.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.471 HD22 ' CE2' ' A' ' 130' ' ' TYR . 94.9 mt -62.53 -41.54 98.94 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.5 177.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.436 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -51.75 -39.15 58.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 0.0 111.12 178.208 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 54.2 mtp180 -81.6 -43.23 18.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.769 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.64 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.86 -26.95 68.84 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.52 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.471 ' CE2' HD22 ' A' ' 126' ' ' LEU . 3.4 m-30 -80.54 -19.45 45.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.791 0.329 . . . . 0.0 111.078 -178.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 2.5 mmt -77.57 -4.92 48.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.348 -177.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.64 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.5 pt20 -100.99 -8.54 22.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.978 0.418 . . . . 0.0 110.472 178.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.54 ' O ' HG23 ' A' ' 137' ' ' VAL . 0.6 OUTLIER -94.35 118.48 67.04 Favored Pre-proline 0 N--CA 1.45 -0.472 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.74 -175.025 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.613 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 16.0 Cg_endo -56.39 -24.53 52.57 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.92 2.413 . . . . 0.0 112.168 -175.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.474 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.0 mp -71.04 -43.01 68.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.211 0.529 . . . . 0.0 109.993 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.487 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 29.7 t80 -81.97 -31.33 31.24 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.105 -176.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 133' ' ' GLU . 86.9 t -61.98 -43.53 97.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.481 177.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 48.0 mt-10 -65.97 -42.71 89.56 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.08 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . 0.503 ' CD2' HD11 ' A' ' 101' ' ' LEU . 75.5 t80 -57.21 -48.91 77.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.158 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.787 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.79 -48.17 77.99 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.562 -177.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -66.75 -26.8 67.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.192 0.52 . . . . 0.0 110.416 -174.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 94.0 m -79.72 -48.44 13.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.106 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.9 p -64.31 -29.03 70.13 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.55 0.214 . . . . 0.0 111.02 -175.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.787 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 73.8 mt -59.61 -52.83 63.84 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.508 178.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.45 -15.23 63.45 Favored Glycine 0 C--N 1.329 0.188 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.533 -176.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 64.4 mt -88.4 -26.08 5.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 120.766 0.317 . . . . 0.0 111.082 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 13.6 m -103.67 -14.1 8.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.501 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 44.8 mt-10 -71.73 118.07 63.3 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.435 176.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 148' ' ' GLU . 20.0 Cg_endo -62.7 -20.85 72.14 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.818 2.346 . . . . 0.0 111.991 178.316 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 19.5 m -78.2 103.93 8.45 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.707 174.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . 0.47 ' HA ' ' OE1' ' A' ' 151' ' ' GLN . 10.8 mm-40 -66.62 137.91 57.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.745 0.307 . . . . 0.0 110.897 -179.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -66.19 126.59 29.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.288 177.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -71.05 129.22 38.43 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.523 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -143.07 93.45 2.5 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.001 -176.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 22.4 m . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.567 -0.73 . . . . 0.0 110.448 -179.74 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 54.9 mt -60.47 -36.22 68.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.683 -174.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -58.72 -42.41 88.66 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 110.218 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -70.25 -50.36 40.5 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.809 177.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.571 ' O ' HG12 ' B' ' 470' ' ' ILE . 37.5 mt-10 -61.25 -48.28 82.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.286 -172.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . 0.436 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 37.2 mtm180 -58.32 -36.43 73.38 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . 0.527 ' ND2' ' HB3' ' A' ' 85' ' ' ASP . 0.0 OUTLIER -76.73 -27.31 55.36 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -179.062 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . 0.499 ' HA ' ' CG ' ' B' ' 472' ' ' GLN . 2.4 t -72.56 -29.54 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 114.717 -1.129 . . . . 0.0 110.513 177.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.571 HG12 ' O ' ' B' ' 466' ' ' GLU . 17.2 mm -68.62 -34.5 65.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 174.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 91.0 mt -60.48 -41.89 95.17 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.362 176.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.561 ' NE2' ' HA ' ' A' ' 86' ' ' ARG . 4.6 mm-40 -52.2 -48.38 65.1 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.61 0.719 . . . . 0.0 110.061 175.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . 0.429 ' O ' HG13 ' B' ' 477' ' ' ILE . 38.1 m -61.51 -54.06 48.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.684 -179.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 89.8 t -50.89 -49.87 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.684 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 24.1 mmm180 -67.1 -28.21 67.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.521 -176.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -76.33 -50.32 14.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.672 0.273 . . . . 0.0 110.672 178.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.429 HG13 ' O ' ' B' ' 473' ' ' CYS . 70.4 mt -63.11 -62.73 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.125 -173.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 46.3 mt -54.83 -24.7 14.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 21.8 tptm -70.98 -39.43 72.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -175.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.72 -15.6 11.9 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.82 -178.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -91.68 -59.64 2.08 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.04 0.447 . . . . 0.0 111.694 -176.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -87.32 -85.29 0.17 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.303 -170.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -107.97 -50.12 3.1 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.367 -174.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.463 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 91.69 9.06 63.17 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.577 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 76.7 mt -75.65 140.06 42.34 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.372 0.606 . . . . 0.0 111.325 -176.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -148.7 -52.01 0.17 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.173 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 5.1 t -80.73 59.7 3.74 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.561 -1.2 . . . . 0.0 110.57 177.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -121.56 152.74 38.88 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.296 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 17.1 m -69.25 -3.79 15.2 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.495 -170.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -83.08 -22.94 33.32 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.417 0.627 . . . . 0.0 110.531 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -124.24 14.49 9.02 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.032 -177.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 57.0 m -113.71 87.96 2.73 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.071 0.462 . . . . 0.0 111.101 -176.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -94.21 17.99 11.7 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.99 -54.45 47.02 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.346 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.379 -0.819 . . . . 0.0 110.633 -179.598 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.7 0 N-CA-C 112.369 -0.293 . . . . 0.0 112.369 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -67.27 -37.63 17.55 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.77 2.313 . . . . 0.0 111.564 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -93.26 -46.75 7.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.011 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 69.2 mtm -85.72 77.85 9.7 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 175.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -92.36 -15.39 27.35 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.303 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -54.86 127.77 30.13 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 121.084 0.469 . . . . 0.0 110.766 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.471 HG21 ' HB ' ' A' ' 147' ' ' VAL . 14.9 p -72.77 148.02 9.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.327 -0.852 . . . . 0.0 111.181 -174.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.4 m -68.41 144.84 54.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.281 -177.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -26.51 68.35 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.793 -175.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 24.2 pt20 -60.82 -35.3 76.18 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.135 0.493 . . . . 0.0 110.313 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -70.7 -37.57 73.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.144 177.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' B' ' 472' ' ' GLN . 61.0 mt -68.07 -37.58 81.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.149 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -61.7 -20.16 63.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.889 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -75.89 -17.75 59.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.965 0.412 . . . . 0.0 110.553 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.49 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 87.8 mt -65.94 -45.0 83.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.982 -178.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -68.9 -13.83 67.01 Favored Glycine 0 CA--C 1.52 0.344 0 CA-C-N 116.073 -0.512 . . . . 0.0 113.496 -176.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -107.31 5.9 27.96 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.122 0.487 . . . . 0.0 110.934 179.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 67.9 m -93.4 112.53 24.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.844 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.91 -26.24 68.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.543 -178.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 27.4 m -70.45 -42.24 71.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.532 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.49 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 24.0 tp -73.63 -44.83 55.96 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.889 -173.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.505 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 7.8 ptp180 -60.77 -28.32 68.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.233 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.5 t -61.66 -27.29 68.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.371 0.605 . . . . 0.0 109.861 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.448 ' O ' HD13 ' A' ' 110' ' ' LEU . 21.0 mt -83.98 -32.54 24.94 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.132 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.5 mp -75.76 2.67 11.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.14 0.495 . . . . 0.0 110.648 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 73.9 mt -79.39 -9.2 59.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.088 174.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -90.4 117.45 68.02 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.824 176.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.53 -39.55 87.72 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.159 2.573 . . . . 0.0 113.033 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -68.8 -41.96 77.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.81 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.451 ' O ' HD23 ' A' ' 110' ' ' LEU . 4.4 tt -60.15 -40.05 88.53 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -179.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.524 ' O ' HG23 ' A' ' 115' ' ' VAL . 59.7 mtm-85 -66.03 -40.53 91.1 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.419 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -63.88 -36.57 84.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.997 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.444 HD13 ' HB2' ' A' ' 136' ' ' PHE . 90.6 mt -58.62 -47.18 85.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.474 ' HB3' HD11 ' B' ' 478' ' ' ILE . 74.4 mtp -58.66 -47.45 84.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.978 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 111' ' ' ARG . 98.6 t -58.15 -42.49 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 CA-C-O 120.963 0.411 . . . . 0.0 111.188 178.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.413 ' HB2' ' OH ' ' A' ' 130' ' ' TYR . 92.3 m-20 -66.81 -44.55 80.91 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.134 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.566 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 50.7 tp -72.66 -31.09 64.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.415 -177.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.427 ' HB2' HG13 ' B' ' 478' ' ' ILE . 32.8 t70 -54.91 -44.05 73.84 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.027 0.441 . . . . 0.0 110.662 176.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 53.3 mt-30 -67.18 -30.7 70.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.008 -176.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.01 21.92 68.27 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.046 -0.979 . . . . 0.0 113.324 173.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -54.1 -50.09 67.63 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.834 0.35 . . . . 0.0 110.873 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.421 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 23.5 t0 -135.16 66.62 1.52 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.667 0.746 . . . . 0.0 109.367 172.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.648 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -52.74 -30.11 30.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.684 -1.143 . . . . 0.0 111.363 175.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.68 -40.3 96.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.807 0.337 . . . . 0.0 111.18 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -78.87 -47.92 15.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.739 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 82.3 mt -56.77 -47.1 80.87 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.635 -175.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.5 ' SD ' ' HB3' ' B' ' 467' ' ' ARG . 0.5 OUTLIER -56.03 -35.47 66.9 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -177.754 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -83.87 -44.16 14.58 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.114 0.483 . . . . 0.0 110.538 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.543 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.03 -21.17 65.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.025 -176.067 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.566 ' CE2' ' HB2' ' A' ' 117' ' ' LEU . 3.6 m-30 -81.66 -29.15 33.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.875 0.369 . . . . 0.0 111.006 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.591 ' HE2' HG12 ' A' ' 137' ' ' VAL . 2.7 mmt -77.57 -4.33 45.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.349 -176.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.543 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.9 pt20 -100.89 0.2 38.02 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 176.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -105.89 118.42 55.24 Favored Pre-proline 0 N--CA 1.449 -0.516 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.366 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.706 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 19.2 Cg_endo -60.99 -13.24 26.34 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.985 2.456 . . . . 0.0 112.108 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -71.77 -48.2 48.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.769 173.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.549 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 37.0 t80 -88.62 -29.86 19.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.829 0.347 . . . . 0.0 110.731 -169.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.706 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.9 m -56.52 -45.75 82.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.985 176.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.468 ' N ' HG23 ' A' ' 137' ' ' VAL . 34.5 mm-40 -58.32 -49.31 77.62 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.352 176.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . 0.421 ' HB2' HD11 ' A' ' 110' ' ' LEU . 76.4 t80 -54.14 -49.43 69.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.961 177.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.754 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.61 -52.73 59.6 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.28 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -62.45 -29.5 70.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.293 0.568 . . . . 0.0 110.44 -174.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 97.6 m -81.11 -46.76 14.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.605 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.418 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 29.5 p -65.28 -31.86 73.23 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.4 -177.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.754 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 65.7 mt -59.11 -41.03 87.19 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.693 178.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.411 ' HA2' ' OE2' ' A' ' 148' ' ' GLU . . . -69.41 -28.23 72.71 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.123 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 62.3 mt -80.16 -36.22 16.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-O 121.053 0.454 . . . . 0.0 110.485 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.471 ' HB ' HG21 ' A' ' 87' ' ' VAL . 19.0 m -93.61 7.44 5.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.02 -176.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.635 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 37.1 mt-10 -60.45 110.97 3.35 Favored Pre-proline 0 C--O 1.233 0.229 0 CA-C-O 120.534 0.207 . . . . 0.0 110.461 174.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . 0.446 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 69.4 Cg_endo -86.41 -2.21 8.48 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.852 2.368 . . . . 0.0 112.191 177.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 81.8 p 55.19 -169.48 0.08 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.172 -176.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 59.69 45.22 13.23 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.169 0.509 . . . . 0.0 110.416 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -57.75 130.85 48.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.041 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -86.1 156.4 20.39 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.73 -176.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 57.75 37.8 27.28 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.965 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 25.9 p . . . . . 0 C--O 1.25 1.094 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.001 179.573 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 10.0 t70 . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.94 0.4 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.53 -30.46 47.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.775 -171.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 70.1 mtm180 -61.33 -46.82 88.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.605 0.717 . . . . 0.0 109.274 177.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -64.72 -48.12 75.8 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.382 177.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.595 ' O ' HG12 ' B' ' 470' ' ' ILE . 40.4 mt-10 -59.36 -47.8 84.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.595 -177.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . 0.5 ' HB3' ' SD ' ' A' ' 127' ' ' MET . 19.8 mtm180 -63.22 -40.76 98.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.73 -25.49 53.57 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -178.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.13 -37.46 79.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.154 171.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.595 HG12 ' O ' ' B' ' 466' ' ' GLU . 36.2 mm -60.01 -36.87 69.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.125 177.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . 0.533 ' O ' ' HG2' ' B' ' 475' ' ' ARG . 93.1 mt -53.24 -49.93 65.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.387 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.482 ' HB3' HD11 ' A' ' 92' ' ' LEU . 1.9 mp0 -63.69 -40.61 97.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.922 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 61.6 m -59.04 -50.89 72.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.025 0.44 . . . . 0.0 110.035 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.643 ' O ' HG12 ' B' ' 478' ' ' ILE . 85.3 t -56.05 -58.45 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.541 175.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.533 ' HG2' ' O ' ' B' ' 471' ' ' LEU . 7.2 ptp180 -71.87 -20.2 61.84 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -169.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.53 -43.84 92.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 171.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 88.5 mt -70.14 -53.71 22.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.139 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.745 HG23 ' HB2' ' B' ' 482' ' ' PHE . 10.1 mm -53.3 -31.88 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.664 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.518 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 11.7 tppt? -53.23 -38.06 62.62 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.134 -174.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.77 -12.23 12.17 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.367 177.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -88.47 -60.61 1.92 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.352 -176.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . 0.745 ' HB2' HG23 ' B' ' 478' ' ' ILE . 98.4 m-85 -107.27 -87.22 0.48 Allowed 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.107 -0.637 . . . . 0.0 112.18 -174.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -112.41 -50.21 2.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.113 0.482 . . . . 0.0 111.199 -174.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.655 ' H ' HG22 ' B' ' 478' ' ' ILE . . . 80.83 38.56 15.8 Favored Glycine 0 N--CA 1.444 -0.827 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.668 177.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.459 HD13 HG23 ' B' ' 487' ' ' THR . 3.3 pp -108.32 149.59 28.47 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.872 0.368 . . . . 0.0 110.28 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . 0.44 ' HA ' HH12 ' B' ' 475' ' ' ARG . 32.6 m-20 -114.54 -8.54 12.75 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.732 0.301 . . . . 0.0 110.825 -177.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . 0.459 HG23 HD13 ' B' ' 485' ' ' LEU . 60.7 p 51.81 27.64 4.36 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.843 0.857 . . . . 0.0 111.843 -177.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . 0.405 HD22 ' HA ' ' B' ' 488' ' ' ASN . 10.9 m120 -127.53 -59.56 1.21 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.368 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 16.3 m -72.73 103.8 3.75 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.227 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -100.12 43.09 1.07 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.601 0.715 . . . . 0.0 109.466 176.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -94.04 17.72 11.9 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.636 -175.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 8.4 t -71.95 139.36 48.65 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 21.8 ttmm -71.88 94.91 1.48 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.013 -174.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 67.69 -60.33 0.39 Allowed 'General case' 0 N--CA 1.463 0.177 0 O-C-N 124.268 0.98 . . . . 0.0 112.44 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 24.2 t . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.018 178.813 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.792 0 N-CA-C 112.002 -0.439 . . . . 0.0 112.002 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -70.6 165.89 30.42 Favored 'Trans proline' 0 C--O 1.233 0.236 0 C-N-CA 123.183 2.588 . . . . 0.0 111.935 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -108.86 69.76 0.72 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.886 0.374 . . . . 0.0 111.161 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 48.5 tpp -81.06 151.78 28.2 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 175.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.444 ' CB ' HD21 ' B' ' 468' ' ' ASN . 19.0 m-20 62.49 40.85 10.35 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.259 0.552 . . . . 0.0 110.315 -175.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.485 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 39.8 ptt180 -75.59 150.0 38.15 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.718 -179.26 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.421 ' CG2' HG22 ' B' ' 469' ' ' VAL . 88.7 t -109.28 138.02 38.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.5 m -63.57 140.14 58.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.268 0.556 . . . . 0.0 110.887 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.524 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 10.2 tp -58.54 -40.04 81.89 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.05 -177.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -56.71 -37.44 70.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.722 178.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -67.53 -41.73 83.88 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.23 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.473 ' HA ' HD13 ' A' ' 95' ' ' LEU . 83.7 mt -69.69 -32.41 71.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.647 -176.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 9.2 mtpm? -62.82 -26.17 68.62 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -69.47 -21.5 63.7 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.734 0.302 . . . . 0.0 111.14 -177.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 92' ' ' LEU . 8.6 mp -64.54 -41.07 96.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.32 -174.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -65.69 -20.84 68.61 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.439 177.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -89.61 -22.9 22.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.72 0.295 . . . . 0.0 110.911 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.688 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 37.4 t -67.4 111.1 3.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.545 -177.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.31 -26.81 68.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.679 179.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.3 m -71.87 -48.04 48.63 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.049 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.3 tp -70.7 -46.72 62.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.793 -173.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.688 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -58.56 -29.83 66.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.876 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 33.7 t -67.16 -24.33 65.87 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.07 0.462 . . . . 0.0 110.049 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.5 mt -84.02 -36.11 23.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.678 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.479 HD21 HD13 ' B' ' 477' ' ' ILE . 11.2 mp -63.86 -22.53 66.96 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.433 177.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 76.7 mt -63.59 -16.86 62.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.971 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -79.47 120.26 79.73 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -62.41 -22.73 74.46 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 123.19 2.593 . . . . 0.0 113.013 -174.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.519 ' NE2' HD11 ' A' ' 113' ' ' LEU . 70.9 t60 -76.32 -48.9 18.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.009 178.099 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 135' ' ' LEU . 47.5 tp -61.91 -37.18 83.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.911 0.386 . . . . 0.0 111.148 -175.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -67.83 -22.16 65.16 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.56 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 10.8 mm100 -74.98 -43.15 55.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.739 176.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.541 HD21 ' OE1' ' A' ' 133' ' ' GLU . 10.5 mp -52.19 -43.88 64.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.621 0.248 . . . . 0.0 111.352 176.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.468 ' HG2' HG22 ' B' ' 474' ' ' VAL . 55.8 mtm -59.91 -53.7 54.76 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.302 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.571 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 26.4 m -68.72 -23.98 28.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 111.518 -177.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -75.84 -51.71 11.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.169 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.482 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 60.7 tp -61.05 -34.5 74.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.454 -177.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.429 ' OD2' ' HG2' ' B' ' 475' ' ' ARG . 24.5 t70 -62.66 -35.55 79.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.415 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.571 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 69.0 mt-30 -63.27 -29.6 70.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.498 0.666 . . . . 0.0 111.169 -177.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.92 25.42 71.96 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 114.54 -1.209 . . . . 0.0 114.034 174.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -67.01 -46.47 74.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.295 0.548 . . . . 0.0 110.053 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.533 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 17.8 m-20 -141.63 46.4 1.69 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.697 176.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.68 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -48.32 -32.11 6.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.999 178.371 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.23 -49.89 75.82 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.468 0.175 . . . . 0.0 111.382 -177.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.473 ' HG2' ' HB3' ' A' ' 122' ' ' ASP . 58.6 pttt -75.76 -30.63 59.23 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.143 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 91.9 mt -63.58 -43.67 96.29 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.427 -179.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.6 mmt -50.61 -36.83 36.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.929 0.395 . . . . 0.0 111.169 177.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 30.0 mmm180 -81.74 -47.23 13.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.043 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.582 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.86 -24.34 66.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.972 -176.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.482 ' CE1' ' HB2' ' A' ' 117' ' ' LEU . 3.4 m-30 -78.86 -29.7 44.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.807 0.337 . . . . 0.0 111.098 -178.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 4.7 mmt -73.51 -10.33 59.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.358 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.3 pt20 -98.99 -15.3 19.13 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.104 -179.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.541 ' OE1' HD21 ' A' ' 113' ' ' LEU . 3.7 mt-10 -87.54 119.01 70.55 Favored Pre-proline 0 N--CA 1.451 -0.406 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.611 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 14.1 Cg_endo -56.25 -23.26 44.71 Favored 'Trans proline' 0 CA--C 1.52 -0.185 0 C-N-CA 123.066 2.511 . . . . 0.0 112.453 -173.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.435 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.5 mp -72.56 -42.09 65.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.324 -178.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.49 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 31.0 t80 -76.64 -29.97 56.67 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 133' ' ' GLU . 57.5 t -61.24 -44.7 98.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.048 176.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.611 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 42.0 mt-10 -67.63 -41.34 84.06 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.323 178.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -57.11 -50.93 71.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.11 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.714 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.71 -45.1 87.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.032 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -63.48 -29.77 71.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.381 0.61 . . . . 0.0 110.588 -174.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.445 ' O ' HG13 ' A' ' 146' ' ' ILE . 89.1 m -82.79 -47.86 11.45 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.359 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 29.1 p -62.92 -32.33 73.6 Favored 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 121.177 -0.209 . . . . 0.0 111.383 -174.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 79.3 mt -65.68 -26.87 67.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.809 0.338 . . . . 0.0 111.092 -178.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -85.87 -14.84 66.53 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.013 177.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 142' ' ' CYS . 32.5 mt -91.63 -42.96 13.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.867 0.365 . . . . 0.0 110.892 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.428 ' CG1' HD11 ' A' ' 95' ' ' LEU . 20.4 m -90.61 7.76 4.1 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.884 -174.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -58.75 119.72 39.6 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 121.128 0.49 . . . . 0.0 110.53 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -68.14 -28.73 34.08 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.734 2.289 . . . . 0.0 111.746 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 16.3 t 52.25 66.03 1.33 Allowed 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.745 0.653 . . . . 0.0 110.874 174.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . 0.495 ' HB2' ' HG3' ' A' ' 153' ' ' GLU . 44.7 mt-30 -110.12 31.96 5.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.141 -177.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 62.6 24.53 14.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.767 -177.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.495 ' HG3' ' HB2' ' A' ' 151' ' ' GLN . 0.0 OUTLIER -109.92 164.05 12.96 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.023 -179.113 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -98.12 120.63 38.86 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.519 -177.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 18.3 m . . . . . 0 C--O 1.249 1.049 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.11 176.964 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 3.5 t70 . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 121.111 0.481 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 47.9 mt -64.02 -36.18 75.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.459 -168.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . 0.475 ' HD3' ' N ' ' B' ' 465' ' ' HIS . 0.0 OUTLIER -75.19 -28.94 60.2 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.57 -176.21 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . 0.485 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 13.4 t60 -76.24 -45.33 33.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.132 173.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -63.17 -30.48 71.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . 0.444 ' O ' HD23 ' B' ' 471' ' ' LEU . 32.8 mtp180 -63.31 -55.07 27.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.613 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . 0.485 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -70.93 -18.57 62.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.829 0.823 . . . . 0.0 109.997 -174.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . 0.421 HG22 ' CG2' ' A' ' 87' ' ' VAL . 1.3 t -73.08 -20.2 18.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.52 178.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.49 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 35.8 mm -72.84 -37.35 54.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 122.188 0.994 . . . . 0.0 108.4 -178.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . 0.612 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.5 OUTLIER -51.28 -48.86 62.11 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 113.166 -1.834 . . . . 0.0 110.546 177.152 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.485 ' NE2' ' HA ' ' A' ' 86' ' ' ARG . 3.6 mm-40 -46.74 -54.23 10.16 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.798 -1.092 . . . . 0.0 110.498 174.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 33.0 m -60.79 -54.11 49.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.668 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.468 HG22 ' HG2' ' A' ' 114' ' ' MET . 75.7 t -48.61 -54.79 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.905 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.6 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 52.2 mtt180 -74.31 -19.8 60.35 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.883 -0.598 . . . . 0.0 112.402 -171.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -74.54 -45.7 43.91 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 172.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.479 HD13 HD21 ' A' ' 105' ' ' LEU . 92.2 mt -64.46 -55.11 23.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.772 -177.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.42 HG13 ' O ' ' B' ' 474' ' ' VAL . 52.4 mt -54.06 -26.18 14.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.059 0.457 . . . . 0.0 111.084 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.6 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 1.6 tppp? -73.04 -42.11 63.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.926 -172.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . 0.424 ' HD3' ' N ' ' B' ' 481' ' ' ASP . 0.0 OUTLIER -111.84 -15.66 13.32 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.451 -0.5 . . . . 0.0 111.876 -176.636 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . 0.424 ' N ' ' HD3' ' B' ' 480' ' ' LYS . 13.3 t70 -92.96 -59.73 1.98 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.162 0.506 . . . . 0.0 111.437 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -85.97 -85.95 0.15 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.582 -169.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -110.8 -46.15 3.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.1 0.476 . . . . 0.0 111.741 -169.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.443 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 93.98 1.07 65.51 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.519 -177.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 2.7 pp -94.44 173.01 7.84 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.592 0.234 . . . . 0.0 110.507 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -144.38 68.21 1.26 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.787 0.803 . . . . 0.0 110.128 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 7.7 p -78.9 61.29 3.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.865 -175.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -117.31 -13.91 10.42 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.673 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 15.0 m -84.73 100.42 11.49 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.156 0.503 . . . . 0.0 110.794 -176.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -114.62 83.81 1.96 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.199 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -110.73 18.92 19.14 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.148 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 16.1 m -120.86 55.75 1.03 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.154 0.502 . . . . 0.0 110.019 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -98.02 45.73 1.02 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.425 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -91.51 -50.21 5.91 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 175.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 C--O 1.247 0.925 0 CA-C-O 118.566 -0.73 . . . . 0.0 109.935 178.144 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.695 0 N-CA-C 112.101 -0.4 . . . . 0.0 112.101 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -63.09 -12.3 29.2 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 123.197 2.598 . . . . 0.0 113.39 -176.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 56.2 p-80 -65.46 -24.13 67.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.811 0.338 . . . . 0.0 110.936 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 47.9 tpp -103.66 87.46 2.83 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 177.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -79.97 -39.46 30.06 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.358 -175.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 -84.87 142.19 29.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.222 0.534 . . . . 0.0 110.486 -178.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 39.7 t -81.84 131.67 33.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.614 -172.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.3 m -63.98 144.82 56.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.468 176.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.533 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.85 -34.22 74.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.705 -173.892 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -61.24 -40.93 95.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.711 -0.222 . . . . 0.0 110.742 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -63.34 -39.42 94.49 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.576 ' HA ' HD13 ' A' ' 95' ' ' LEU . 88.2 mt -69.06 -32.42 71.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.64 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 97.4 mttt -58.04 -27.32 63.48 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -178.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.444 ' HB2' HG22 ' A' ' 146' ' ' ILE . 24.0 m-80 -72.64 -18.63 61.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.797 0.332 . . . . 0.0 111.277 -178.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.576 HD13 ' HA ' ' A' ' 92' ' ' LEU . 7.4 mp -71.02 -40.58 71.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.113 -175.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -63.05 -21.07 63.33 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.693 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -108.71 6.51 25.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.064 0.459 . . . . 0.0 110.739 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.625 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 41.9 t -76.96 108.54 10.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.24 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.14 67.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.131 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 90.1 m -71.7 -43.87 65.18 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.185 0.517 . . . . 0.0 110.78 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.542 HD12 HD11 ' A' ' 104' ' ' LEU . 21.4 tp -71.09 -49.56 43.15 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.446 -171.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.625 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.0 ptp180 -57.72 -32.07 67.05 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.327 -179.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 67.5 m -62.95 -40.23 97.02 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.542 HD11 HD12 ' A' ' 101' ' ' LEU . 0.5 OUTLIER -88.56 -15.75 34.35 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.508 -0.877 . . . . 0.0 112.161 -178.965 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.47 HD13 ' O ' ' A' ' 101' ' ' LEU . 8.7 mp -68.74 -12.06 61.01 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.194 0.521 . . . . 0.0 110.591 171.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 80.1 mt -73.14 -13.42 61.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.021 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -74.03 123.7 89.47 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.865 176.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.5 -30.34 90.52 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.111 2.54 . . . . 0.0 112.763 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -78.77 -41.29 30.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.657 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 104' ' ' LEU . 5.0 tt -63.18 -42.48 99.39 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -68.06 -27.19 66.3 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.151 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -70.84 -43.07 69.3 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.187 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.494 HD13 ' HB2' ' A' ' 136' ' ' PHE . 85.8 mt -56.11 -51.77 66.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.315 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 59.7 mtp -54.28 -54.15 44.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.829 -179.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.648 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.8 m -65.89 -34.45 70.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.343 -176.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -62.86 -46.36 88.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.086 0.47 . . . . 0.0 110.61 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.45 ' HB2' ' CE2' ' A' ' 130' ' ' TYR . 62.7 tp -64.47 -36.39 84.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.621 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.41 -36.74 84.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.802 177.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.648 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 75.7 mt-30 -68.2 -32.15 72.17 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.868 0.842 . . . . 0.0 110.508 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 66.11 27.08 72.63 Favored Glycine 0 N--CA 1.447 -0.567 0 CA-C-N 114.145 -1.389 . . . . 0.0 113.18 175.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.67 -32.38 59.18 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.176 0.512 . . . . 0.0 110.806 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.499 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 15.4 t0 -160.52 69.23 0.37 Allowed 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 168.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.512 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -55.31 -26.77 42.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.007 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.75 -49.39 73.22 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.057 0.456 . . . . 0.0 110.596 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.0 -38.03 66.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.557 178.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 95.4 mt -61.65 -46.67 88.79 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.162 -177.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -54.88 -33.86 62.4 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.006 0.431 . . . . 0.0 111.187 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -79.34 -49.08 12.96 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.449 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.679 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.45 -27.03 67.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.057 -176.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.592 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 3.2 m-30 -79.26 -27.54 42.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.877 0.37 . . . . 0.0 111.436 -176.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.513 ' HE2' HG12 ' A' ' 137' ' ' VAL . 3.3 mmt -86.13 3.42 42.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.821 0.344 . . . . 0.0 111.574 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.679 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.8 pt20 -100.56 -19.61 16.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.039 0.447 . . . . 0.0 109.965 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -105.36 137.45 19.27 Favored Pre-proline 0 N--CA 1.448 -0.548 0 CA-C-O 121.393 0.616 . . . . 0.0 111.688 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.674 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 56.4 Cg_endo -68.45 -11.87 33.19 Favored 'Trans proline' 0 CA--C 1.527 0.144 0 C-N-CA 123.904 3.069 . . . . 0.0 113.974 -173.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 45.5 mt -77.8 -37.62 48.33 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.427 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.592 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 45.5 t80 -88.98 -32.1 17.8 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.573 -173.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.674 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 10.5 m -54.87 -44.89 74.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.831 176.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 25.7 mm-40 -57.62 -50.29 73.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.433 176.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -54.94 -48.93 72.51 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.211 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.762 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.28 -49.55 71.37 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.052 -0.977 . . . . 0.0 111.019 -177.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.71 -31.11 72.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.218 0.532 . . . . 0.0 110.55 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.547 ' O ' HG13 ' A' ' 146' ' ' ILE . 65.4 m -70.61 -47.72 58.72 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.018 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 28.3 p -67.5 -30.98 70.8 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.526 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.762 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.8 mt -65.71 -27.95 68.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.708 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -83.24 -14.67 73.78 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.226 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 142' ' ' CYS . 21.1 mt -91.8 -40.83 12.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.199 0.523 . . . . 0.0 110.505 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 15.3 m -94.75 7.5 6.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.398 -177.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -53.9 126.82 51.89 Favored Pre-proline 0 C--O 1.234 0.252 0 CA-C-O 121.369 0.604 . . . . 0.0 112.112 -173.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.81 -3.17 13.51 Favored 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 122.936 2.424 . . . . 0.0 111.295 175.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 3.4 p -84.18 16.7 2.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.497 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . 0.511 ' HA ' HE21 ' A' ' 151' ' ' GLN . 0.0 OUTLIER -70.69 127.15 31.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.673 176.616 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -69.74 129.5 39.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.799 0.333 . . . . 0.0 110.203 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -77.6 129.94 36.25 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.854 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -71.29 96.51 1.44 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.143 0.497 . . . . 0.0 110.37 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 3.1 p . . . . . 0 C--O 1.248 1.017 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.394 179.355 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 . . . . . 0 N--CA 1.48 1.033 0 CA-C-O 121.066 0.46 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 29.4 mm -85.82 -19.89 8.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 -176.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -57.76 -35.46 70.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.915 0.388 . . . . 0.0 110.769 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -69.95 -48.9 56.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.962 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.456 ' O ' HG12 ' B' ' 470' ' ' ILE . 6.5 mm-40 -55.91 -50.42 70.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.93 -178.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -59.92 -40.86 90.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.396 -176.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -79.0 -23.46 44.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.382 0.61 . . . . 0.0 109.666 -178.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.1 t -65.32 -32.15 56.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.422 173.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.456 HG12 ' O ' ' B' ' 466' ' ' GLU . 26.3 mm -61.94 -29.87 47.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.391 179.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 83.7 mt -63.53 -31.86 73.15 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.881 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -71.7 -35.22 70.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.059 0.457 . . . . 0.0 110.092 176.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 45.4 m -72.7 -59.08 2.89 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.077 -177.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.41 ' O ' HG13 ' B' ' 478' ' ' ILE . 11.5 p -54.95 -45.34 76.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.085 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 18.8 tpp85 -65.68 -35.17 80.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.634 0.254 . . . . 0.0 110.96 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.06 -47.88 78.42 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 120.687 0.28 . . . . 0.0 110.65 -179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 50.6 mt -67.55 -55.4 17.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.846 -174.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.738 HG23 ' HB2' ' B' ' 482' ' ' PHE . 46.3 mt -58.52 -25.55 28.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.156 -175.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.531 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 22.8 tptp -65.09 -34.6 78.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.219 -173.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . 0.46 ' HD2' ' H ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER -116.46 -15.47 10.9 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.884 176.372 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -89.57 -57.17 2.97 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . 0.738 ' HB2' HG23 ' B' ' 478' ' ' ILE . 69.7 m-85 -89.64 -89.68 0.15 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.776 -172.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -100.91 -47.74 4.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.851 0.358 . . . . 0.0 111.093 -173.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.523 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 95.47 3.62 61.2 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.668 176.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' B' ' 485' ' ' LEU . 3.1 pp -94.8 159.71 14.93 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.407 0.622 . . . . 0.0 111.383 -174.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -153.49 -12.81 0.15 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.958 177.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 13.4 t -83.64 -11.49 57.2 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.823 178.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -93.19 -160.12 0.73 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 42.3 m 64.51 18.38 11.33 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.814 0.696 . . . . 0.0 111.048 -178.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -95.79 3.44 53.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.835 177.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -83.1 19.13 1.49 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.158 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 17.0 t -79.61 134.45 36.45 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -78.1 92.5 4.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.988 0.423 . . . . 0.0 110.815 -175.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -107.59 -51.83 2.85 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.909 179.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 2.9 m . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.794 178.563 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.587 0 N-CA-C 111.655 -0.578 . . . . 0.0 111.655 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -69.57 124.17 10.89 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.4 2.067 . . . . 0.0 111.956 178.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -128.56 123.05 32.43 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.078 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 17.1 ptp -78.29 73.92 4.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.5 0.667 . . . . 0.0 110.676 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -67.22 -29.16 68.73 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -91.29 140.11 30.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.154 171.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 24.5 t -80.55 134.72 26.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.099 -173.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.1 m -67.58 144.34 55.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.981 176.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.523 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 1.6 tt -62.32 -33.38 74.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.994 -173.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -56.01 -43.66 77.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.665 174.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -68.66 -28.09 66.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.412 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 90.7 mt -78.68 -35.26 45.43 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.622 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 50.1 mtpt -57.72 -29.49 64.77 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -178.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -73.22 -18.66 61.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.606 0.241 . . . . 0.0 111.082 -176.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.512 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 82.1 mt -62.67 -47.16 84.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.032 -175.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.93 -15.36 81.03 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.259 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 93' ' ' LYS . 17.4 mm-40 -95.5 -16.0 22.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.15 0.5 . . . . 0.0 110.397 -177.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.61 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 33.0 t -77.49 121.31 23.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.967 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.45 -27.62 67.95 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.629 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.6 m -69.24 -45.93 68.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.225 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.512 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 38.8 tp -71.11 -46.97 60.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.57 -173.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 98' ' ' SER . 8.9 ptp180 -60.29 -27.27 67.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.534 -178.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 66.6 m -62.99 -22.88 67.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.974 0.416 . . . . 0.0 110.662 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 110' ' ' LEU . 17.5 mt -86.57 -34.38 19.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.32 0.581 . . . . 0.0 109.717 178.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.485 HD21 HD13 ' B' ' 477' ' ' ILE . 9.3 mp -64.1 -18.37 64.34 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.612 178.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 63.7 mt -66.06 -21.02 66.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.293 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -78.39 118.1 70.24 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.265 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.4 -36.66 97.54 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 123.069 2.512 . . . . 0.0 112.589 178.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.3 t60 -68.29 -44.06 76.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.86 0.362 . . . . 0.0 110.558 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 104' ' ' LEU . 4.4 tt -65.59 -46.01 81.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.277 -176.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.419 ' O ' HG23 ' A' ' 115' ' ' VAL . 13.5 ptp180 -64.47 -34.18 77.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.491 -179.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -66.65 -34.97 79.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.947 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.3 mt -59.47 -48.59 81.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.129 0.49 . . . . 0.0 109.717 174.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 68.6 mtp -55.75 -52.09 65.14 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.973 176.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.494 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 84.0 t -60.25 -38.83 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.542 -179.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -64.56 -43.01 95.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.07 0.462 . . . . 0.0 111.071 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 56.4 tp -67.55 -38.41 84.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.57 -177.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.435 ' HB2' HD12 ' B' ' 478' ' ' ILE . 23.8 t0 -63.97 -27.83 69.4 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.084 0.469 . . . . 0.0 111.375 -175.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 70.9 mt-30 -63.19 -29.77 71.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.516 0.674 . . . . 0.0 110.785 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.5 29.3 72.93 Favored Glycine 0 CA--C 1.518 0.226 0 CA-C-N 114.551 -1.204 . . . . 0.0 114.239 172.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -73.1 -55.45 6.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.568 0.699 . . . . 0.0 109.526 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -135.16 50.85 2.12 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.502 176.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.598 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -48.68 -37.57 18.89 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 113.505 -1.679 . . . . 0.0 111.961 179.003 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.16 -46.53 77.1 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.908 0.385 . . . . 0.0 110.866 -176.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -65.57 -41.91 92.39 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.183 177.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.475 HD22 ' CE2' ' A' ' 130' ' ' TYR . 95.5 mt -62.63 -43.67 98.22 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.572 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -34.67 65.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.933 0.397 . . . . 0.0 111.142 -178.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.9 mmm180 -77.01 -46.09 25.04 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.007 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.93 -38.65 86.56 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.421 -178.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.475 ' CE2' HD22 ' A' ' 126' ' ' LEU . 3.2 m-30 -72.31 -21.78 61.28 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.865 -174.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.448 ' HE2' HG12 ' A' ' 137' ' ' VAL . 3.6 mmt -79.43 -1.23 36.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.14 -179.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -98.79 -20.03 17.11 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 175.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -88.17 120.89 70.72 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.733 -175.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.678 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 27.9 Cg_endo -62.2 -14.11 36.13 Favored 'Trans proline' 0 N--CA 1.465 -0.157 0 C-N-CA 122.863 2.375 . . . . 0.0 112.671 -175.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.3 mp -77.32 -40.26 44.88 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.592 176.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.425 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 32.8 t80 -88.74 -31.01 18.63 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.066 -172.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.678 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 16.6 m -58.47 -49.11 83.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.246 177.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.53 ' N ' HG23 ' A' ' 137' ' ' VAL . 11.0 pt-20 -70.96 -36.64 72.64 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.558 179.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -56.29 -48.07 77.36 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 174.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.779 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.46 -49.78 74.07 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.726 178.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -62.09 -30.76 71.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.209 0.528 . . . . 0.0 110.627 -175.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 64.6 m -77.3 -45.29 26.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.537 -179.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.437 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.3 p -69.33 -28.11 65.96 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.861 0.362 . . . . 0.0 110.53 -177.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 83.3 mt -62.13 -31.3 71.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.69 178.163 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.534 ' HA2' ' OE2' ' A' ' 148' ' ' GLU . . . -79.87 -17.69 74.36 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.452 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 49.0 mt -91.16 -26.24 5.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.109 0.48 . . . . 0.0 110.569 -179.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.408 HG13 HD21 ' A' ' 95' ' ' LEU . 17.3 m -104.05 -3.43 9.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.599 -177.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.534 ' OE2' ' HA2' ' A' ' 145' ' ' GLY . 12.7 pt-20 -71.66 124.32 90.73 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.255 0.55 . . . . 0.0 110.393 -178.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.9 -8.35 23.42 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 122.891 2.394 . . . . 0.0 111.452 177.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 5.4 p -86.82 57.48 4.53 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.307 177.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . 0.415 ' HA ' ' OE1' ' A' ' 151' ' ' GLN . 15.9 mm-40 -71.97 85.8 0.99 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.609 -179.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 67.68 109.64 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.168 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -88.62 -29.68 19.78 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.479 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -138.05 111.81 8.28 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.165 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.616 -0.706 . . . . 0.0 110.225 179.223 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 47.3 mm -57.83 -40.12 74.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.071 -173.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -58.56 -43.36 89.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.886 0.375 . . . . 0.0 110.772 178.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -64.12 -48.83 74.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.067 175.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.58 ' O ' HG12 ' B' ' 470' ' ' ILE . 43.4 mt-10 -60.14 -43.83 95.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.45 -176.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -58.78 -39.97 82.62 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -30.89 60.23 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.5 t -62.46 -35.51 70.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.584 176.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.58 HG12 ' O ' ' B' ' 466' ' ' GLU . 31.6 mm -63.41 -34.85 69.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.493 178.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 82.8 mt -57.44 -42.5 82.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.691 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -62.78 -43.11 99.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.441 177.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 56.1 m -63.65 -55.5 23.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.752 -178.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.455 ' O ' HG13 ' B' ' 478' ' ' ILE . 75.0 t -51.16 -55.7 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.868 178.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -68.85 -32.13 71.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.582 -172.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -61.14 -47.03 88.13 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 120.962 0.41 . . . . 0.0 109.941 177.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.485 HD13 HD21 ' A' ' 105' ' ' LEU . 79.6 mt -63.54 -53.34 46.4 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.099 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.798 HG23 ' HB2' ' B' ' 482' ' ' PHE . 49.9 mt -58.63 -26.76 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.868 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.525 ' HA ' ' CA ' ' B' ' 484' ' ' GLY . 27.0 tptp -57.7 -41.31 81.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.736 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.19 -16.8 14.5 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.872 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -89.55 -59.32 2.24 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.742 0.306 . . . . 0.0 111.523 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . 0.798 ' HB2' HG23 ' B' ' 478' ' ' ILE . 83.3 m-85 -107.63 -90.43 0.44 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.767 -172.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -113.48 -50.24 2.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.682 0.277 . . . . 0.0 111.1 -172.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.765 ' H ' HG22 ' B' ' 478' ' ' ILE . . . 79.43 51.19 5.35 Favored Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.305 -0.95 . . . . 0.0 111.404 -177.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 85.9 mt -72.78 169.35 16.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.276 0.56 . . . . 0.0 111.593 -176.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -140.26 23.34 2.36 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.155 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 44.5 p 51.42 35.88 15.22 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.971 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -113.08 92.11 3.89 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.776 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . 0.402 ' OG ' ' HE2' ' B' ' 491' ' ' LYS . 6.2 p -87.13 145.43 26.44 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.679 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -81.58 56.62 3.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.191 0.52 . . . . 0.0 111.297 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . 0.402 ' HE2' ' OG ' ' B' ' 489' ' ' SER . 66.4 mttm -78.65 93.67 4.92 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.593 177.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 11.0 t 62.97 30.32 16.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.081 -176.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 1.1 tmmm? -86.93 88.98 7.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.698 -178.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -100.89 -57.5 2.09 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.993 0.425 . . . . 0.0 109.868 177.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 47.6 t . . . . . 0 C--O 1.251 1.133 0 CA-C-O 118.436 -0.792 . . . . 0.0 110.149 179.161 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.645 0 N-CA-C 111.475 -0.65 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -67.61 76.85 0.54 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 123.1 2.533 . . . . 0.0 112.142 177.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -141.81 46.29 1.67 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.283 0.563 . . . . 0.0 109.781 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.406 ' O ' ' HE1' ' B' ' 465' ' ' HIS . 57.7 ttp -106.7 -23.42 12.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.959 -179.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -71.47 -56.98 4.86 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.183 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -91.35 129.14 37.37 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 173.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.545 HG21 ' HB ' ' A' ' 147' ' ' VAL . 12.0 p -84.16 154.11 3.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.168 -173.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.7 m -59.36 141.33 54.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.467 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 92' ' ' LEU . 3.2 tt -68.03 -30.97 70.32 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.865 -178.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -54.25 -43.97 71.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.48 173.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.438 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 2.8 m-20 -63.31 -35.63 81.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.137 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 89' ' ' LEU . 44.6 mt -71.01 -34.47 71.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.194 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.449 ' NZ ' ' HB3' ' A' ' 93' ' ' LYS . 9.8 mtpm? -59.64 -24.13 63.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.317 -0.401 . . . . 0.0 112.053 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -77.42 -17.44 58.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.177 -179.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.556 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 91.8 mt -62.7 -46.02 90.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.438 -176.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.66 -18.32 69.99 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.622 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -84.67 -16.19 42.73 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.938 0.399 . . . . 0.0 110.608 -179.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.646 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.7 t -78.27 122.07 25.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.084 -176.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.51 -25.2 63.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.428 177.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 97.2 m -72.78 -45.2 59.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.919 178.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.556 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 36.2 tp -69.45 -51.26 37.83 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.766 -172.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.646 ' HG2' ' O ' ' A' ' 98' ' ' SER . 6.2 ptp180 -58.45 -29.5 66.2 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.974 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 33.3 t -62.05 -42.67 99.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -178.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.682 HD21 ' SG ' ' A' ' 142' ' ' CYS . 0.5 OUTLIER -87.96 -16.2 34.46 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.261 -178.608 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.495 HD13 ' O ' ' A' ' 101' ' ' LEU . 9.4 mp -69.36 -12.22 61.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.179 0.514 . . . . 0.0 110.541 171.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 83.1 mt -73.09 -17.63 61.39 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.792 178.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -71.0 118.75 68.44 Favored Pre-proline 0 C--O 1.234 0.256 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.34 -32.37 71.71 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 123.063 2.509 . . . . 0.0 112.755 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -71.56 -49.86 36.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.534 0.206 . . . . 0.0 110.849 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.57 HD21 ' HB2' ' A' ' 139' ' ' PHE . 33.2 tp -63.51 -43.17 97.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 120.774 0.321 . . . . 0.0 111.077 -176.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -66.15 -30.59 71.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.182 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . 0.557 ' HA ' HE21 ' A' ' 112' ' ' GLN . 0.0 OUTLIER -72.33 -39.3 68.29 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.654 175.86 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 72.4 mt -56.72 -50.24 72.78 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.405 ' HG2' HG23 ' B' ' 474' ' ' VAL . 57.5 mtp -53.94 -55.51 26.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.904 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.625 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 34.5 m -67.21 -23.89 31.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -176.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 57.3 m-20 -72.22 -38.81 68.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.189 0.519 . . . . 0.0 110.69 177.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.27 -43.61 81.4 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.521 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -61.61 -16.55 49.31 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.604 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.625 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 77.6 mt-30 -74.43 -29.73 61.61 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 65.4 14.93 60.62 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 114.578 -1.192 . . . . 0.0 113.908 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -55.14 -55.03 35.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.475 0.655 . . . . 0.0 110.186 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -135.09 55.8 1.87 Allowed 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.909 175.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.635 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -49.96 -30.52 10.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.388 -1.278 . . . . 0.0 111.933 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.86 -53.06 61.08 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.724 0.297 . . . . 0.0 111.09 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -75.72 -28.75 58.67 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.494 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.487 HD22 ' CE2' ' A' ' 130' ' ' TYR . 94.6 mt -64.25 -48.71 74.74 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.41 178.016 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.95 -40.21 60.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.951 0.405 . . . . 0.0 111.403 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -79.26 -44.84 20.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.972 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.588 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.99 -26.88 65.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.693 -176.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.487 ' CE2' HD22 ' A' ' 126' ' ' LEU . 4.3 m-30 -76.85 -29.44 55.86 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.93 0.395 . . . . 0.0 110.992 -178.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.424 ' HA ' ' CE ' ' A' ' 131' ' ' MET . 1.4 mmt -76.33 -2.79 33.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.89 -175.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.588 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.3 pt20 -103.96 -8.11 19.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.085 0.469 . . . . 0.0 110.416 176.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.472 ' O ' HG23 ' A' ' 137' ' ' VAL . 7.3 mt-10 -95.08 118.85 66.48 Favored Pre-proline 0 N--CA 1.449 -0.522 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 -178.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.472 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 19.7 Cg_endo -58.47 -21.39 53.8 Favored 'Trans proline' 0 CA--C 1.519 -0.244 0 C-N-CA 122.826 2.351 . . . . 0.0 111.976 -177.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.37 -39.02 81.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.28 177.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -87.86 -29.15 21.13 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.225 -178.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 133' ' ' GLU . 86.4 t -62.82 -44.06 99.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.696 177.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 14.0 pt-20 -67.76 -32.88 73.79 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.404 179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . 0.57 ' HB2' HD21 ' A' ' 110' ' ' LEU . 30.6 t80 -61.91 -52.73 62.91 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.062 0.458 . . . . 0.0 109.948 174.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.702 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -59.6 -42.75 93.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.175 -178.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -62.72 -33.04 74.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.418 0.628 . . . . 0.0 110.427 -175.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.682 ' SG ' HD21 ' A' ' 104' ' ' LEU . 89.4 m -75.74 -47.93 23.94 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.167 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.544 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 22.4 p -67.58 -32.81 73.82 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.933 -176.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.3 mt -69.56 -27.16 64.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.063 -179.099 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -79.29 -20.64 69.09 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.465 -0.874 . . . . 0.0 111.807 177.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 65.5 mt -91.04 -35.89 7.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.84 0.352 . . . . 0.0 111.342 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.545 ' HB ' HG21 ' A' ' 87' ' ' VAL . 30.9 m -83.2 5.24 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.309 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -79.24 110.54 15.3 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 170.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -66.16 -37.08 26.43 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.957 2.438 . . . . 0.0 112.373 -177.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 18.0 m -117.4 99.39 6.97 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . 0.45 ' HA ' ' OE1' ' A' ' 151' ' ' GLN . 14.6 mm-40 -64.77 105.92 1.1 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.185 0.517 . . . . 0.0 110.861 -176.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 -115.99 125.51 52.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.624 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.463 ' H ' ' CD ' ' A' ' 153' ' ' GLU . 2.8 mp0 -64.21 129.01 38.26 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.829 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -82.1 43.1 0.77 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.563 0.696 . . . . 0.0 110.543 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.248 0.988 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.545 -179.536 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . 0.639 ' O ' ' HG2' ' B' ' 466' ' ' GLU . 10.9 t70 . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 121.474 0.654 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 43.0 mm -68.19 -37.98 78.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.354 -170.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -70.83 -25.28 62.77 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.198 -176.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . 0.514 ' HD2' ' OE1' ' B' ' 466' ' ' GLU . 49.8 t60 -74.17 -50.92 17.18 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.366 174.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.639 ' HG2' ' O ' ' B' ' 462' ' ' ASP . 54.7 mm-40 -54.86 -44.63 74.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.07 -175.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -59.0 -35.51 73.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.994 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -31.1 54.94 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -178.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.1 -36.67 78.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.722 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.574 HG12 ' O ' ' B' ' 466' ' ' GLU . 28.3 mm -60.99 -36.91 75.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.346 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 90.3 mt -57.13 -44.24 83.13 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.809 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.48 ' HB3' HD11 ' A' ' 92' ' ' LEU . 2.1 mp0 -62.71 -38.9 92.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.663 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . 0.425 ' O ' HG13 ' B' ' 477' ' ' ILE . 60.5 m -66.72 -59.9 3.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.175 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.405 HG23 ' HG2' ' A' ' 114' ' ' MET . 10.3 p -54.36 -43.78 63.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.04 -179.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.529 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 73.6 mtp180 -67.65 -30.29 69.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.523 0.202 . . . . 0.0 111.373 -177.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . 0.413 ' CZ ' ' HE2' ' B' ' 480' ' ' LYS . 0.5 OUTLIER -68.77 -46.83 67.74 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.09 0.471 . . . . 0.0 109.929 176.42 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.456 HD13 HD21 ' A' ' 105' ' ' LEU . 56.5 mt -64.55 -51.82 62.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.257 -175.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.49 HG23 ' HB2' ' B' ' 482' ' ' PHE . 61.8 mt -56.59 -24.85 19.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.758 177.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.64 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 13.4 ttmm -71.23 -32.85 69.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.87 -173.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . 0.413 ' HE2' ' CZ ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER -115.86 -16.57 11.15 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.795 -0.762 . . . . 0.0 112.308 176.842 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -92.0 -57.39 2.74 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.005 0.431 . . . . 0.0 111.944 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . 0.49 ' HB2' HG23 ' B' ' 478' ' ' ILE . 96.4 m-85 -97.41 -92.86 0.23 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.168 -171.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -84.84 -48.66 9.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.272 0.558 . . . . 0.0 111.267 -172.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.64 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 89.24 11.47 64.63 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.362 -0.836 . . . . 0.0 113.436 177.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 3.4 pp -115.3 160.04 20.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.942 0.401 . . . . 0.0 111.476 -174.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -125.39 -43.95 1.89 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.701 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 3.5 t -127.8 64.26 1.37 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.958 0.885 . . . . 0.0 110.387 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -122.64 -64.24 1.2 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.826 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 19.4 m -90.34 11.41 21.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.52 -173.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -91.57 16.45 10.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.573 -176.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -108.77 -168.45 1.35 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.254 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 55.4 m 68.19 36.32 3.23 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.509 173.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -97.72 13.83 28.95 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.337 0.589 . . . . 0.0 110.617 176.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -105.11 -3.77 22.66 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.848 -178.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 C--O 1.246 0.896 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.658 -178.002 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.933 0 N-CA-C 111.915 -0.474 . . . . 0.0 111.915 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.28 112.07 1.06 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.082 2.521 . . . . 0.0 112.115 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 62.23 25.66 15.35 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.831 0.824 . . . . 0.0 109.927 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 51.1 ttm -142.39 62.96 1.41 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.145 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -84.11 -20.13 33.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.206 -178.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.0 ptp180 -79.58 146.75 32.41 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 173.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.4 p -110.46 160.89 9.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.771 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.0 m -72.41 164.58 26.12 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.783 0.325 . . . . 0.0 111.593 -177.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.442 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -69.82 -38.76 76.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.503 -176.652 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -53.1 -42.05 65.56 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.116 0.484 . . . . 0.0 110.877 177.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.46 ' O ' HG12 ' A' ' 147' ' ' VAL . 3.1 m-20 -67.02 -23.08 65.87 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.999 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.51 ' HA ' HD13 ' A' ' 95' ' ' LEU . 81.2 mt -87.17 -34.37 19.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.098 0.475 . . . . 0.0 110.753 177.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 2.6 mmmp? -56.72 -36.51 69.8 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.432 HD21 ' HA ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -73.76 -15.81 61.19 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -174.273 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.51 HD13 ' HA ' ' A' ' 92' ' ' LEU . 8.3 mp -63.46 -42.9 98.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.81 0.338 . . . . 0.0 110.834 -178.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -71.08 -13.26 72.72 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.711 176.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -94.27 -11.3 30.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.238 0.542 . . . . 0.0 109.779 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.644 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 40.4 t -81.61 113.08 19.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.578 -176.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.83 -25.65 67.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.62 178.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 63.3 m -71.29 -46.06 61.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.054 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.419 HD11 ' CD2' ' A' ' 139' ' ' PHE . 61.1 tp -72.3 -45.98 57.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.563 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.3 ptp180 -58.59 -31.05 67.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.116 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.432 ' HA ' HD23 ' A' ' 106' ' ' LEU . 37.6 t -62.54 -22.5 66.36 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.228 0.537 . . . . 0.0 110.423 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.452 HD11 ' SG ' ' A' ' 142' ' ' CYS . 21.7 mt -84.44 -31.71 24.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.876 178.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.24 -2.1 17.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.203 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.2 mm? -67.28 -18.43 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.836 0.351 . . . . 0.0 110.235 172.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -84.84 115.41 60.78 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.902 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.36 -37.89 92.98 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.776 2.317 . . . . 0.0 111.879 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.483 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 66.7 t60 -60.28 -46.95 88.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.724 177.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.448 ' O ' HD23 ' A' ' 110' ' ' LEU . 4.4 tt -59.67 -40.72 88.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.176 0.512 . . . . 0.0 109.64 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 111' ' ' ARG . 23.2 mtm180 -66.38 -40.32 89.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.447 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.63 -37.18 85.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.675 176.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 109' ' ' HIS . 86.1 mt -58.02 -52.22 66.41 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 175.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.41 ' HG2' HG22 ' B' ' 474' ' ' VAL . 65.5 mtp -53.41 -51.72 61.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.871 176.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.598 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 56.8 t -58.38 -46.65 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.351 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -60.48 -42.8 97.02 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.032 0.444 . . . . 0.0 111.488 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.507 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 54.3 tp -68.01 -36.02 79.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.887 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.12 -24.27 63.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.064 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.598 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 77.4 mt-30 -61.98 -30.65 71.08 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.725 0.774 . . . . 0.0 110.612 177.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 68.49 25.82 74.67 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 114.336 -1.302 . . . . 0.0 113.368 174.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.437 ' CD ' ' HB3' ' B' ' 488' ' ' ASN . 5.5 mm-40 -76.73 -55.39 5.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.208 0.527 . . . . 0.0 109.826 -178.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.513 ' OD2' ' HE2' ' A' ' 125' ' ' LYS . 4.5 p-10 -135.01 43.12 2.73 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.887 177.052 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.646 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.59 -35.68 9.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.974 177.054 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.41 -42.16 98.75 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.014 0.435 . . . . 0.0 110.97 -177.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.513 ' HE2' ' OD2' ' A' ' 122' ' ' ASP . 35.7 ttpt -72.79 -44.99 60.86 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.2 0.524 . . . . 0.0 110.059 175.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.444 HD22 ' HE2' ' A' ' 130' ' ' TYR . 95.1 mt -56.72 -38.72 72.73 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.326 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 1.7 mmt -51.2 -40.0 57.74 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 110.959 177.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 24.0 mmm180 -79.32 -40.41 30.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.826 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.574 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -66.76 -27.28 67.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.692 -177.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.507 ' CE1' ' HB2' ' A' ' 117' ' ' LEU . 3.3 m-30 -81.87 -29.32 32.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.977 0.418 . . . . 0.0 111.21 -176.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.494 ' HE2' HG12 ' A' ' 137' ' ' VAL . 15.0 mmt -77.32 4.98 9.45 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.539 -177.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.574 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 20.7 pt20 -107.07 -9.54 16.16 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -99.27 120.08 58.95 Favored Pre-proline 0 N--CA 1.452 -0.362 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.769 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.69 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 27.7 Cg_endo -62.38 -13.76 34.75 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.797 2.332 . . . . 0.0 112.224 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.0 mp -72.84 -46.39 53.25 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.611 176.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.498 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 32.3 t80 -87.04 -31.4 20.55 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.493 -169.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.69 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.7 m -56.93 -48.29 81.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.879 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 37.4 mt-10 -65.56 -42.57 91.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.638 178.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . 0.419 ' CD2' HD11 ' A' ' 101' ' ' LEU . 60.0 t80 -53.89 -50.05 67.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.376 0.607 . . . . 0.0 109.609 176.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.757 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.35 -46.32 87.14 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.098 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -65.31 -28.93 69.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.31 0.576 . . . . 0.0 110.948 -174.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.452 ' SG ' HD11 ' A' ' 104' ' ' LEU . 91.5 m -80.84 -41.83 22.56 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.685 -177.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 27.9 p -69.79 -27.34 64.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.616 0.246 . . . . 0.0 111.151 -177.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.757 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 81.6 mt -59.64 -44.9 93.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.059 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -65.11 -17.66 63.81 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.615 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 20.6 mt -91.7 -31.56 4.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.765 0.316 . . . . 0.0 111.054 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.461 ' O ' ' HD3' ' A' ' 149' ' ' PRO . 13.6 m -98.48 -17.41 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -75.83 110.68 11.51 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-O 120.917 0.389 . . . . 0.0 110.286 178.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 86.1 Cg_endo -80.81 -9.13 13.28 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.824 2.349 . . . . 0.0 112.741 -177.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 26.2 t 59.13 -154.29 0.37 Allowed 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -175.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.29 154.91 22.67 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.879 0.371 . . . . 0.0 110.016 172.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . 0.425 HD22 ' HA ' ' A' ' 152' ' ' ASN . 9.1 m120 -107.56 30.28 6.42 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.223 0.535 . . . . 0.0 110.324 178.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -77.59 -16.74 58.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.877 176.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -147.55 126.48 12.76 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.395 176.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 19.3 t . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.527 -0.749 . . . . 0.0 109.842 179.187 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . 0.405 ' OD2' ' HB2' ' B' ' 464' ' ' ARG . 14.2 t70 . . . . . 0 N--CA 1.482 1.154 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . 0.579 ' HA ' ' HG2' ' B' ' 466' ' ' GLU . 27.3 mt -72.1 -24.57 22.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.596 -170.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . 0.405 ' HB2' ' OD2' ' B' ' 462' ' ' ASP . 84.2 mtm180 -66.89 -35.3 79.7 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . 0.493 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 19.0 t60 -73.38 -47.67 40.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.672 -177.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.581 ' O ' HG12 ' B' ' 470' ' ' ILE . 12.3 pt-20 -63.21 -36.91 85.22 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.779 -176.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -61.77 -40.82 96.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.418 . . . . 0.0 112.039 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . 0.493 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.6 p-10 -81.8 -23.52 36.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -177.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.17 -36.82 77.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.679 173.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.581 HG12 ' O ' ' B' ' 466' ' ' GLU . 26.5 mm -60.58 -34.35 58.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.28 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 73.0 mt -59.61 -43.55 93.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.167 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -62.62 -41.31 98.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.876 177.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 55.1 m -63.42 -57.3 10.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.437 -178.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.41 HG22 ' HG2' ' A' ' 114' ' ' MET . 98.3 t -51.22 -45.33 31.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.602 175.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.601 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 0.8 OUTLIER -60.74 -42.2 96.87 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.317 -178.17 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -67.07 -45.98 75.7 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.673 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.18 -57.22 10.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.93 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 44.9 mt -60.32 -21.13 21.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.782 0.325 . . . . 0.0 111.253 -177.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.601 ' HB2' ' O ' ' B' ' 475' ' ' ARG . 19.3 tptm -67.91 -42.31 81.33 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.77 -177.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' B' ' 481' ' ' ASP . 0.0 OUTLIER -114.61 -14.35 12.08 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.43 0.529 . . . . 0.0 112.43 -178.211 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . 0.511 ' N ' ' HD3' ' B' ' 480' ' ' LYS . 13.3 t70 -90.65 -59.9 2.06 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.725 -175.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -85.13 -89.07 0.11 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.978 -171.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -112.1 -43.22 3.59 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.101 -171.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . . . . . . . . . . . 89.86 1.19 77.13 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.154 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 3.1 pp -123.34 179.65 4.65 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.742 0.306 . . . . 0.0 111.126 -176.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -129.29 107.69 9.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.449 0.643 . . . . 0.0 109.699 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 17.0 p -83.85 -13.29 54.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.079 -175.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . 0.437 ' HB3' ' CD ' ' A' ' 121' ' ' GLU . 15.1 m120 -127.9 -163.54 1.28 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.923 -172.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 22.0 t 66.61 15.35 10.1 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.746 0.784 . . . . 0.0 109.868 -173.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -88.65 -8.33 54.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.637 -178.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.24 7.96 42.74 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.341 176.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 54.0 m -128.82 148.55 50.89 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.339 178.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -92.04 74.74 5.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.218 0.533 . . . . 0.0 110.386 -178.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -101.96 -62.61 1.24 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.324 -178.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 45.9 t . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.491 -0.766 . . . . 0.0 110.064 178.661 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.599 0 N-CA-C 111.89 -0.484 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -66.26 115.08 3.3 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.938 2.426 . . . . 0.0 112.088 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -86.26 -36.89 19.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.22 0.533 . . . . 0.0 110.121 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 46.8 tpp -142.33 84.08 1.85 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.294 176.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -85.25 -3.1 58.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.488 -176.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -63.23 134.57 56.12 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 175.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.497 HG21 ' HB ' ' A' ' 147' ' ' VAL . 11.2 p -81.35 148.79 5.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.772 -175.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 25.2 m -55.54 139.9 42.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.227 -176.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.505 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -61.43 -35.95 78.98 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.04 -179.235 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -60.62 -39.95 90.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.65 177.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -60.71 -38.82 86.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.811 177.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.477 HD12 HD22 ' A' ' 89' ' ' LEU . 61.2 mt -69.96 -36.62 75.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.054 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 9.2 mtpm? -59.93 -17.79 40.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.21 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -83.29 -17.36 42.79 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.597 0.237 . . . . 0.0 111.378 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 84.8 mt -61.28 -44.22 97.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.83 0.348 . . . . 0.0 111.245 -176.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -71.1 -14.46 73.72 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.384 -179.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -87.94 -18.18 29.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.877 0.37 . . . . 0.0 110.503 -178.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.643 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 28.0 t -80.68 115.81 20.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.763 -177.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.72 -21.47 65.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.48 176.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 29.5 m -74.3 -43.71 55.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.927 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 63.2 tp -73.38 -48.38 34.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.424 -175.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.643 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.8 ptp180 -58.77 -29.6 66.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.072 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 28.9 t -63.11 -31.32 72.43 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-O 121.127 0.489 . . . . 0.0 109.956 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.1 mt -75.45 -38.14 59.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.898 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.444 HD21 HD13 ' B' ' 477' ' ' ILE . 11.1 mp -66.8 -17.98 65.15 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.819 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 62.1 mt -65.81 -19.01 65.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.741 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -75.61 120.84 83.52 Favored Pre-proline 0 C--O 1.236 0.352 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 173.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.73 -25.55 79.47 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.674 2.249 . . . . 0.0 112.29 -178.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -71.24 -48.8 48.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.093 178.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 58.2 tp -65.77 -37.27 85.88 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 120.86 0.362 . . . . 0.0 111.103 -175.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -69.15 -27.94 65.99 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.161 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . 0.474 ' HA ' HG22 ' A' ' 115' ' ' VAL . 8.6 mm100 -70.44 -38.85 74.6 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.391 174.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 94.5 mt -59.35 -47.21 86.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.194 0.521 . . . . 0.0 110.054 174.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 69.9 mtp -57.66 -51.95 67.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.668 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.614 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 32.9 m -65.79 -31.51 54.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.516 -177.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -64.69 -45.89 84.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.941 0.401 . . . . 0.0 110.635 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.9 tp -66.69 -40.3 88.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.21 -178.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -63.28 -41.38 98.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.76 -178.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.614 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 48.5 mt-30 -68.76 -29.09 67.4 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.521 0.677 . . . . 0.0 110.592 -177.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 83.15 29.84 32.79 Favored Glycine 0 C--N 1.318 -0.472 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.96 174.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -52.2 -54.62 28.74 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.218 0.533 . . . . 0.0 110.207 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.643 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 9.9 t0 -155.79 65.97 0.6 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 172.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.417 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -56.13 -27.23 53.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.211 -177.388 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.56 -47.3 86.8 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.105 0.479 . . . . 0.0 110.478 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -75.25 -42.14 55.83 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.662 177.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 87.7 mt -58.45 -44.24 89.15 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.485 -175.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.439 ' SD ' HD21 ' B' ' 471' ' ' LEU . 0.8 OUTLIER -52.25 -37.83 56.44 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.995 0.426 . . . . 0.0 111.421 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -84.06 -42.38 16.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.81 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.573 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.07 -21.64 64.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.983 -176.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.478 ' HB3' ' CD1' ' A' ' 136' ' ' PHE . 4.4 m-30 -82.77 -26.37 31.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.893 0.377 . . . . 0.0 111.203 -178.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.505 ' HE2' HG12 ' A' ' 137' ' ' VAL . 2.7 mmt -81.58 3.2 25.94 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.04 0.448 . . . . 0.0 111.501 -175.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 24.7 pt20 -102.84 -7.15 21.81 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.851 174.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.401 ' O ' HG22 ' A' ' 137' ' ' VAL . 6.4 mt-10 -99.49 122.66 50.88 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.324 -176.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.716 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 28.7 Cg_endo -62.01 -14.54 37.93 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.061 2.507 . . . . 0.0 112.867 -177.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 51.6 mt -82.75 -33.94 27.28 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.316 176.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.478 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 34.7 t80 -89.62 -31.14 17.68 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.107 -176.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.716 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 14.0 m -60.88 -48.44 88.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.08 177.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.479 ' N ' HG23 ' A' ' 137' ' ' VAL . 40.9 mm-40 -66.3 -36.5 83.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.849 176.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -56.46 -49.1 75.62 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 173.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.698 ' HA ' ' SG ' ' A' ' 143' ' ' CYS . . . -64.0 -43.0 96.98 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.507 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.46 -36.55 73.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.375 0.607 . . . . 0.0 110.292 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 65.1 m -77.05 -49.82 14.49 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.08 -0.963 . . . . 0.0 111.403 -179.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.698 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 27.5 p -64.21 -36.84 85.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.775 -176.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 46.2 mt -67.95 -34.58 76.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.409 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -73.92 -17.12 79.28 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.163 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 82.4 mt -90.97 -49.02 13.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.689 0.28 . . . . 0.0 110.775 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.497 ' HB ' HG21 ' A' ' 87' ' ' VAL . 16.3 m -86.62 1.8 5.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 -172.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -64.6 116.88 32.57 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-O 120.94 0.4 . . . . 0.0 111.266 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -71.4 -26.57 20.29 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.348 2.032 . . . . 0.0 111.219 175.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 23.2 t -162.0 143.29 10.84 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.184 -0.916 . . . . 0.0 108.76 176.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . 0.505 ' HB3' ' HB3' ' A' ' 154' ' ' GLU . 8.6 tp-100 -121.17 147.99 44.84 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -55.02 112.48 1.07 Allowed 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 176.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 38.52 91.7 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 O-C-N 124.395 1.059 . . . . 0.0 112.173 -166.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.505 ' HB3' ' HB3' ' A' ' 151' ' ' GLN . 8.1 pt-20 -95.86 60.25 2.09 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 114.207 -1.361 . . . . 0.0 110.813 -174.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 12.1 t . . . . . 0 C--O 1.249 1.073 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.581 177.836 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 121.074 0.464 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 65.9 mt -70.69 -26.72 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.783 -175.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -56.37 -44.15 79.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.689 178.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . 0.569 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 58.7 t60 -67.71 -45.29 75.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.778 176.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -60.14 -38.45 83.11 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.566 -179.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 21.6 ttp180 -67.95 -42.92 80.22 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.713 -176.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . 0.569 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.6 p-10 -76.66 -16.51 59.52 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.675 0.75 . . . . 0.0 110.047 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . 0.502 ' HA ' ' NE2' ' B' ' 472' ' ' GLN . 1.4 t -74.67 -21.76 17.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.286 177.195 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . . . . . . . . . 36.8 mm -68.94 -32.82 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-O 122.338 1.066 . . . . 0.0 109.062 -175.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . 0.623 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.6 OUTLIER -50.96 -54.83 20.9 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 113.017 -1.901 . . . . 0.0 110.768 179.145 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.502 ' NE2' ' HA ' ' B' ' 469' ' ' VAL . 2.4 mp0 -50.83 -44.81 59.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.938 176.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 50.6 m -62.81 -56.36 18.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.511 -179.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 92.4 t -52.01 -53.88 16.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.016 178.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 50.2 mtp180 -72.65 -27.33 62.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.623 -171.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -67.17 -46.63 73.38 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.053 0.454 . . . . 0.0 109.867 176.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.444 HD13 HD21 ' A' ' 105' ' ' LEU . 79.3 mt -63.03 -54.92 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.729 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.51 HG23 ' HB2' ' B' ' 482' ' ' PHE . 41.9 mt -56.33 -28.16 25.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.047 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.653 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 25.3 tptp -56.94 -39.46 74.55 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.976 -177.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.39 -14.09 12.22 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.029 -179.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -87.78 -59.6 2.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.477 -173.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . 0.51 ' HB2' HG23 ' B' ' 478' ' ' ILE . 95.8 m-85 -103.08 -83.55 0.48 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.141 0.422 . . . . 0.0 112.141 -172.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -111.87 -51.05 2.88 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 120.999 -0.281 . . . . 0.0 110.401 -174.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.653 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 61.82 36.66 93.09 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.748 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 3.3 pp -120.3 156.43 31.28 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.945 0.402 . . . . 0.0 110.686 176.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -138.08 -15.33 1.31 Allowed 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.519 0.676 . . . . 0.0 109.658 177.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 22.3 p -99.87 2.43 43.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.697 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -124.97 120.94 33.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.186 -175.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 44.5 m -148.2 88.83 1.68 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.315 0.579 . . . . 0.0 110.949 175.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -85.1 61.81 7.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.768 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -102.64 91.01 4.02 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.707 -176.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 16.7 t 52.28 57.26 6.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 0.0 110.437 178.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . 0.527 ' HE3' ' HA ' ' B' ' 493' ' ' LYS . 0.0 OUTLIER -95.19 27.49 3.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.577 0.703 . . . . 0.0 109.648 179.47 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -72.81 90.61 1.44 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.109 178.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 56.7 t . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.542 -0.742 . . . . 0.0 109.732 178.36 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 112.101 -0.4 . . . . 0.0 112.101 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -70.15 -28.29 23.57 Favored 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 122.913 2.409 . . . . 0.0 112.004 176.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 61.47 68.13 0.73 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.342 0.591 . . . . 0.0 110.425 -176.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 67.0 mtt -92.71 41.68 1.08 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.242 178.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.476 ' HB2' ' ND2' ' B' ' 468' ' ' ASN . 7.6 p-10 -70.44 -33.73 71.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.319 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 71.5 mtm180 -88.22 133.98 33.9 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.774 174.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.6 p -99.83 155.79 4.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.455 -174.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.0 m -69.29 151.82 45.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.244 0.545 . . . . 0.0 111.204 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.42 HD22 HD12 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -63.79 -33.38 75.53 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.905 -174.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -56.35 -39.66 73.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.864 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -68.6 -37.87 80.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.54 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.42 HD12 HD22 ' A' ' 89' ' ' LEU . 84.7 mt -68.9 -36.95 78.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.983 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 98.4 mttt -58.76 -27.08 64.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.742 178.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -72.53 -18.02 61.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.162 -178.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.437 ' HB3' ' CD2' ' A' ' 101' ' ' LEU . 94.0 mt -61.98 -54.41 42.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.161 -177.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -63.02 -21.22 63.43 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 121.145 -0.55 . . . . 0.0 113.07 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -76.35 -20.72 56.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.02 0.438 . . . . 0.0 110.744 -178.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 15.0 m -89.0 117.13 27.8 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.706 -175.021 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.16 -27.68 68.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.584 -176.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 60.3 m -70.03 -42.67 72.65 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.092 -178.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.437 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 43.6 tp -69.84 -49.77 49.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.539 -176.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.62 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 8.1 ptp180 -60.35 -27.23 67.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.649 -177.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.5 t -61.36 -28.98 69.61 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.368 0.604 . . . . 0.0 109.858 176.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.6 mt -80.18 -32.02 38.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.965 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.594 HD21 HD13 ' B' ' 477' ' ' ILE . 9.5 mp -66.56 -22.56 66.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.551 0.691 . . . . 0.0 110.173 177.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 63.4 mt -72.97 -9.15 58.41 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.997 -179.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -79.84 121.23 82.03 Favored Pre-proline 0 C--O 1.233 0.236 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 175.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -63.16 -19.9 69.76 Favored 'Trans proline' 0 CA--C 1.528 0.218 0 C-N-CA 122.777 2.318 . . . . 0.0 112.679 -179.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 112' ' ' GLN . 71.1 t60 -81.87 -49.89 9.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.717 0.294 . . . . 0.0 110.746 175.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.517 HD11 ' HB2' ' A' ' 139' ' ' PHE . 2.6 tt -62.93 -41.84 99.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.488 -174.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -61.77 -29.94 70.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.515 177.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 6.6 mm-40 -64.15 -49.19 73.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.262 175.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.559 HD21 ' OE2' ' A' ' 133' ' ' GLU . 8.9 mp -52.04 -44.97 64.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.948 0.404 . . . . 0.0 110.646 174.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . . . . . . . . . 73.9 mtp -57.45 -59.28 5.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.199 178.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.66 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 26.4 m -66.49 -27.62 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.652 -175.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -71.2 -53.53 14.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.976 0.417 . . . . 0.0 110.986 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 59.7 tp -62.11 -39.56 92.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.011 -176.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -66.71 -27.94 68.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.66 -0.246 . . . . 0.0 111.653 -173.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 72.6 mt-30 -64.06 -29.66 70.78 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.682 0.754 . . . . 0.0 110.374 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.409 ' HA2' ' HB3' ' A' ' 123' ' ' LYS . . . 68.71 29.04 72.72 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.603 173.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.31 -49.5 27.19 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 5.4 m-20 -136.72 42.61 2.47 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.944 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.654 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.3 OUTLIER -47.99 -33.05 7.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.576 -1.193 . . . . 0.0 112.377 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -56.26 -55.6 31.35 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.682 0.277 . . . . 0.0 111.667 -176.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -75.04 -29.98 60.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.782 0.325 . . . . 0.0 110.375 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.462 HD22 ' CE1' ' A' ' 130' ' ' TYR . 97.6 mt -65.73 -40.9 92.64 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.875 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.408 ' SD ' HD21 ' B' ' 471' ' ' LEU . 0.0 OUTLIER -55.41 -34.54 64.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.067 0.46 . . . . 0.0 110.64 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -78.87 -49.7 12.45 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.005 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.526 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -68.09 -16.54 64.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.345 -175.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.462 ' CE1' HD22 ' A' ' 126' ' ' LEU . 3.4 m-30 -88.75 -28.75 20.3 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.765 0.317 . . . . 0.0 111.059 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 3.2 mmt -71.14 -4.95 28.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.407 -178.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 28.3 pt20 -98.76 -18.44 17.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.258 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.559 ' OE2' HD21 ' A' ' 113' ' ' LEU . 4.2 mt-10 -88.86 123.06 68.49 Favored Pre-proline 0 CA--C 1.515 -0.387 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -176.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.42 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 12.6 Cg_endo -55.88 -25.1 50.91 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.169 2.58 . . . . 0.0 112.604 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.31 -45.22 66.69 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.201 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.411 ' CZ ' HG21 ' B' ' 470' ' ' ILE . 28.2 t80 -73.74 -31.68 63.48 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -178.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 133' ' ' GLU . 82.9 t -62.54 -42.77 97.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.336 176.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 8.3 mm-40 -66.67 -45.91 77.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.341 175.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . 0.517 ' HB2' HD11 ' A' ' 110' ' ' LEU . 69.8 t80 -57.54 -48.64 78.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.646 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.786 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.76 -49.52 74.7 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.111 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -60.21 -33.84 72.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.413 0.625 . . . . 0.0 110.294 -176.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.445 ' O ' HG13 ' A' ' 146' ' ' ILE . 99.6 m -69.56 -50.3 46.04 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.723 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.0 p -69.49 -29.06 66.62 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.638 -176.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.6 mt -60.89 -40.32 92.59 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.061 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -74.05 -29.78 62.17 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.414 -0.898 . . . . 0.0 111.985 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 142' ' ' CYS . 62.6 mt -77.5 -37.05 24.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.67 -0.265 . . . . 0.0 111.234 -177.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.404 ' O ' ' HD3' ' A' ' 149' ' ' PRO . 23.0 m -87.33 2.92 5.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.399 -178.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 19.0 mm-40 -82.72 109.5 16.94 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 168.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . 0.404 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 73.4 Cg_endo -76.67 -0.82 10.88 Favored 'Trans proline' 0 C--N 1.334 -0.187 0 C-N-CA 122.957 2.438 . . . . 0.0 112.911 -176.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 14.6 t 63.78 36.16 10.7 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -177.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 41.5 tp60 -82.42 74.9 9.36 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.781 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -83.21 56.22 3.44 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.924 -173.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -97.18 -155.03 0.47 Allowed 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.955 -1.021 . . . . 0.0 108.768 177.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -87.46 56.27 3.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.25 0.547 . . . . 0.0 110.543 175.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 18.8 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.373 179.408 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . 0.46 ' OD2' ' HB2' ' B' ' 464' ' ' ARG . 8.0 t70 . . . . . 0 N--CA 1.478 0.943 0 CA-C-O 121.035 0.445 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . 0.439 ' HA ' ' HB2' ' B' ' 466' ' ' GLU . 65.7 mt -68.42 -28.96 42.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.465 -170.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . 0.46 ' HB2' ' OD2' ' B' ' 462' ' ' ASP . 20.2 mmm180 -55.25 -49.81 71.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.312 0.577 . . . . 0.0 109.444 174.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . 0.472 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 29.0 t60 -70.24 -45.45 66.46 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.165 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.439 ' HB2' ' HA ' ' B' ' 463' ' ' ILE . 39.5 mt-10 -64.19 -22.83 67.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.242 -174.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 38.9 ttt180 -80.15 -41.38 25.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 178.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . 0.476 ' ND2' ' HB2' ' A' ' 85' ' ' ASP . 2.5 p-10 -84.47 -17.48 38.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.534 0.683 . . . . 0.0 110.597 -174.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 3.4 p -78.3 -19.39 13.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.343 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.411 HG21 ' CZ ' ' A' ' 136' ' ' PHE . 39.4 mm -69.11 -31.07 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 122.427 1.108 . . . . 0.0 108.737 -175.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . 0.62 ' CD2' ' H ' ' B' ' 471' ' ' LEU . 0.6 OUTLIER -54.81 -52.63 62.1 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 112.929 -1.941 . . . . 0.0 110.284 179.358 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -53.09 -44.5 67.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.932 174.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 50.7 m -61.28 -55.52 30.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.433 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 94.1 t -51.67 -51.58 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.908 176.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -64.6 -40.75 96.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.616 -173.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.47 -43.57 96.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.82 0.343 . . . . 0.0 110.447 178.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.594 HD13 HD21 ' A' ' 105' ' ' LEU . 78.2 mt -65.57 -55.42 19.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.274 -178.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.409 HG23 ' HB2' ' B' ' 482' ' ' PHE . 47.0 mt -56.97 -25.14 21.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.067 -178.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.522 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 17.1 tppt? -58.89 -47.06 86.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.111 -176.07 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . 0.479 ' HD2' ' H ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER -115.69 -9.2 11.98 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.903 -0.719 . . . . 0.0 112.073 -179.532 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -89.2 -60.22 2.01 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.629 -176.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . 0.409 ' HB2' HG23 ' B' ' 478' ' ' ILE . 89.8 m-85 -93.15 -86.95 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -172.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -107.48 -39.45 5.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.017 0.437 . . . . 0.0 111.522 -171.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.522 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 96.58 0.25 60.96 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.315 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 3.9 pp -140.97 153.47 45.62 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.835 0.35 . . . . 0.0 110.869 -177.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.23 1.62 18.76 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.518 0.675 . . . . 0.0 109.694 176.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 2.4 p -99.99 66.43 1.35 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.709 -177.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . 0.435 ' HA ' HD22 ' B' ' 488' ' ' ASN . 2.1 t-20 -83.16 81.22 8.78 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 121.219 0.533 . . . . 0.0 110.302 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 15.3 m -87.18 8.15 25.17 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.856 -177.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -78.07 1.12 22.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.76 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -97.97 8.02 45.41 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.513 -178.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 25.7 t -123.48 132.91 54.06 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.266 -177.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . 0.442 ' N ' ' HD3' ' B' ' 493' ' ' LYS . 0.4 OUTLIER -150.09 150.23 31.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.267 178.144 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -115.98 104.08 11.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.436 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.247 0.941 0 CA-C-O 118.123 -0.942 . . . . 0.0 111.506 -177.896 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.753 0 N-CA-C 111.956 -0.457 . . . . 0.0 111.956 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -61.43 -60.83 0.19 Allowed 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.75 2.3 . . . . 0.0 112.115 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -172.61 -51.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.225 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.411 ' O ' ' HG3' ' A' ' 84' ' ' MET . 27.0 ptt? -80.2 65.42 5.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.698 0.761 . . . . 0.0 111.249 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -88.06 -0.54 57.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.102 178.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -101.04 146.58 27.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.451 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 45.2 t -98.6 128.74 49.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.863 0.363 . . . . 0.0 110.502 -175.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.0 m -68.74 150.07 48.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.526 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -60.62 -34.41 74.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.374 -173.842 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -60.05 -39.89 87.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 0.0 110.296 178.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.41 -38.83 81.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.098 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.517 ' HA ' HD13 ' A' ' 95' ' ' LEU . 94.3 mt -69.46 -35.17 75.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.934 -177.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 96.6 mttt -59.31 -30.99 68.75 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -177.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -68.58 -19.59 64.48 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.513 0.196 . . . . 0.0 111.148 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.517 HD13 ' HA ' ' A' ' 92' ' ' LEU . 8.7 mp -64.1 -39.15 93.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.955 0.407 . . . . 0.0 110.623 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -72.48 -19.12 78.8 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.597 175.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -83.86 -24.6 30.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.032 0.444 . . . . 0.0 110.371 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.654 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 48.3 t -77.39 111.73 13.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.77 -177.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.2 -21.31 62.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.313 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 58.8 m -71.43 -46.79 59.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.96 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.515 HD11 ' CD1' ' A' ' 139' ' ' PHE . 59.5 tp -68.25 -51.08 49.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.968 -175.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.654 ' HG2' ' O ' ' A' ' 98' ' ' SER . 6.3 ptp180 -59.96 -28.19 67.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.682 -178.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.49 ' HA ' HD23 ' A' ' 106' ' ' LEU . 33.7 t -62.2 -23.62 66.73 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.095 0.474 . . . . 0.0 110.399 178.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.3 mt -82.38 -24.79 34.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.028 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 102' ' ' ARG . 10.2 mp -75.74 -8.68 57.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.51 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.4 mm? -67.48 -22.92 65.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.889 172.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -71.25 113.88 23.02 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.858 177.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' A' ' 111' ' ' ARG . 25.1 Cg_endo -61.68 -24.29 77.48 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.938 2.425 . . . . 0.0 112.846 -175.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 47.1 t60 -78.47 -42.46 29.71 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.824 0.345 . . . . 0.0 110.376 177.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.6 tt -65.36 -42.97 92.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.035 -176.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.457 ' HD3' ' HA ' ' A' ' 108' ' ' PRO . 12.7 ptm180 -67.56 -31.62 71.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.648 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . 0.451 ' HA ' HE21 ' A' ' 112' ' ' GLN . 0.0 OUTLIER -63.52 -43.02 98.39 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.426 173.545 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 86.0 mt -57.34 -49.34 76.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.412 ' HG2' HG22 ' B' ' 474' ' ' VAL . 75.0 mtp -54.89 -49.32 71.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.073 177.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 45.8 t -60.56 -39.9 82.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.032 0.444 . . . . 0.0 111.343 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.497 ' HA ' ' NE2' ' A' ' 119' ' ' GLN . 74.4 m-20 -68.32 -38.61 81.73 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.268 -178.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.56 ' HB2' ' CE1' ' A' ' 130' ' ' TYR . 59.7 tp -73.66 -44.66 56.19 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.61 -178.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.438 ' OD1' ' HD3' ' B' ' 475' ' ' ARG . 30.9 t70 -71.0 -27.99 64.09 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -171.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.497 ' NE2' ' HA ' ' A' ' 116' ' ' ASN . 11.0 pt20 -68.29 -17.54 64.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.279 0.562 . . . . 0.0 110.675 178.26 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 67.39 29.42 74.16 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.442 -0.799 . . . . 0.0 113.864 170.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -76.87 -51.99 10.27 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.954 0.377 . . . . 0.0 111.167 179.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.46 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 17.6 m-20 -132.89 37.06 3.46 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.252 0.549 . . . . 0.0 110.518 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.646 ' HD3' ' H ' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -46.11 -34.29 4.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.557 -1.201 . . . . 0.0 112.521 179.269 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.2 -46.9 88.14 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.834 0.349 . . . . 0.0 111.462 -176.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.437 ' HE2' ' HB3' ' A' ' 122' ' ' ASP . 3.9 mppt? -81.44 -35.33 30.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.138 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 85.4 mt -59.8 -44.25 94.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.046 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.476 ' HB3' ' NH2' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -54.75 -29.85 54.92 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.796 0.331 . . . . 0.0 111.822 179.314 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -83.19 -50.32 8.56 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.98 0.419 . . . . 0.0 110.441 176.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.752 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -63.34 -29.97 71.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.104 -176.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.594 ' HB3' ' CD1' ' A' ' 136' ' ' PHE . 3.5 m-30 -73.37 -21.92 60.41 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 122.172 -0.33 . . . . 0.0 111.367 -177.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.484 ' SD ' ' HG2' ' B' ' 467' ' ' ARG . 3.3 mmt -85.19 -5.26 59.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.899 0.38 . . . . 0.0 110.892 -177.125 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.752 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 12.6 pt20 -103.6 -6.63 21.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.896 0.379 . . . . 0.0 110.22 176.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.516 ' O ' HG23 ' A' ' 137' ' ' VAL . 4.1 mt-10 -92.31 120.3 67.68 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.184 -177.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.537 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 22.5 Cg_endo -60.74 -21.0 68.32 Favored 'Trans proline' 0 N--CA 1.464 -0.21 0 C-N-CA 122.754 2.303 . . . . 0.0 112.339 -175.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 63.4 mt -82.08 -43.96 17.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.706 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.594 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 47.1 t80 -73.48 -31.21 63.63 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.601 -0.44 . . . . 0.0 109.998 -177.018 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 133' ' ' GLU . 78.0 t -60.67 -39.98 83.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.483 176.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 17.7 mm-40 -63.18 -46.67 86.0 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.965 0.412 . . . . 0.0 110.129 177.373 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . 0.515 ' CD1' HD11 ' A' ' 101' ' ' LEU . 58.7 t80 -57.93 -50.23 74.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.376 178.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.765 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -64.45 -48.69 74.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.497 -176.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -63.99 -30.33 71.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.159 0.504 . . . . 0.0 110.295 -176.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 61.4 m -70.27 -51.07 33.28 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.819 178.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.453 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 24.3 p -66.7 -25.2 66.42 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.242 -176.222 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.765 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 79.1 mt -57.42 -44.0 84.27 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.913 0.387 . . . . 0.0 110.805 177.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.421 ' O ' ' HG2' ' A' ' 148' ' ' GLU . . . -76.75 -14.59 82.39 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.309 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 41.1 mt -91.46 -29.32 4.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.751 0.31 . . . . 0.0 111.026 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 23.0 m -100.64 5.3 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 CA-C-O 120.698 0.285 . . . . 0.0 110.559 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 145' ' ' GLY . 4.9 pt-20 -65.55 137.16 96.36 Favored Pre-proline 0 N--CA 1.441 -0.89 0 CA-C-O 121.321 0.582 . . . . 0.0 109.704 178.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -59.71 -15.0 29.21 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 123.678 2.919 . . . . 0.0 112.562 177.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 51.3 p 47.6 68.72 0.61 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.605 0.762 . . . . 0.0 112.46 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 64.58 103.13 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.212 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -61.27 122.05 14.11 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.85 179.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -80.29 -16.12 55.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.645 0.736 . . . . 0.0 109.483 177.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.66 41.29 1.61 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.325 176.332 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 31.4 p . . . . . 0 C--O 1.25 1.087 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.487 179.317 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . 0.533 ' OD1' ' HG2' ' B' ' 464' ' ' ARG . 10.5 t70 . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 121.284 0.564 . . . . 0.0 110.329 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 77.6 mt -69.33 -34.66 63.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.109 -0.95 . . . . 0.0 112.165 -171.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . 0.617 ' HD2' ' H ' ' B' ' 464' ' ' ARG . 0.0 OUTLIER -76.74 -29.43 56.17 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.608 -0.837 . . . . 0.0 109.901 -175.31 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . 0.573 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 45.2 t60 -65.55 -48.28 72.99 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.524 171.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.404 ' O ' HG12 ' B' ' 470' ' ' ILE . 37.8 mt-10 -62.48 -22.36 66.19 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.407 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . 0.484 ' HG2' ' SD ' ' A' ' 131' ' ' MET . 28.4 mtp-105 -79.0 -44.78 21.57 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 176.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . 0.573 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.5 p-10 -78.53 -19.68 52.39 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.411 -175.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . 0.49 HG13 ' O ' ' B' ' 465' ' ' HIS . 31.4 m -71.28 -22.51 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.973 0.416 . . . . 0.0 110.523 176.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.404 HG12 ' O ' ' B' ' 466' ' ' GLU . 31.3 mm -66.42 -30.75 50.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.886 177.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 77.8 mt -60.3 -38.09 82.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.789 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.451 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.2 mp0 -68.44 -40.0 81.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.067 0.461 . . . . 0.0 110.102 176.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.5 m -62.15 -57.29 12.09 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.509 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.412 HG22 ' HG2' ' A' ' 114' ' ' MET . 96.3 t -53.08 -49.6 49.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.514 176.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.524 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 1.8 tpp180 -59.87 -44.27 94.26 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.689 0.281 . . . . 0.0 111.259 -175.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -62.49 -47.06 85.65 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.8 -177.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . . . . . . . . . 72.1 mt -65.6 -54.5 27.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.146 -178.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.531 HG22 ' H ' ' B' ' 484' ' ' GLY . 11.2 mt -57.02 -28.89 30.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.182 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.544 ' HA ' ' HA2' ' B' ' 484' ' ' GLY . 21.5 tptm -59.13 -40.25 84.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.053 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' B' ' 480' ' ' LYS . 0.0 OUTLIER -111.7 -17.41 13.0 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.258 -179.129 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -91.47 -55.86 3.34 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.812 -174.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . 0.526 ' HB2' HG23 ' B' ' 478' ' ' ILE . 94.3 m-85 -99.1 -94.54 0.24 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.534 -172.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -113.33 -48.9 2.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.2 0.524 . . . . 0.0 111.276 -173.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.544 ' HA2' ' HA ' ' B' ' 479' ' ' LYS . . . 79.75 15.45 79.36 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.549 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.455 HD13 ' HB3' ' B' ' 488' ' ' ASN . 3.2 pp -138.66 158.0 45.06 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.775 0.321 . . . . 0.0 111.033 -178.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -139.4 -16.51 1.04 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.059 175.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 39.8 p -90.99 -0.23 57.7 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.63 -176.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . 0.455 ' HB3' HD13 ' B' ' 485' ' ' LEU . 1.3 t-20 -86.35 56.83 4.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.324 0.583 . . . . 0.0 110.307 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 18.3 m -66.45 126.15 27.92 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.426 -0.807 . . . . 0.0 110.362 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -97.49 -14.59 21.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.085 0.469 . . . . 0.0 111.385 -176.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -86.04 74.95 10.01 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.584 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 34.1 t -81.62 157.45 24.69 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.971 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . 0.443 ' HD2' ' N ' ' B' ' 493' ' ' LYS . 11.9 mptt -110.88 89.6 3.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.766 0.317 . . . . 0.0 110.395 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -149.16 -41.79 0.15 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.13 -178.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 16.1 t . . . . . 0 C--O 1.248 1.015 0 CA-C-O 119.239 -0.41 . . . . 0.0 109.906 -179.231 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -61.98 127.15 20.52 Favored 'Trans proline' 0 C--O 1.237 0.426 0 C-N-CA 122.845 2.364 . . . . 0.0 111.508 178.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 72.5 t60 70.39 110.22 0.06 Allowed 'General case' 0 N--CA 1.463 0.186 0 O-C-N 123.951 0.782 . . . . 0.0 109.741 -174.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 26.3 mmt -67.77 169.1 10.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.475 -175.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -84.43 39.02 0.71 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.739 0.781 . . . . 0.0 110.456 -176.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 -96.9 163.82 12.81 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.655 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.526 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 61.8 t -101.46 139.88 21.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.631 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.429 ' O ' ' HB2' ' A' ' 91' ' ' ASN . 30.1 m -59.82 134.77 57.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.998 0.427 . . . . 0.0 110.196 178.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.516 ' O ' ' HG3' ' A' ' 93' ' ' LYS . 3.9 tt -65.02 -33.64 76.52 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.642 -173.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -58.51 -37.78 76.31 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.396 175.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.436 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 4.1 m-20 -65.49 -38.57 90.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.988 176.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 78.1 mt -68.89 -34.01 74.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.177 -178.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 89' ' ' LEU . 56.7 mtpt -59.66 -24.47 63.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.081 -179.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -74.54 -19.28 60.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 121.215 -0.194 . . . . 0.0 111.206 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.36 -42.78 99.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.932 0.396 . . . . 0.0 110.915 -177.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.45 -9.84 81.96 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.441 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -103.06 -24.47 13.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.658 0.266 . . . . 0.0 111.34 -178.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.537 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 23.8 p -71.42 115.92 11.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.921 -176.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.07 -26.96 69.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.308 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 35.9 m -70.17 -44.34 68.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.887 0.375 . . . . 0.0 110.937 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.42 HD11 ' CD2' ' A' ' 139' ' ' PHE . 46.5 tp -72.23 -49.13 37.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.522 -174.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.537 ' HG2' ' O ' ' A' ' 98' ' ' SER . 2.4 ptp180 -58.43 -29.56 66.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.17 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.416 ' HA ' HD23 ' A' ' 106' ' ' LEU . 34.0 t -65.71 -22.82 66.65 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.918 0.39 . . . . 0.0 110.256 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 24.2 mt -84.2 -28.37 27.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.226 0.536 . . . . 0.0 109.65 178.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.533 ' O ' ' HD2' ' A' ' 111' ' ' ARG . 9.7 mp -74.03 2.64 8.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.154 178.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 103' ' ' SER . 4.2 mm? -75.7 -19.73 58.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.893 0.378 . . . . 0.0 110.056 171.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -80.17 114.36 46.22 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.572 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -55.82 -39.77 89.16 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.501 2.801 . . . . 0.0 113.137 -177.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -69.03 -41.42 77.71 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.762 0.315 . . . . 0.0 110.624 -178.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.424 ' O ' HD23 ' A' ' 110' ' ' LEU . 3.8 tt -60.45 -41.53 94.27 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 105' ' ' LEU . 57.1 mtp85 -62.78 -44.28 96.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.912 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.81 -24.81 67.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.497 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 65.7 mt -79.16 -51.58 9.33 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 121.646 0.736 . . . . 0.0 109.079 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.576 ' HG3' HG13 ' B' ' 474' ' ' VAL . 44.0 ttp -59.55 -43.86 93.41 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.39 -1.277 . . . . 0.0 111.211 -177.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.628 ' HA ' HD13 ' B' ' 478' ' ' ILE . 33.4 m -68.01 -23.98 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.88 0.372 . . . . 0.0 111.744 -178.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 28.2 m-20 -72.69 -42.35 64.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.282 0.563 . . . . 0.0 110.673 177.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.485 HD23 HG21 ' B' ' 474' ' ' VAL . 27.9 tp -60.42 -37.27 80.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.041 -177.24 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.525 ' HB2' HD12 ' B' ' 478' ' ' ILE . 17.0 t70 -67.53 -32.22 72.86 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.867 0.365 . . . . 0.0 110.979 -178.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 68.8 mt-30 -60.75 -28.89 69.04 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.497 -178.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.56 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 70.51 20.54 77.16 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.039 -0.982 . . . . 0.0 114.06 169.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -69.01 -50.59 47.5 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.451 0.643 . . . . 0.0 109.691 -178.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.483 ' OD2' ' HE2' ' A' ' 125' ' ' LYS . 13.4 p-10 -141.01 40.21 1.8 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.648 179.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.617 ' HD2' ' H ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -52.78 -26.99 16.0 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.794 -1.094 . . . . 0.0 112.033 179.429 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.617 ' H ' ' HD2' ' A' ' 123' ' ' LYS . . . -67.6 -39.13 84.8 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.25 0.547 . . . . 0.0 110.137 -177.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.504 ' C ' ' HD2' ' A' ' 125' ' ' LYS . 5.1 tmmm? -79.45 -45.03 20.2 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.07 177.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.532 HD22 ' CE1' ' A' ' 130' ' ' TYR . 94.5 mt -56.25 -38.11 70.68 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.463 -178.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.58 -44.89 56.94 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.953 0.406 . . . . 0.0 111.385 177.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -84.18 -36.34 22.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.801 -178.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.504 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -70.24 -16.81 63.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.638 -178.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.532 ' CE1' HD22 ' A' ' 126' ' ' LEU . 7.3 m-30 -87.45 -22.1 25.16 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.934 0.397 . . . . 0.0 110.737 178.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 5.8 mmt -77.85 -6.11 53.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.963 -177.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 13.9 pt20 -99.59 -4.23 31.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.948 0.404 . . . . 0.0 110.235 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.522 ' O ' HG23 ' A' ' 137' ' ' VAL . 3.9 mt-10 -104.65 119.89 52.15 Favored Pre-proline 0 N--CA 1.452 -0.356 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.459 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 16.1 Cg_endo -57.11 -24.53 58.9 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.976 2.451 . . . . 0.0 112.363 -175.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.523 ' H ' HD12 ' A' ' 135' ' ' LEU . 5.1 mp -67.01 -51.66 52.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.347 -179.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.476 ' CD1' ' HB3' ' A' ' 130' ' ' TYR . 27.7 t80 -75.64 -28.04 58.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -174.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 133' ' ' GLU . 99.4 t -59.38 -43.26 89.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.331 175.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 134' ' ' PRO . 44.8 mt-10 -64.74 -46.85 80.48 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.818 0.342 . . . . 0.0 110.173 178.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . 0.42 ' CD2' HD11 ' A' ' 101' ' ' LEU . 71.4 t80 -56.98 -47.09 81.61 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.556 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.697 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -68.16 -45.55 73.21 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.72 -176.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.73 -32.47 73.79 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.996 0.427 . . . . 0.0 110.331 -176.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 91.2 m -77.01 -42.77 37.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.686 -176.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.443 ' HA ' HD12 ' A' ' 146' ' ' ILE . 27.8 p -64.95 -27.07 68.59 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.212 -177.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 82.2 mt -63.2 -39.34 94.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.767 0.318 . . . . 0.0 110.927 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -74.25 -14.76 80.43 Favored Glycine 0 C--O 1.225 -0.418 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.088 178.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.443 HD12 ' HA ' ' A' ' 143' ' ' CYS . 50.7 mt -90.78 -40.34 12.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.972 0.415 . . . . 0.0 110.493 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.436 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 29.7 m -87.15 12.57 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.883 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 7.7 pt-20 -42.32 112.51 1.1 Allowed Pre-proline 0 C--O 1.236 0.342 0 O-C-N 124.115 0.885 . . . . 0.0 112.146 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.97 -41.27 1.05 Allowed 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.441 2.094 . . . . 0.0 111.522 177.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 59.4 m -156.84 78.24 0.91 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.649 176.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -95.22 139.64 31.26 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.325 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -102.85 124.4 48.29 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.802 0.334 . . . . 0.0 110.105 175.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -107.62 150.29 27.06 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.609 176.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -153.78 158.35 40.78 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 17.8 m . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.913 -179.129 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . 0.71 ' OD2' ' HG3' ' B' ' 464' ' ' ARG . 7.5 t70 . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . 0.487 ' O ' ' HG3' ' B' ' 467' ' ' ARG . 71.5 mt -76.2 -32.81 23.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.329 -169.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . 0.71 ' HG3' ' OD2' ' B' ' 462' ' ' ASP . 1.4 ppt_? -70.63 -37.53 73.81 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -177.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . 0.543 ' HA ' ' OD1' ' B' ' 468' ' ' ASN . 49.8 t60 -65.88 -46.92 76.61 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.387 176.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.624 ' O ' HG12 ' B' ' 470' ' ' ILE . 39.7 mt-10 -58.91 -36.5 74.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.695 -179.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' B' ' 463' ' ' ILE . 19.1 mtm180 -66.67 -46.8 74.48 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . 0.543 ' OD1' ' HA ' ' B' ' 465' ' ' HIS . 2.9 p-10 -75.16 -19.01 60.07 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.934 -177.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.0 t -66.8 -34.88 72.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.347 170.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.624 HG12 ' O ' ' B' ' 466' ' ' GLU . 35.1 mm -65.12 -29.63 47.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 96.8 mt -56.05 -41.17 74.61 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.598 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.526 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.4 mp0 -64.79 -44.11 91.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.76 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . 0.415 ' O ' HG13 ' B' ' 477' ' ' ILE . 42.6 m -63.01 -52.95 60.97 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.268 0.556 . . . . 0.0 110.626 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.576 HG13 ' HG3' ' A' ' 114' ' ' MET . 24.5 t -56.45 -55.11 20.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.663 178.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.64 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 53.2 mtm180 -68.99 -20.18 64.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.232 -174.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . 0.427 ' O ' ' HD2' ' B' ' 480' ' ' LYS . 2.4 t80 -73.82 -55.28 6.41 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.193 176.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.415 HG13 ' O ' ' B' ' 473' ' ' CYS . 62.2 mt -60.54 -59.15 4.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-O 120.917 0.389 . . . . 0.0 111.242 -173.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.628 HD13 ' HA ' ' A' ' 115' ' ' VAL . 46.3 mt -53.71 -30.49 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.872 -176.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.668 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 1.5 ttmm -81.65 -19.04 42.53 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -166.214 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . 0.427 ' HD2' ' O ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER -120.45 -17.22 8.21 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 118.946 -1.102 . . . . 0.0 112.659 167.193 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -91.22 -60.06 1.99 Allowed 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.621 -0.432 . . . . 0.0 112.117 -177.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . 0.411 ' HB2' HG23 ' B' ' 478' ' ' ILE . 46.1 m-85 -79.94 -90.43 0.05 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.081 -170.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -95.78 -35.05 11.67 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.587 0.708 . . . . 0.0 110.237 -175.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.668 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 78.61 13.19 83.45 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.373 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 57.8 mt -89.83 160.96 16.23 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.031 0.443 . . . . 0.0 111.164 -177.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -147.7 -6.17 0.46 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.374 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 6.2 p -83.22 55.76 3.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.492 -177.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -118.94 77.92 1.23 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.396 0.617 . . . . 0.0 110.301 178.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 20.0 m -148.31 -172.74 4.15 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.315 177.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -70.95 -55.83 7.53 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.41 0.624 . . . . 0.0 111.068 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -122.09 48.03 1.8 Allowed 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.4 -176.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 5.8 p -86.12 115.71 23.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.574 178.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -143.42 132.03 22.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.626 0.25 . . . . 0.0 111.093 -177.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 21.9 t70 57.28 84.27 0.1 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.763 178.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.385 -0.817 . . . . 0.0 110.222 177.463 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.869 -0.492 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.39 135.16 64.69 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.882 2.388 . . . . 0.0 112.227 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -163.73 -76.6 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -178.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.433 ' SD ' ' HG2' ' A' ' 86' ' ' ARG . 6.3 tmm? -126.49 97.06 4.89 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 171.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -109.57 4.48 22.2 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -166.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.433 ' HG2' ' SD ' ' A' ' 84' ' ' MET . 30.2 ptt180 -90.46 163.73 14.54 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.28 178.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.655 ' H ' ' HG2' ' B' ' 472' ' ' GLN . 48.8 t -109.72 136.0 46.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.58 -175.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.605 ' OG ' ' HG2' ' A' ' 90' ' ' GLN . 37.0 t -63.25 144.02 57.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.565 176.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.42 -21.36 66.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.846 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.605 ' HG2' ' OG ' ' A' ' 88' ' ' SER . 11.6 pt20 -66.5 -39.88 88.94 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 177.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -69.79 -35.24 74.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.11 177.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.3 mt -70.31 -37.94 74.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.763 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -61.73 -22.53 65.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.814 0.34 . . . . 0.0 111.849 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -78.69 -17.98 55.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.535 -178.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 95.9 mt -61.31 -47.07 87.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.698 -179.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -69.35 -12.21 65.87 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.744 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -86.44 -24.45 25.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.738 0.304 . . . . 0.0 110.899 -177.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.57 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 82.0 p -80.43 124.58 29.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.96 0.409 . . . . 0.0 110.432 -177.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.22 -26.65 65.82 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.075 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.7 m -68.22 -48.14 65.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.067 -178.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -67.8 -49.99 59.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.463 -175.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.57 ' HG2' ' O ' ' A' ' 98' ' ' SER . 7.9 ptp180 -60.63 -27.87 68.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.402 -178.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.3 t -68.62 -23.35 64.43 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.275 0.56 . . . . 0.0 110.001 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.1 mt -81.33 -32.51 32.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.811 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.8 mp -72.19 -5.29 34.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.349 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 57.1 mt -76.69 -8.31 57.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.229 176.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -87.48 117.84 69.08 Favored Pre-proline 0 C--N 1.332 -0.157 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 173.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -58.52 -32.15 95.88 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.825 2.35 . . . . 0.0 112.613 -178.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.8 t60 -66.86 -43.45 83.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.96 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 54.3 tp -63.3 -35.3 79.89 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.913 0.387 . . . . 0.0 110.008 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 -59.92 -42.97 95.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.075 177.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . 0.576 ' HA ' HE21 ' A' ' 112' ' ' GLN . 0.0 OUTLIER -64.26 -45.61 87.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.13 178.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.41 ' O ' ' HE1' ' A' ' 130' ' ' TYR . 91.9 mt -56.3 -47.04 79.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.155 0.502 . . . . 0.0 110.351 178.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.468 ' HG2' HG22 ' B' ' 474' ' ' VAL . 71.4 mtp -58.75 -50.82 72.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.926 177.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.607 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 52.2 t -59.27 -41.97 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 120.804 0.335 . . . . 0.0 111.301 179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -64.28 -45.24 88.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.262 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 48.5 tp -67.02 -39.94 87.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.298 -177.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.475 ' CB ' HD12 ' B' ' 478' ' ' ILE . 16.9 t70 -62.39 -33.53 74.95 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.961 -175.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 63.1 mt-30 -60.26 -26.86 66.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.265 0.555 . . . . 0.0 110.501 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.505 ' HA2' ' HG3' ' A' ' 123' ' ' LYS . . . 68.2 23.67 74.74 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.096 -0.956 . . . . 0.0 114.075 170.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -78.9 -45.83 19.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.132 0.491 . . . . 0.0 110.029 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.493 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 10.4 m-20 -132.44 31.65 4.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.756 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.668 ' HD2' ' N ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -53.22 -28.02 24.94 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.184 -0.916 . . . . 0.0 112.099 -179.013 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.668 ' N ' ' HD2' ' A' ' 123' ' ' LYS . . . -64.11 -38.43 91.03 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.369 0.604 . . . . 0.0 110.753 -175.455 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.424 ' HE3' ' HB3' ' A' ' 122' ' ' ASP . 46.6 mtmt -87.21 -42.02 13.28 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.004 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 86.2 mt -55.0 -42.04 72.02 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.404 -178.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.62 -41.53 55.04 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -82.34 -39.79 22.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.511 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.48 -32.28 73.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.251 -178.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.41 ' HE1' ' O ' ' A' ' 113' ' ' LEU . 3.4 m-30 -78.34 -17.35 56.65 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.01 -177.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.615 ' HE2' HG12 ' A' ' 137' ' ' VAL . 3.6 mmt -76.85 -4.22 42.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.251 -177.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -88.38 -20.01 25.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.104 0.478 . . . . 0.0 109.854 175.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -92.2 121.66 66.23 Favored Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.658 -172.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.717 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 28.4 Cg_endo -63.17 -14.06 39.44 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.107 2.538 . . . . 0.0 112.502 -178.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 52.7 mt -80.04 -34.6 38.13 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.88 177.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -89.58 -35.01 16.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.227 -175.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.717 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 11.8 m -57.62 -48.68 82.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.223 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.473 ' N ' HG23 ' A' ' 137' ' ' VAL . 27.3 mm-40 -61.34 -42.15 98.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.423 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -57.19 -50.96 71.22 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.219 0.533 . . . . 0.0 109.665 176.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.775 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -63.06 -45.37 92.53 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.976 179.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -63.02 -32.86 74.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.286 0.565 . . . . 0.0 110.493 -175.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 90.9 m -79.69 -44.87 20.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.611 -177.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.47 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -66.4 -28.27 68.5 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.157 -175.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.9 mt -58.82 -51.03 71.74 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.688 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.12 -21.45 65.99 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.322 -176.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 52.3 mt -86.99 -35.15 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.676 0.274 . . . . 0.0 110.853 -179.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.449 ' HB ' HG11 ' A' ' 87' ' ' VAL . 18.7 m -95.88 -5.75 10.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -175.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 144' ' ' LEU . 25.0 mt-10 -85.03 113.05 47.72 Favored Pre-proline 0 C--N 1.327 -0.373 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.949 175.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . 0.419 ' HD3' ' O ' ' A' ' 147' ' ' VAL . 72.0 Cg_endo -80.38 -11.16 13.26 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.806 2.338 . . . . 0.0 111.87 176.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 10.6 m -89.82 155.77 18.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.832 178.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -78.38 106.91 10.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.58 0.705 . . . . 0.0 110.451 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -96.08 141.42 29.49 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.692 -178.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.25 143.94 26.13 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.562 176.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 45.7 tt0 -70.27 91.51 0.73 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 0.0 110.348 -177.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.731 -0.652 . . . . 0.0 109.713 178.457 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . 0.564 ' O ' ' HG2' ' B' ' 466' ' ' GLU . 6.0 p-10 . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 121.368 0.604 . . . . 0.0 109.814 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . 0.46 ' O ' ' HD2' ' B' ' 467' ' ' ARG . 50.3 mm -67.08 -29.82 47.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.581 -173.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -58.87 -47.39 85.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.237 0.542 . . . . 0.0 110.398 177.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . 0.487 ' HD2' ' OE1' ' B' ' 466' ' ' GLU . 46.6 t60 -64.47 -43.11 95.23 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.051 178.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.564 ' HG2' ' O ' ' B' ' 462' ' ' ASP . 7.9 mm-40 -63.59 -22.67 67.02 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.408 -178.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . 0.571 ' HE ' ' HA ' ' B' ' 467' ' ' ARG . 0.0 OUTLIER -84.14 -41.19 17.32 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.155 176.649 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -31.09 71.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.689 0.281 . . . . 0.0 110.623 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 31.5 m -69.59 -21.82 24.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-O 120.791 0.329 . . . . 0.0 110.907 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 466' ' ' GLU . 42.8 mm -66.64 -32.77 59.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.224 178.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 71.6 mt -58.79 -45.05 90.74 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.291 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.655 ' HG2' ' H ' ' A' ' 87' ' ' VAL . 2.5 mp0 -62.24 -39.9 94.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.586 177.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . 0.59 ' O ' HG12 ' B' ' 477' ' ' ILE . 59.9 m -64.12 -57.71 8.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.356 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.468 HG22 ' HG2' ' A' ' 114' ' ' MET . 85.4 t -52.02 -50.28 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.12 176.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' B' ' 479' ' ' LYS . 22.8 ttm180 -66.65 -33.16 75.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.225 -174.359 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -61.23 -45.57 94.01 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 175.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.59 HG12 ' O ' ' B' ' 473' ' ' CYS . 9.2 mm -57.95 -63.5 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 121.765 0.793 . . . . 0.0 109.228 178.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.617 HG23 ' HB2' ' B' ' 482' ' ' PHE . 16.6 mt -56.32 -30.05 29.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.167 -1.379 . . . . 0.0 112.065 -174.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.556 ' HA ' ' CA ' ' B' ' 484' ' ' GLY . 80.7 tttt -60.31 -44.3 95.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . 0.496 ' HD3' ' N ' ' B' ' 481' ' ' ASP . 0.0 OUTLIER -108.19 -15.15 14.56 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.655 -177.276 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . 0.496 ' N ' ' HD3' ' B' ' 480' ' ' LYS . 11.9 t70 -91.3 -59.05 2.25 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.768 -178.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . 0.617 ' HB2' HG23 ' B' ' 478' ' ' ILE . 97.9 m-85 -100.42 -89.04 0.34 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -171.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -112.7 -51.0 2.86 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -171.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.556 ' CA ' ' HA ' ' B' ' 479' ' ' LYS . . . 66.04 28.4 73.64 Favored Glycine 0 N--CA 1.454 -0.165 0 C-N-CA 120.892 -0.671 . . . . 0.0 111.889 -175.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 58.5 mt -96.86 141.84 29.56 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.285 0.564 . . . . 0.0 111.383 -177.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -102.56 -7.04 22.17 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.907 175.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 2.4 p -74.21 7.22 2.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.161 -177.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . 0.457 HD22 ' N ' ' B' ' 488' ' ' ASN . 0.9 OUTLIER -84.24 -15.53 46.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.97 0.414 . . . . 0.0 110.479 179.085 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 44.5 t -156.39 139.87 15.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.247 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -88.49 13.24 12.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.042 176.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -125.32 34.12 5.01 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.831 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 20.5 t -81.95 81.66 7.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.574 0.702 . . . . 0.0 109.546 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -119.95 151.88 38.27 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.522 -176.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -76.02 -46.79 27.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.002 177.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.746 176.658 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.855 0 N-CA-C 111.834 -0.506 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -51.89 -62.21 0.41 Allowed 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.056 2.504 . . . . 0.0 112.558 -174.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -102.14 37.25 1.91 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.193 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 86.2 mtp 55.51 62.85 2.28 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.904 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.448 ' HA ' ' ND1' ' B' ' 465' ' ' HIS . 15.3 p-10 -88.98 -38.68 14.26 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.102 -176.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -74.79 115.73 14.72 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -88.58 146.95 5.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.545 -176.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.0 m -63.87 144.69 56.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.312 0.577 . . . . 0.0 111.249 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 tt -66.13 -30.39 70.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.107 -0.952 . . . . 0.0 110.156 -176.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -58.79 -36.91 75.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.347 176.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -68.09 -40.06 82.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.0 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.421 HD11 ' HB3' ' B' ' 472' ' ' GLN . 83.7 mt -65.14 -34.49 78.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.439 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.415 ' HA ' ' CE2' ' B' ' 476' ' ' TYR . 10.4 mtpm? -59.1 -25.21 63.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.016 179.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -72.29 -16.81 61.91 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.455 ' HB2' ' CE1' ' B' ' 476' ' ' TYR . 93.1 mt -62.01 -51.93 66.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.769 0.318 . . . . 0.0 110.719 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -64.08 -19.3 63.56 Favored Glycine 0 CA--C 1.519 0.34 0 C-N-CA 121.02 -0.61 . . . . 0.0 112.47 176.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -79.3 -16.43 56.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.725 0.298 . . . . 0.0 110.751 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.535 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 31.0 t -83.23 120.07 25.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.06 0.457 . . . . 0.0 111.051 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.96 -27.95 67.04 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.401 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 77.3 m -70.33 -47.38 61.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.884 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.592 HD12 HD11 ' A' ' 104' ' ' LEU . 17.4 tp -65.72 -50.15 65.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.92 -174.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 98' ' ' SER . 3.8 ptp180 -58.09 -25.1 60.91 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.142 -0.223 . . . . 0.0 111.44 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 73.9 m -74.15 -39.35 63.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.592 HD11 HD12 ' A' ' 101' ' ' LEU . 0.7 OUTLIER -87.12 -15.51 38.23 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.908 177.94 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.71 HD21 HD13 ' B' ' 477' ' ' ILE . 7.3 mp -68.95 -4.34 16.3 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.109 0.481 . . . . 0.0 110.774 168.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 97.1 mt -81.95 -11.73 58.73 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.774 177.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.575 ' O ' ' HG3' ' A' ' 111' ' ' ARG . 56.4 m-80 -75.88 115.21 44.29 Favored Pre-proline 0 N--CA 1.463 0.192 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 175.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.42 -26.3 82.41 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.556 2.171 . . . . 0.0 112.193 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -69.62 -47.09 64.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.261 177.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 58.5 tp -64.01 -34.6 78.37 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.343 0.592 . . . . 0.0 110.145 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.575 ' HG3' ' O ' ' A' ' 107' ' ' ASN . 70.5 mtp85 -65.05 -42.47 94.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.679 177.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -64.01 -39.79 94.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.062 177.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 84.0 mt -59.04 -48.45 81.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.828 178.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.543 ' HG2' HG22 ' B' ' 474' ' ' VAL . 44.2 mtm -57.77 -53.02 62.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.575 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.572 ' O ' ' HG3' ' A' ' 119' ' ' GLN . 33.1 m -65.7 -28.86 45.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.714 -175.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -69.14 -46.77 66.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.084 0.469 . . . . 0.0 110.518 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.587 HD11 ' SD ' ' A' ' 127' ' ' MET . 33.8 tp -63.3 -38.94 93.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.861 -178.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.538 ' OD1' ' HG2' ' B' ' 475' ' ' ARG . 9.4 t70 -63.71 -30.34 71.45 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.851 -177.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.572 ' HG3' ' O ' ' A' ' 115' ' ' VAL . 74.4 mt-30 -60.09 -29.63 68.71 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.503 0.668 . . . . 0.0 109.819 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.35 18.72 73.65 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 114.62 -1.173 . . . . 0.0 113.902 171.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -67.07 -55.36 14.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.202 0.501 . . . . 0.0 110.227 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -133.71 45.22 2.68 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.368 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.596 ' O ' ' HG2' ' A' ' 127' ' ' MET . 0.0 OUTLIER -56.92 -29.5 63.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.462 -178.037 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.45 -38.41 84.08 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.812 0.339 . . . . 0.0 111.412 -177.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.597 ' HD2' ' H ' ' A' ' 125' ' ' LYS . 0.0 OUTLIER -87.4 -33.9 18.95 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.477 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.451 HD22 ' CE2' ' A' ' 130' ' ' TYR . 97.4 mt -60.69 -36.02 77.74 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.729 -179.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . 0.596 ' HG2' ' O ' ' A' ' 123' ' ' LYS . 73.9 mmm -53.6 -43.91 68.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.975 0.417 . . . . 0.0 110.454 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 22.8 mmm180 -72.44 -38.79 68.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.981 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -69.89 -24.55 63.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.419 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.451 ' CE2' HD22 ' A' ' 126' ' ' LEU . 2.5 m-30 -88.82 -30.62 18.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.834 0.35 . . . . 0.0 110.699 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 1.3 mmt -68.75 -10.36 56.07 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.503 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 27.8 pt20 -95.65 -9.65 31.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.87 0.367 . . . . 0.0 110.499 -178.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.573 ' O ' HG23 ' A' ' 137' ' ' VAL . 3.4 mt-10 -91.97 121.88 66.13 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.749 -175.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.52 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 18.3 Cg_endo -59.31 -20.19 54.33 Favored 'Trans proline' 0 C--O 1.226 -0.113 0 C-N-CA 122.963 2.442 . . . . 0.0 112.585 -177.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.1 mt -80.33 -41.18 25.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.99 0.424 . . . . 0.0 110.535 178.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -78.59 -32.38 47.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.087 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' ' 133' ' ' GLU . 79.6 t -59.91 -42.01 87.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.781 177.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 134' ' ' PRO . 17.5 mm-40 -69.25 -42.97 74.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.106 178.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -58.35 -49.22 77.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.695 178.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.793 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -61.64 -47.43 85.42 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.98 -177.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -63.91 -33.21 75.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.163 0.506 . . . . 0.0 110.263 -178.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.445 ' O ' HG13 ' A' ' 146' ' ' ILE . 65.3 m -67.4 -51.46 51.59 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.761 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.451 ' O ' HG22 ' A' ' 147' ' ' VAL . 26.1 p -64.64 -33.15 75.26 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.704 -0.225 . . . . 0.0 111.203 -177.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.793 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 77.5 mt -62.71 -36.92 84.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.934 0.397 . . . . 0.0 110.825 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -77.19 -15.32 81.68 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.355 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 142' ' ' CYS . 67.6 mt -91.71 -38.9 11.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.069 0.462 . . . . 0.0 110.964 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.451 HG22 ' O ' ' A' ' 143' ' ' CYS . 19.3 m -95.57 11.35 4.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.108 -177.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.421 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 2.8 pt-20 -47.62 126.8 10.53 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.456 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -69.05 -40.0 7.06 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.289 1.992 . . . . 0.0 111.464 176.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 26.0 t -178.23 36.69 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.624 177.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 51.17 52.76 14.23 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -175.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -89.19 140.88 29.02 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.057 -175.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -96.34 142.06 28.93 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.035 176.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 60.21 27.37 16.87 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.257 0.551 . . . . 0.0 111.299 -176.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 41.1 p . . . . . 0 C--O 1.255 1.394 0 CA-C-O 117.819 -1.086 . . . . 0.0 109.133 173.498 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . . . . . . . . . 14.3 t70 . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 121.154 0.502 . . . . 0.0 110.099 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . 0.562 ' H ' HD12 ' B' ' 463' ' ' ILE . 4.2 mp -61.5 -35.42 66.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.612 -170.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -70.5 -39.71 74.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.17 0.51 . . . . 0.0 109.768 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . 0.448 ' ND1' ' HA ' ' A' ' 85' ' ' ASP . 47.6 t60 -62.48 -51.19 68.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.083 174.17 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.662 ' O ' HG12 ' B' ' 470' ' ' ILE . 34.5 mt-10 -61.59 -43.67 98.43 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.198 -175.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -55.46 -40.08 71.16 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 177.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -31.49 52.85 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -177.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.4 t -63.66 -36.0 74.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.266 175.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.662 HG12 ' O ' ' B' ' 466' ' ' GLU . 34.0 mm -60.86 -38.57 79.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.879 176.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . . . . . . . . . 87.2 mt -59.29 -37.06 76.75 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.421 ' HB3' HD11 ' A' ' 92' ' ' LEU . 1.6 mp0 -68.12 -44.23 76.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.689 176.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 60.4 m -63.15 -56.1 19.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.104 -177.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.543 HG22 ' HG2' ' A' ' 114' ' ' MET . 73.9 t -48.85 -52.66 9.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.762 176.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.538 ' HG2' ' OD1' ' A' ' 118' ' ' ASP . 88.4 mtm180 -69.68 -23.05 63.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.918 -174.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . 0.455 ' CE1' ' HB2' ' A' ' 95' ' ' LEU . 0.8 OUTLIER -71.17 -47.36 58.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.969 0.414 . . . . 0.0 110.013 176.559 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.71 HD13 HD21 ' A' ' 105' ' ' LEU . 74.5 mt -64.89 -54.16 33.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.513 -177.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . 0.514 HG23 ' HB2' ' B' ' 482' ' ' PHE . 50.5 mt -54.39 -26.45 15.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.694 178.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.599 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 3.6 ttmp? -70.81 -31.15 67.8 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.908 -173.325 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.46 -17.54 10.64 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.785 -0.766 . . . . 0.0 112.581 175.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -91.54 -58.82 2.31 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.967 0.413 . . . . 0.0 112.062 -174.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . 0.514 ' HB2' HG23 ' B' ' 478' ' ' ILE . 73.5 m-85 -86.91 -90.23 0.11 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.436 -169.033 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -102.06 -31.09 10.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.191 0.52 . . . . 0.0 110.681 -174.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.599 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 86.96 8.51 75.73 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.911 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 73.5 mt -84.55 140.03 31.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.24 0.543 . . . . 0.0 111.387 -176.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . 0.458 ' HB3' ' HE3' ' B' ' 479' ' ' LYS . 5.6 p-10 -128.13 -4.7 5.58 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.013 174.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 11.9 t -84.13 29.21 0.57 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.85 -178.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -88.41 107.57 18.92 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.64 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 57.2 m 71.34 167.36 0.31 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.431 -175.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . 62.13 34.7 16.13 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.204 0.526 . . . . 0.0 110.809 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -82.55 123.35 29.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.7 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 63.8 m -146.95 95.28 2.55 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.106 0.479 . . . . 0.0 110.147 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -82.01 15.83 2.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.719 -174.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -81.09 -18.16 47.5 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.229 177.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.246 0.918 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.956 176.736 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.819 0 N-CA-C 111.786 -0.526 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.412 ' O ' ' HB2' ' A' ' 83' ' ' HIS . 79.0 Cg_exo -48.59 115.83 1.8 Allowed 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.231 2.621 . . . . 0.0 112.46 -179.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 82' ' ' PRO . 69.0 m-70 72.3 -47.47 0.67 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.711 0.804 . . . . 0.0 111.567 -177.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 24.9 mmt -86.3 71.96 10.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.205 0.526 . . . . 0.0 111.482 -178.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -115.49 25.66 10.64 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 170.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -75.9 160.59 29.75 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.847 -173.525 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.9 p -107.3 157.82 7.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.467 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.8 m -64.07 147.59 51.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.224 0.535 . . . . 0.0 111.251 -176.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.507 HD22 HD12 ' A' ' 92' ' ' LEU . 0.1 OUTLIER -67.68 -31.68 71.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.218 -174.846 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -57.97 -41.13 82.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.369 176.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.433 ' HB3' ' HA ' ' A' ' 147' ' ' VAL . 5.3 m-20 -64.41 -40.27 95.46 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.227 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.507 HD12 HD22 ' A' ' 89' ' ' LEU . 83.3 mt -67.71 -36.62 80.96 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.889 -178.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -62.81 -19.06 63.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -177.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -79.02 -17.76 54.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.61 0.243 . . . . 0.0 111.034 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.424 HD21 HG13 ' A' ' 147' ' ' VAL . 95.4 mt -61.82 -52.69 63.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.816 0.341 . . . . 0.0 111.327 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -64.27 -22.81 67.63 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.794 -176.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -97.38 -15.31 20.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.275 0.537 . . . . 0.0 111.576 -175.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.51 ' O ' ' HG2' ' A' ' 102' ' ' ARG . 68.3 m -71.8 116.11 11.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.51 -29.06 65.99 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.707 -174.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 18.7 m -68.79 -48.54 63.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.958 0.409 . . . . 0.0 110.902 -178.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.406 ' CD2' ' HB3' ' A' ' 95' ' ' LEU . 41.9 tp -68.88 -48.05 64.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.668 -172.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.575 ' O ' ' HG ' ' A' ' 106' ' ' LEU . 7.8 ptp180 -60.3 -28.38 68.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.479 -178.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 71.1 m -66.69 -25.63 66.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.99 0.424 . . . . 0.0 110.789 177.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.441 ' O ' HD23 ' A' ' 110' ' ' LEU . 22.6 mt -81.48 -33.26 32.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.406 HD21 HD13 ' B' ' 477' ' ' ILE . 11.0 mp -67.48 -12.68 60.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.531 177.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 102' ' ' ARG . 70.3 mt -77.54 -8.0 57.14 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.348 177.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 108' ' ' PRO . 88.3 m-20 -84.21 115.01 58.17 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.705 176.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 107' ' ' ASN . 50.0 Cg_exo -54.33 -36.65 87.6 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.451 2.767 . . . . 0.0 113.373 -175.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 60.3 t60 -69.15 -45.01 71.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.594 0.235 . . . . 0.0 110.866 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 104' ' ' LEU . 49.8 tp -62.12 -38.2 88.03 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.132 0.491 . . . . 0.0 109.999 -178.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.42 ' O ' HG22 ' A' ' 115' ' ' VAL . 58.7 mtp180 -56.11 -49.79 72.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.048 174.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . 0.416 ' HA ' ' NE2' ' A' ' 112' ' ' GLN . 6.7 mm-40 -63.04 -24.16 67.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.924 -179.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 77.4 mt -78.6 -53.24 7.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -177.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' MET . . . . . 0.578 ' HG3' HG13 ' B' ' 474' ' ' VAL . 42.0 ttp -61.28 -42.21 98.27 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.367 -1.288 . . . . 0.0 111.58 -177.29 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 111' ' ' ARG . 26.3 m -72.95 -28.88 27.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.38 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -62.59 -46.2 89.37 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.145 0.497 . . . . 0.0 110.652 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 54.1 tp -56.46 -33.89 66.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.399 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -65.92 -32.27 73.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.564 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.66 -29.04 69.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.54 0.686 . . . . 0.0 110.553 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 71.94 19.04 78.06 Favored Glycine 0 C--N 1.322 -0.248 0 CA-C-N 114.89 -1.05 . . . . 0.0 113.775 172.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -70.07 -56.01 8.02 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.988 0.423 . . . . 0.0 110.076 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.599 ' O ' ' HG ' ' A' ' 126' ' ' LEU . 20.4 m-20 -123.52 41.37 3.49 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.468 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.85 -33.16 48.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.026 -177.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.55 -38.99 65.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.156 0.503 . . . . 0.0 110.896 -177.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.6 mtpt -79.08 -38.84 35.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.502 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 122' ' ' ASP . 89.6 mt -61.79 -39.09 90.48 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.962 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.88 -35.85 58.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.872 0.368 . . . . 0.0 111.326 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -84.1 -45.43 13.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.227 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.696 ' O ' ' HG2' ' A' ' 132' ' ' GLN . . . -64.09 -31.96 73.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.749 -177.403 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.553 ' HB3' ' CD2' ' A' ' 136' ' ' PHE . 5.2 m-30 -72.39 -22.49 61.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.151 0.5 . . . . 0.0 110.411 -178.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.58 ' HE2' HG12 ' A' ' 137' ' ' VAL . 1.6 mmt -85.74 1.39 49.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.995 -178.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.696 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 17.7 pt20 -101.19 -14.13 17.84 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 175.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -91.13 120.03 68.64 Favored Pre-proline 0 N--CA 1.451 -0.388 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.331 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.709 ' HA ' ' CG2' ' A' ' 137' ' ' VAL . 29.0 Cg_endo -62.6 -13.61 34.71 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.98 2.453 . . . . 0.0 112.32 -179.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 86.9 mt -83.52 -32.29 25.98 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.07 178.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.553 ' CD2' ' HB3' ' A' ' 130' ' ' TYR . 47.4 t80 -90.43 -34.36 15.65 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.303 -177.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.709 ' CG2' ' HA ' ' A' ' 134' ' ' PRO . 8.6 m -57.11 -46.16 84.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.414 178.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.457 ' N ' HG23 ' A' ' 137' ' ' VAL . 5.7 mm-40 -62.31 -43.93 97.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.45 177.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -55.1 -49.74 70.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.818 175.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.756 ' O ' ' HG ' ' A' ' 144' ' ' LEU . . . -62.81 -47.99 81.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.946 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -61.82 -33.45 74.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.4 0.619 . . . . 0.0 110.524 -176.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 68.6 m -76.8 -40.92 46.45 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.49 -177.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.514 ' SG ' ' HA ' ' A' ' 140' ' ' ALA . 26.6 p -73.07 -29.47 62.98 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.607 -177.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 140' ' ' ALA . 80.4 mt -60.52 -44.09 96.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.604 178.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.38 -20.68 69.78 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.333 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 56.6 mt -87.85 -30.48 5.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.842 0.353 . . . . 0.0 110.568 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.433 ' HA ' ' HB3' ' A' ' 91' ' ' ASN . 23.2 m -102.31 8.98 9.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -176.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 144' ' ' LEU . 42.6 mm-40 -56.95 117.79 19.78 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 120.644 0.259 . . . . 0.0 110.725 176.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -74.92 -7.22 19.03 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.563 2.175 . . . . 0.0 112.167 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 18.6 t 68.47 82.71 0.17 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.55 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -84.21 27.72 0.67 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.882 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -131.09 129.01 41.36 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.413 176.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -65.47 144.51 56.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.244 -176.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -161.19 157.91 26.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.981 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 42.6 m . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.182 176.178 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 462' ' ' ASP . . . . . 0.6 ' O ' ' HG2' ' B' ' 466' ' ' GLU . 14.1 t70 . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 120.985 0.422 . . . . 0.0 110.724 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 463' ' ' ILE . . . . . . . . . . . . . 59.8 mt -68.53 -32.25 54.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.47 -173.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 464' ' ' ARG . . . . . 0.449 ' HB2' ' OD1' ' B' ' 462' ' ' ASP . 11.5 mmm180 -58.66 -42.12 87.67 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 175.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 465' ' ' HIS . . . . . . . . . . . . . 70.8 t60 -65.96 -46.78 76.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.06 177.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 466' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' B' ' 462' ' ' ASP . 6.1 mm-40 -56.01 -50.22 71.5 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.059 -178.081 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 467' ' ' ARG . . . . . . . . . . . . . 36.2 mtm180 -65.26 -33.08 75.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.618 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 468' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.05 -31.44 62.87 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 1.4 t -66.13 -36.32 77.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.223 174.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 470' ' ' ILE . . . . . 0.598 HG12 ' O ' ' B' ' 466' ' ' GLU . 43.2 mm -61.1 -35.96 69.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.201 176.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 471' ' ' LEU . . . . . 0.469 ' O ' ' HG3' ' B' ' 475' ' ' ARG . 93.3 mt -56.44 -48.48 76.95 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.12 176.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 472' ' ' GLN . . . . . 0.442 ' HB3' HD11 ' A' ' 92' ' ' LEU . 2.4 mp0 -59.46 -40.47 86.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.039 177.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 473' ' ' CYS . . . . . . . . . . . . . 58.0 m -61.84 -55.47 29.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.976 0.417 . . . . 0.0 110.055 178.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 474' ' ' VAL . . . . . 0.578 HG13 ' HG3' ' A' ' 114' ' ' MET . 45.8 t -51.75 -50.42 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.597 177.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 475' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' B' ' 471' ' ' LEU . 82.8 mtp180 -64.47 -39.0 92.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.286 -175.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 476' ' ' TYR . . . . . 0.419 ' O ' ' HG3' ' B' ' 480' ' ' LYS . 0.9 OUTLIER -67.72 -45.84 73.88 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 120.867 0.365 . . . . 0.0 110.502 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 477' ' ' ILE . . . . . 0.406 HD13 HD21 ' A' ' 105' ' ' LEU . 97.5 mt -63.97 -60.54 2.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.434 -175.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 478' ' ' ILE . . . . . . . . . . . . . 56.3 mt -53.65 -28.1 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.763 0.316 . . . . 0.0 111.326 -178.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 479' ' ' LYS . . . . . 0.634 ' O ' ' HA2' ' B' ' 484' ' ' GLY . 27.4 ttpp -76.45 -32.55 58.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.078 -173.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 480' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' B' ' 476' ' ' TYR . 0.0 OUTLIER -114.39 -15.8 12.05 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.02 -0.672 . . . . 0.0 112.108 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 481' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -91.36 -60.24 1.94 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.041 0.448 . . . . 0.0 111.748 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 482' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -99.23 -91.63 0.28 Allowed 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -168.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 483' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -90.84 -35.71 14.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.326 -169.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 484' ' ' GLY . . . . . 0.634 ' HA2' ' O ' ' B' ' 479' ' ' LYS . . . 93.67 6.96 61.95 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.138 -178.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 43.2 mt -86.13 162.9 18.16 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.811 0.339 . . . . 0.0 110.781 -178.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 486' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -175.45 -43.82 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.742 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 487' ' ' THR . . . . . . . . . . . . . 11.3 t -104.32 28.3 7.01 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.992 -179.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 488' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -116.39 107.9 15.37 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.99 -171.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 489' ' ' SER . . . . . . . . . . . . . 47.9 m -153.26 100.93 2.5 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.267 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 490' ' ' ALA . . . . . . . . . . . . . . . -141.33 52.12 1.56 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.525 0.679 . . . . 0.0 110.052 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 491' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -120.22 18.8 12.26 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.242 -176.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 492' ' ' SER . . . . . . . . . . . . . 23.8 t -124.68 136.59 54.03 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.107 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 493' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -97.78 10.83 39.12 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.195 0.522 . . . . 0.0 110.518 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 494' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -99.46 -16.9 18.19 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.025 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . . . . . . . . . 42.4 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.946 -179.651 . . . . . . . . 0 0 . 1 stop_ save_