data_2kjg_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 2kjg _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.3 t70 . . . . . 0 C--O 1.247 0.933 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.09 -23.69 62.37 Favored 'Trans proline' 0 CA--C 1.548 1.218 0 C-N-CA 123.804 3.002 . . . . 0.0 115.274 175.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.433 ' OE1' ' HG2' ' A' ' 65' ' ' MET . 32.8 mm-40 -65.14 -34.57 78.72 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.382 0.992 . . . . 0.0 109.917 179.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -67.36 -42.78 82.9 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.753 -177.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.483 ' O ' ' HG3' ' A' ' 14' ' ' GLN . 11.5 p -65.02 -34.59 71.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.123 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.415 ' HZ3' ' CD ' ' A' ' 8' ' ' GLU . 56.8 mtmt -65.69 -38.03 88.12 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.914 178.077 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.53 -44.58 93.15 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.503 0.668 . . . . 0.0 109.614 174.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -39.09 90.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.672 178.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 10' ' ' VAL . 26.4 mt-30 . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 122.73 0.412 . . . . 0.0 111.516 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 34.3 m . . . . . 0 N--CA 1.446 -0.64 0 CA-C-O 120.728 0.299 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -76.69 113.25 14.12 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -58.31 -34.8 70.97 Favored 'General case' 0 C--N 1.308 -1.239 0 O-C-N 123.557 0.536 . . . . 0.0 110.607 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -74.94 -37.8 61.9 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.809 -173.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.541 ' O ' HG12 ' A' ' 27' ' ' ILE . 19.3 tp -77.44 -40.81 42.09 Favored 'General case' 0 N--CA 1.423 -1.817 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.747 -177.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 86.1 t -65.13 -39.1 84.44 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 59.9 ttp -57.86 -37.11 73.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.711 176.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -75.86 -40.13 55.27 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.431 177.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.4 mm -56.99 -51.75 64.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.05 -41.54 98.23 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-N 115.047 -0.978 . . . . 0.0 110.247 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -63.31 -45.12 92.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.412 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -62.9 -44.96 94.68 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.847 -175.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.503 ' CD1' HD11 ' A' ' 70' ' ' LEU . 46.0 pt -70.31 -37.01 69.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 119.875 -0.73 . . . . 0.0 109.74 176.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.19 -53.4 55.8 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 123.017 0.527 . . . . 0.0 111.223 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.462 HD11 ' N ' ' A' ' 34' ' ' ASP . 4.1 pp -59.45 -33.69 71.59 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.462 ' N ' HD11 ' A' ' 33' ' ' LEU . 14.9 t70 -71.04 -47.89 55.94 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.3 tp . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 123.429 0.692 . . . . 0.0 112.266 -179.413 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.516 ' O ' HG12 ' A' ' 45' ' ' ILE . 14.4 tt . . . . . 0 N--CA 1.448 -0.546 0 CA-C-O 120.357 0.122 . . . . 0.0 110.892 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.53 ' HG2' ' OE1' ' A' ' 71' ' ' GLN . 42.7 mtmt -59.36 -48.67 80.75 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 177.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.1 m -65.21 -38.74 91.4 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.589 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.8 m -58.81 -41.09 85.96 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 120.863 0.363 . . . . 0.0 110.405 175.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.516 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.5 mm -58.77 -46.31 90.84 Favored 'Isoleucine or valine' 0 C--N 1.343 0.314 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 176.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 42' ' ' LYS . 67.6 mt -51.76 -49.61 35.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.208 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -61.14 -53.72 53.5 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.408 0.623 . . . . 0.0 110.71 -176.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 51.7 t -66.79 -42.82 89.82 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.891 -172.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -70.95 -37.63 72.82 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.44 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.526 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 36.2 t -73.47 -31.41 63.76 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.567 0.699 . . . . 0.0 109.798 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.3 t -73.54 -43.83 59.0 Favored 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.509 ' O ' HG12 ' A' ' 56' ' ' ILE . 68.9 m-70 -103.34 37.42 2.0 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 -176.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 50' ' ' SER . 80.0 mt -47.11 -41.66 17.7 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -57.46 -46.65 83.4 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.522 ' HA ' ' OE1' ' A' ' 55' ' ' GLU . 2.2 tp10 -74.58 -34.31 62.86 Favored 'General case' 0 N--CA 1.432 -1.325 0 C-N-CA 119.626 -0.83 . . . . 0.0 111.312 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 52' ' ' HIS . 47.1 mm -61.26 -45.28 98.92 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.174 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -71.76 -22.97 61.53 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.79 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.448 ' HB2' ' NZ ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -68.53 -52.72 28.95 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.628 ' HB2' ' CE2' ' A' ' 63' ' ' TYR . 16.9 m120 -112.53 52.66 0.77 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.8 pttp -60.7 -31.55 70.82 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -66.44 -47.53 72.86 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 121.457 0.646 . . . . 0.0 109.396 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.402 ' O ' HG12 ' A' ' 66' ' ' ILE . 93.1 t80 -63.12 -51.5 66.27 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 114.412 -1.267 . . . . 0.0 110.714 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.628 ' CE2' ' HB2' ' A' ' 59' ' ' ASN . 79.0 m-85 -68.99 -26.44 65.02 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -176.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -71.23 -50.72 30.0 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.146 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.433 ' HG2' ' OE1' ' A' ' 8' ' ' GLU . 73.6 mtm -66.0 -43.27 88.2 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.54 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.542 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 46.2 pt -65.93 -41.71 90.44 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.634 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.195 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.26 -39.0 71.9 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 117.893 0.315 . . . . 0.0 110.909 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -64.33 -56.6 13.33 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 177.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 95.2 mt -56.63 -44.33 80.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.446 1.099 . . . . 0.0 112.514 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.55 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 82.5 mt -54.57 -50.45 67.95 Favored 'General case' 0 C--O 1.212 -0.876 0 C-N-CA 123.531 0.732 . . . . 0.0 111.826 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.53 ' OE1' ' HG2' ' A' ' 42' ' ' LYS . 46.3 mt-30 -70.16 -45.67 66.27 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 121.984 0.897 . . . . 0.0 109.917 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 46.4 ttt85 -57.91 -45.41 86.54 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 126.62 1.968 . . . . 0.0 111.319 -176.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -94.48 -16.54 23.26 Favored 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.55 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.23 -33.91 77.12 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.054 178.601 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -68.12 -25.61 65.38 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.384 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -99.38 -47.61 5.09 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.9 pt -115.88 -20.79 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -177.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.544 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 111.15 142.43 9.01 Favored Glycine 0 CA--C 1.501 -0.795 0 N-CA-C 110.999 -0.841 . . . . 0.0 110.999 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tp -62.45 -37.43 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 117.203 0.502 . . . . 0.0 111.559 -174.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -53.19 -48.09 68.34 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.858 0.837 . . . . 0.0 109.455 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.424 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 85.4 m-20 -68.0 -42.97 79.91 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 113.787 -1.551 . . . . 0.0 112.204 -178.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.544 HG21 ' O ' ' A' ' 78' ' ' GLY . 16.8 t -65.49 -45.8 91.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.3 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -56.64 -42.81 79.52 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.435 0.636 . . . . 0.0 111.075 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -45.7 86.84 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.9 mt -63.09 -36.28 83.06 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.632 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.6 mm -64.44 -41.08 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.7 mt -62.41 -38.74 90.84 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-O 121.363 0.601 . . . . 0.0 110.558 176.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.4 m -64.91 -33.44 76.02 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.473 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 29.5 m -72.1 -31.7 66.3 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.488 0.715 . . . . 0.0 111.479 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.6 pt . . . . . 0 C--N 1.316 -0.858 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.621 -178.829 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.431 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 14.3 t70 . . . . . 0 C--O 1.243 0.745 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.438 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 13.9 Cg_exo -70.82 -31.53 15.65 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.665 2.243 . . . . 0.0 113.088 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.67 -35.95 57.61 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -61.32 -42.72 99.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.434 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.73 -34.26 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 CA-C-O 121.055 0.455 . . . . 0.0 109.988 178.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.438 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 63.5 mttp -63.08 -37.02 85.54 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 174.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.5 mt -63.31 -37.33 86.82 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.115 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.447 HH11 ' HA ' ' A' ' 89' ' ' THR . 24.9 tpt180 -67.5 -35.25 78.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.362 0.601 . . . . 0.0 109.76 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.084 178.474 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 30.1 m . . . . . 0 N--CA 1.44 -0.927 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -81.16 119.63 23.83 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 174.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.403 ' CE1' HD23 ' A' ' 87' ' ' LEU . 86.2 t80 -53.25 -47.89 68.68 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.683 0.615 . . . . 0.0 111.692 -179.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -59.15 -36.01 74.51 Favored 'General case' 0 CA--C 1.497 -1.09 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.173 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.586 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.2 tp -76.51 -42.62 42.68 Favored 'General case' 0 N--CA 1.419 -2.006 0 C-N-CA 119.441 -0.904 . . . . 0.0 111.248 -178.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.598 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 65.0 t -59.22 -44.71 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 118.205 0.457 . . . . 0.0 109.874 177.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 52.1 ttp -58.76 -38.03 77.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.991 177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -72.69 -38.59 67.52 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.123 176.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.1 mm -57.25 -49.61 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 66.8 mt -63.96 -35.23 79.99 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.743 -1.117 . . . . 0.0 110.496 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.73 -44.64 63.77 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 124.139 0.976 . . . . 0.0 110.092 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.563 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 17.3 tt0 -69.7 -39.5 76.88 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.759 -177.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 41.7 pt -68.34 -37.05 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 119.832 -0.747 . . . . 0.0 109.185 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -58.73 -46.28 87.75 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.589 0.555 . . . . 0.0 111.086 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 30' ' ' GLU . 4.4 pp -63.88 -32.85 74.52 Favored 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -177.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.53 -48.74 18.41 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.364 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 51.8 tp . . . . . 0 CA--C 1.517 -0.309 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.748 -179.774 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.542 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.8 tt . . . . . 0 C--O 1.224 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 111.333 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -63.21 -34.36 77.48 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.925 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.9 m -79.24 -33.86 43.22 Favored 'General case' 0 N--CA 1.419 -2.007 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 15.3 m -59.59 -41.26 89.89 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.571 176.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.542 HG12 ' O ' ' A' ' 41' ' ' ILE . 43.1 mm -53.76 -48.87 60.57 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.853 176.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 69.6 mt -53.5 -49.12 56.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.228 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.63 -53.01 58.15 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.124 0.487 . . . . 0.0 110.417 -176.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.3 t -60.29 -46.03 95.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.449 -174.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -65.7 -37.54 86.74 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.06 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.0 m -72.85 -22.16 60.83 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.116 0.484 . . . . 0.0 111.092 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.1 t -90.09 -9.99 46.38 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.686 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.447 ' O ' HG12 ' A' ' 56' ' ' ILE . 87.2 m-70 -138.46 36.33 2.26 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 -178.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.413 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 80.9 mt -47.64 -38.62 15.15 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -174.107 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -53.79 -50.26 66.48 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.256 0.622 . . . . 0.0 112.275 -175.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.453 ' OE2' ' HD3' ' A' ' 58' ' ' LYS . 9.2 tp10 -73.69 -35.41 65.16 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.286 0.565 . . . . 0.0 109.654 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.5 mm -60.12 -50.0 81.9 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.301 -176.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.413 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 13.6 ptt180 -77.6 -24.73 49.6 Favored 'General case' 0 C--N 1.312 -1.041 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.533 -178.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.453 ' HD3' ' OE2' ' A' ' 55' ' ' GLU . 62.7 tttt -60.1 -43.28 95.66 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 123.204 0.601 . . . . 0.0 109.457 177.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -126.32 57.24 1.41 Allowed 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.898 178.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -60.77 -28.54 68.81 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.341 -175.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -61.52 -53.25 58.87 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.39 -50.6 73.33 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.08 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.447 ' HA ' HG12 ' A' ' 66' ' ' ILE . 71.2 m-85 -68.94 -30.4 68.84 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -176.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -75.03 -37.97 61.61 Favored 'General case' 0 C--O 1.248 1.0 0 C-N-CA 119.506 -0.877 . . . . 0.0 109.101 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.6 mtm -69.49 -48.08 61.8 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.142 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.5 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.6 pt -64.11 -38.84 83.49 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.713 0 C-N-CA 119.404 -0.919 . . . . 0.0 111.573 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.533 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.28 -39.74 67.21 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.884 0.373 . . . . 0.0 110.978 178.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.1 -55.69 11.57 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.377 178.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.4 mt -58.12 -41.3 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.805 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.612 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 94.5 mt -56.44 -47.93 78.08 Favored 'General case' 0 C--O 1.213 -0.837 0 C-N-CA 122.633 0.373 . . . . 0.0 111.11 179.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.0 mt-30 -65.08 -50.01 67.81 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.726 0.774 . . . . 0.0 109.714 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -57.9 -52.95 63.39 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-N 114.009 -1.45 . . . . 0.0 112.076 -177.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.431 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 29.5 m-85 -83.41 -19.88 35.18 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.612 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.36 -34.41 77.24 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.509 -0.876 . . . . 0.0 109.708 175.714 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.491 ' HG3' ' CE2' ' A' ' 74' ' ' TYR . 55.2 mttp -81.62 -16.76 50.46 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 174.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -86.84 -51.33 6.13 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.564 177.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.8 pt -121.23 -30.5 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.527 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 128.65 138.83 4.61 Favored Glycine 0 C--N 1.314 -0.676 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.237 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.5 tp -58.39 -39.34 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 122.968 0.507 . . . . 0.0 112.112 -174.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -57.9 -43.99 86.5 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.581 0.705 . . . . 0.0 110.609 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.432 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 40.4 m-80 -67.26 -46.83 72.52 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.34 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.527 HG21 ' O ' ' A' ' 78' ' ' GLY . 23.5 t -61.96 -47.69 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.129 -176.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -56.86 -42.06 79.06 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 123.58 0.55 . . . . 0.0 111.339 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -47.7 79.48 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 179.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 88.3 mt -62.74 -29.6 70.8 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.8 mm -64.82 -42.28 94.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.403 HD23 ' CE1' ' A' ' 21' ' ' PHE . 85.4 mt -64.01 -38.67 91.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.936 178.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.1 m -61.53 -33.92 74.64 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.146 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.447 ' HA ' HH11 ' A' ' 13' ' ' ARG . 23.0 m -73.61 -40.17 64.03 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 120.592 0.235 . . . . 0.0 111.425 -178.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 42.3 pt . . . . . 0 C--N 1.319 -0.739 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.504 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.424 ' OD2' ' HD2' ' A' ' 72' ' ' ARG . 12.1 t70 . . . . . 0 C--O 1.245 0.838 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -68.19 -30.66 30.87 Favored 'Trans proline' 0 C--O 1.24 0.593 0 C-N-CA 122.707 2.271 . . . . 0.0 113.466 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -76.11 -38.17 57.19 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -59.29 -43.57 92.57 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.151 -1.386 . . . . 0.0 111.366 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.6 p -65.38 -34.96 73.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.606 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HE3' ' SD ' ' A' ' 65' ' ' MET . 56.6 mtmt -66.8 -36.45 82.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.744 176.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.8 -39.54 94.57 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -57.95 -37.79 74.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.318 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 . . . . . 0 C--N 1.315 -0.931 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.779 -179.152 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 27.6 m . . . . . 0 C--O 1.252 1.223 0 CA-C-O 120.87 0.367 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -91.68 129.93 37.57 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -51.99 -41.41 62.16 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 124.034 0.934 . . . . 0.0 111.195 177.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -67.7 -37.46 82.32 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.532 -175.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.516 ' O ' HG12 ' A' ' 27' ' ' ILE . 15.9 tp -77.19 -35.93 55.38 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.119 -176.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.414 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 88.6 t -68.88 -42.57 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 56.1 ttp -60.91 -33.61 73.4 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.931 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -70.63 -42.93 70.24 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 123.085 0.24 . . . . 0.0 110.747 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.516 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.83 -49.07 80.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.6 mt -63.76 -40.09 95.87 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.713 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -67.41 -47.39 70.39 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.148 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -62.01 -38.96 90.6 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.704 -176.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.456 ' CD1' HD13 ' A' ' 70' ' ' LEU . 35.0 pt -73.06 -38.25 55.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.705 176.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -58.22 -52.85 63.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 124.124 0.97 . . . . 0.0 111.029 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -63.52 -30.07 71.25 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.179 -178.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.7 -49.51 18.09 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.391 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.4 tp . . . . . 0 C--N 1.317 -0.838 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.356 -175.618 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.502 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.5 tt . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.479 ' O ' HG13 ' A' ' 46' ' ' ILE . 63.7 pttt -61.21 -36.03 78.82 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.159 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.4 m -74.01 -35.29 64.39 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.783 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.411 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 16.7 m -63.17 -39.63 95.2 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 175.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.502 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.7 mm -57.07 -46.36 84.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.698 176.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 42' ' ' LYS . 69.7 mt -53.22 -47.01 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.871 -178.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.411 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 14.4 m-85 -62.35 -52.15 64.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.555 0.693 . . . . 0.0 110.233 -177.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.0 t -66.19 -42.64 91.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.904 -173.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -67.94 -34.58 76.86 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.215 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.9 m -76.36 -24.24 54.17 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.323 0.582 . . . . 0.0 111.058 178.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.3 t -79.67 -29.31 40.82 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.037 0.446 . . . . 0.0 110.488 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.468 ' O ' HG12 ' A' ' 56' ' ' ILE . 67.4 m-70 -120.76 37.64 4.24 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -175.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.47 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 87.5 mt -47.02 -51.7 16.69 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 -175.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 3.8 p30 -59.68 -33.02 71.04 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -73.89 -46.3 45.41 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 121.193 0.52 . . . . 0.0 110.041 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.468 HG12 ' O ' ' A' ' 52' ' ' HIS . 47.3 mm -56.27 -40.96 68.91 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.15 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.627 179.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.47 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 82.8 mtp180 -63.38 -38.73 92.3 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 177.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 50.5 mttp -63.15 -48.37 78.74 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.861 0.838 . . . . 0.0 110.532 -176.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -123.43 51.72 1.46 Allowed 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.918 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -59.7 -19.62 50.98 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.955 -1.021 . . . . 0.0 111.986 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -61.01 -57.81 11.05 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.374 1.083 . . . . 0.0 108.094 174.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -65.87 -51.25 60.38 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.194 -1.821 . . . . 0.0 109.969 -176.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.419 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.7 m-85 -66.99 -25.95 66.57 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -175.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -83.68 -39.43 20.21 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 118.728 -1.189 . . . . 0.0 109.896 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.472 ' O ' HG13 ' A' ' 69' ' ' ILE . 73.3 mtm -64.11 -44.27 92.77 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.476 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.475 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.6 pt -62.74 -38.59 82.1 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.302 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.938 178.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.43 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -52.68 -45.5 66.84 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.399 0.437 . . . . 0.0 111.797 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -74.5 -36.33 63.22 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 119.922 -0.711 . . . . 0.0 112.139 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 65' ' ' MET . 80.4 mt -63.99 -46.23 94.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-O 120.627 0.251 . . . . 0.0 110.347 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 79.6 mt -54.07 -45.33 71.69 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 123.461 0.704 . . . . 0.0 110.987 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 48.5 mt-30 -66.65 -49.38 66.38 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.574 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.424 ' HD2' ' OD2' ' A' ' 6' ' ' ASP . 41.4 ttm180 -61.31 -45.22 95.33 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 124.48 1.112 . . . . 0.0 111.74 -177.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -88.93 -18.09 28.19 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -176.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.534 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.49 -29.4 68.82 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 173.094 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -71.9 -31.58 66.55 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.871 175.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -86.44 -52.08 5.81 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -177.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.1 pt -121.25 -27.22 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -172.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.59 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 121.85 146.66 7.4 Favored Glycine 0 CA--C 1.496 -1.124 0 C-N-CA 119.513 -1.327 . . . . 0.0 111.804 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.1 tp -61.8 -40.14 85.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -56.16 -46.35 79.34 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-O 121.825 0.821 . . . . 0.0 110.137 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.417 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 91.4 m-20 -65.03 -44.16 90.01 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 114.051 -1.431 . . . . 0.0 111.623 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.59 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.9 t -65.45 -42.79 94.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.467 -177.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -57.33 -44.97 84.71 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.264 0.554 . . . . 0.0 110.655 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.75 -43.06 94.56 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 86.7 mt -65.95 -37.34 85.78 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.1 mm -63.87 -41.06 91.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 176.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.2 mt -62.98 -39.45 94.76 Favored 'General case' 0 C--O 1.21 -1.01 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.515 175.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 50.0 m -63.82 -33.31 75.4 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.65 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 41.2 m -70.49 -37.71 74.24 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.336 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.5 pt . . . . . 0 C--N 1.317 -0.833 0 C-N-CA 119.884 -0.726 . . . . 0.0 111.597 179.482 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.8 t70 . . . . . 0 N--CA 1.44 -0.97 0 N-CA-C 110.652 -0.129 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -69.84 -29.12 23.97 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.547 2.164 . . . . 0.0 113.131 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.459 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 20.0 mm-40 -75.38 -31.34 60.43 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -178.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -62.73 -40.75 98.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.902 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -71.28 -34.35 53.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.05 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -61.75 -36.07 79.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.037 173.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 95.5 mt -60.69 -35.84 77.29 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.602 176.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 mmt85 -65.04 -29.36 70.25 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.163 0.506 . . . . 0.0 110.318 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.515 179.435 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.6 m . . . . . 0 C--O 1.253 1.252 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -74.72 121.81 22.28 Favored 'General case' 0 CA--C 1.499 -0.995 0 C-N-CA 119.881 -0.728 . . . . 0.0 109.522 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -55.48 -41.54 73.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -56.68 -42.13 78.52 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.79 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.589 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.6 tp -75.64 -43.1 49.51 Favored 'General case' 0 N--CA 1.417 -2.119 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.658 -175.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.479 HG22 ' HH ' ' A' ' 63' ' ' TYR . 61.0 t -63.82 -38.97 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.2 ttp -59.81 -35.04 73.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.989 176.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -75.83 -41.7 51.85 Favored 'General case' 0 C--O 1.197 -1.667 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.449 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.5 mm -55.97 -51.2 63.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 121.456 0.646 . . . . 0.0 109.73 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 76.2 mt -64.69 -34.14 77.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.878 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -72.45 -44.87 61.76 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 122.024 0.916 . . . . 0.0 109.979 -179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -65.62 -37.84 87.73 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.893 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.7 pt -72.07 -37.87 61.6 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.852 176.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -61.5 -52.53 64.13 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 124.165 0.986 . . . . 0.0 110.908 -178.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.19 -30.9 71.95 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 116.322 -0.399 . . . . 0.0 112.06 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -75.43 -46.54 32.12 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.971 0.415 . . . . 0.0 110.231 178.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.481 HD21 ' CE1' ' A' ' 74' ' ' TYR . 58.7 tp . . . . . 0 C--O 1.243 0.758 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.889 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.574 ' O ' HG12 ' A' ' 45' ' ' ILE . 14.8 tt . . . . . 0 C--O 1.214 -0.788 0 CA-C-O 120.622 0.249 . . . . 0.0 110.454 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.485 ' O ' HG13 ' A' ' 46' ' ' ILE . 49.7 mtpt -55.31 -50.09 70.49 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-O 121.688 0.756 . . . . 0.0 110.008 174.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.0 m -59.05 -47.12 86.39 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 113.707 -1.588 . . . . 0.0 110.279 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 23.1 m -58.34 -39.55 79.77 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 123.771 0.669 . . . . 0.0 111.077 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.574 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.3 mm -58.2 -42.54 83.66 Favored 'Isoleucine or valine' 0 C--N 1.344 0.326 0 C-N-CA 123.145 0.578 . . . . 0.0 109.812 176.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 42' ' ' LYS . 63.9 mt -59.36 -47.45 90.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.59 -175.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -61.79 -50.79 70.92 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 121.671 0.748 . . . . 0.0 109.462 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.52 -47.22 93.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.573 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -64.99 -39.57 93.66 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.837 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.9 m -70.17 -27.57 64.64 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.135 0.493 . . . . 0.0 111.457 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -82.34 -32.11 29.52 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.306 0.574 . . . . 0.0 110.42 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.534 ' O ' HG12 ' A' ' 56' ' ' ILE . 90.0 m-70 -114.97 35.52 4.28 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.447 -174.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.6 mt -47.35 -39.0 14.01 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.65 1.18 . . . . 0.0 113.734 -177.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.515 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 12.3 t70 -54.17 -50.85 66.07 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -73.79 -38.08 64.75 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.624 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.534 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.8 mm -56.5 -52.14 56.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.668 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.949 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.06 -36.8 82.84 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -176.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 33.4 mtmm -71.78 -24.79 61.81 Favored 'General case' 0 CA--C 1.51 -0.572 0 C-N-CA 119.921 -0.712 . . . . 0.0 111.277 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -130.24 49.71 2.26 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -178.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.54 -31.07 65.73 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.58 -1.191 . . . . 0.0 112.773 -177.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.67 -50.23 67.84 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -59.84 -50.77 72.48 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.501 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.479 ' HH ' HG22 ' A' ' 24' ' ' VAL . 69.6 m-85 -69.7 -25.6 63.95 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -177.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -75.73 -44.63 40.91 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 176.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.1 mtm -61.13 -50.83 71.61 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.33 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.58 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.6 pt -64.43 -38.73 83.34 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.746 0 C-N-CA 119.47 -0.892 . . . . 0.0 111.801 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -59.31 -41.02 88.04 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 117.927 0.331 . . . . 0.0 110.642 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.28 -55.32 29.47 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 89.8 mt -58.03 -42.4 82.71 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 CA-C-N 115.212 -0.903 . . . . 0.0 111.929 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.4 mt -54.55 -47.87 72.69 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 122.812 0.445 . . . . 0.0 111.284 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 64.5 mt-30 -69.73 -47.95 61.24 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.74 0.781 . . . . 0.0 109.557 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -59.47 -43.06 93.31 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 113.989 -1.459 . . . . 0.0 110.782 -176.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -93.68 -15.5 25.22 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.488 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.75 -29.71 69.0 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 174.291 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -77.61 -28.33 51.49 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.75 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -87.1 -51.64 5.88 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.256 -0.577 . . . . 0.0 111.486 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.3 pt -119.52 -26.71 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -173.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.527 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 117.04 148.17 8.77 Favored Glycine 0 C--N 1.307 -1.057 0 C-N-CA 120.298 -0.953 . . . . 0.0 110.996 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.8 tp -64.87 -37.87 81.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 117.029 0.414 . . . . 0.0 111.999 -174.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -55.92 -42.84 76.7 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 122.125 0.965 . . . . 0.0 110.148 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.47 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 48.6 m-80 -67.05 -50.06 63.15 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.145 -1.388 . . . . 0.0 111.324 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.527 HG21 ' O ' ' A' ' 78' ' ' GLY . 17.3 t -61.67 -39.55 83.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -177.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -51.05 -50.39 58.74 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.868 1.267 . . . . 0.0 110.129 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.11 -40.58 71.4 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.062 -177.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.7 mt -64.9 -34.8 79.25 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.125 -178.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.426 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.8 mm -68.38 -41.96 83.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.5 mt -62.11 -40.73 96.88 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.137 0.494 . . . . 0.0 110.889 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 48.9 m -63.96 -33.38 75.6 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.786 177.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.4 m -74.19 -48.26 30.24 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.989 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.4 pt . . . . . 0 C--N 1.326 -0.443 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -176.154 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.535 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 15.0 t70 . . . . . 0 N--CA 1.448 -0.562 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.522 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 17.3 Cg_exo -69.76 -28.26 25.48 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.947 2.432 . . . . 0.0 113.9 177.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -75.16 -33.27 61.48 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -60.17 -44.57 94.92 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.484 -1.234 . . . . 0.0 110.552 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -66.78 -34.09 67.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.235 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.2 mttt -62.77 -37.2 85.7 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.38 -38.17 88.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.151 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.6 mtp180 -72.4 -25.43 61.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.31 0.576 . . . . 0.0 110.339 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 . . . . . 0 CA--C 1.547 0.828 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.212 174.679 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 29.7 m . . . . . 0 N--CA 1.432 -1.347 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -74.92 121.85 22.54 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.316 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -53.43 -50.62 64.83 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.681 0.613 . . . . 0.0 111.658 -178.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -64.61 -29.54 70.55 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.359 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.604 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.2 tp -75.93 -39.6 55.85 Favored 'General case' 0 N--CA 1.425 -1.703 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.054 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 62.8 t -63.36 -43.21 98.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 175.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 60.7 ttp -57.94 -39.34 77.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.667 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.72 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 58.9 tt0 -67.63 -45.42 75.44 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.736 176.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.604 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.6 mm -55.93 -44.8 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 CA-C-O 121.403 0.621 . . . . 0.0 110.047 -179.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 68.5 mt -68.65 -33.87 74.74 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.7 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -71.63 -43.6 65.87 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.197 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.72 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.7 mm-40 -53.66 -53.99 44.19 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.664 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 31.7 pt -67.59 -34.28 67.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.37 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -63.23 -51.46 66.17 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.317 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.4 pp -72.19 -30.29 64.81 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.462 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.42 ' N ' HD12 ' A' ' 33' ' ' LEU . 15.6 t70 -75.11 -45.43 41.18 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.245 -178.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.2 tt . . . . . 0 N--CA 1.444 -0.734 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -176.981 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.442 ' O ' HG12 ' A' ' 45' ' ' ILE . 13.9 tt . . . . . 0 N--CA 1.434 -1.236 0 N-CA-C 111.425 0.158 . . . . 0.0 111.425 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.553 ' O ' HG13 ' A' ' 46' ' ' ILE . 11.2 ptmm? -65.52 -32.33 73.87 Favored 'General case' 0 CA--C 1.509 -0.624 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.535 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.4 m -66.3 -44.61 82.99 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.065 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.422 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 48.4 m -63.68 -38.36 90.83 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.339 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 41' ' ' ILE . 25.7 mm -54.68 -43.57 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.55 0.74 . . . . 0.0 110.077 175.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.553 HG13 ' O ' ' A' ' 42' ' ' LYS . 74.6 mt -54.6 -50.26 60.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.597 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.422 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 20.2 m-85 -62.88 -53.1 59.34 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.511 0.672 . . . . 0.0 110.321 -177.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.417 HG21 ' O ' ' A' ' 44' ' ' SER . 60.2 t -58.78 -44.94 91.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.667 -176.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -71.21 -27.37 63.45 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.9 m -80.95 -25.48 37.36 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.372 0.606 . . . . 0.0 110.372 176.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.1 t -78.07 -52.94 7.98 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.489 177.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.56 ' O ' HG12 ' A' ' 56' ' ' ILE . 86.0 m-70 -98.46 48.53 0.99 Allowed 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.316 -172.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 98.2 mt -48.59 -48.04 39.34 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -175.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.412 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 3.1 t70 -54.11 -52.04 62.26 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -174.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.437 ' CG ' ' HH ' ' A' ' 63' ' ' TYR . 5.0 tp10 -72.59 -32.18 65.78 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.759 -0.776 . . . . 0.0 110.031 -176.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.56 HG12 ' O ' ' A' ' 52' ' ' HIS . 44.7 mm -63.57 -49.74 81.18 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.033 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.101 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.3 ptt-85 -69.76 -29.81 67.24 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -175.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 54' ' ' ASP . 32.5 mmtp -70.98 -34.05 71.03 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.012 0.434 . . . . 0.0 110.661 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -131.36 53.91 1.95 Allowed 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -59.65 -35.04 73.63 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.208 -176.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -64.38 -40.47 95.89 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 120.955 0.407 . . . . 0.0 110.925 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -65.61 -50.13 66.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.382 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.476 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.3 m-85 -68.88 -34.26 75.14 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -177.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.61 -45.09 76.45 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.274 177.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.6 mtm -65.69 -44.0 87.54 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.998 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.581 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 45.0 pt -66.04 -39.08 83.54 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.824 0 C-N-CA 118.588 -1.245 . . . . 0.0 111.173 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.569 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.05 -40.67 73.87 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 117.99 0.359 . . . . 0.0 110.839 178.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.89 -54.15 35.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.749 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 98.1 mt -58.27 -41.47 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.289 -179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 96.9 mt -55.97 -48.73 75.28 Favored 'General case' 0 C--O 1.216 -0.694 0 C-N-CA 122.989 0.516 . . . . 0.0 111.506 178.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.569 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 57.3 mt-30 -68.37 -45.82 71.76 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.483 0.658 . . . . 0.0 109.78 -178.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 45.3 ttm180 -57.81 -49.34 76.98 Favored 'General case' 0 N--CA 1.424 -1.76 0 C-N-CA 124.71 1.204 . . . . 0.0 111.831 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.535 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 66.1 m-85 -87.86 -15.06 37.8 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 -176.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.529 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.14 -32.37 73.44 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 174.753 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.425 ' NZ ' ' HB3' ' A' ' 75' ' ' LYS . 7.2 mtpm? -81.25 -18.02 47.44 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.144 176.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -94.48 -47.42 6.56 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.163 -176.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.1 pt -126.55 -30.09 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.572 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 123.77 142.89 6.13 Favored Glycine 0 CA--C 1.499 -0.908 0 C-N-CA 120.238 -0.982 . . . . 0.0 112.043 177.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.3 tp -62.03 -33.64 59.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 117.018 0.409 . . . . 0.0 111.372 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -53.59 -49.47 67.7 Favored 'General case' 0 C--O 1.248 0.979 0 CA-C-O 122.376 1.084 . . . . 0.0 109.156 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -68.47 -46.98 68.27 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 113.795 -1.548 . . . . 0.0 110.756 -177.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.3 t -62.99 -38.24 81.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.737 -177.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -52.92 -50.34 64.16 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.673 0.749 . . . . 0.0 109.429 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -39.33 73.71 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.234 -178.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.446 ' O ' ' HB ' ' A' ' 88' ' ' THR . 87.0 mt -68.12 -32.77 73.29 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -178.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.4 ' O ' ' HB ' ' A' ' 89' ' ' THR . 43.7 mm -67.12 -37.69 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 CA-C-O 121.777 0.799 . . . . 0.0 108.983 175.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.36 -38.68 88.16 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.135 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.446 ' HB ' ' O ' ' A' ' 85' ' ' LEU . 90.5 m -61.3 -34.47 75.27 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.973 0.909 . . . . 0.0 110.562 175.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 86' ' ' ILE . 28.7 m -57.32 -49.97 74.43 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.955 0.902 . . . . 0.0 110.47 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.5 pt . . . . . 0 C--N 1.318 -0.787 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.985 -176.3 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.438 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 14.3 t70 . . . . . 0 N--CA 1.441 -0.923 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.492 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 5.5 Cg_exo -71.58 -25.62 20.76 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.59 2.193 . . . . 0.0 113.426 -178.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -76.84 -40.13 48.83 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -59.49 -41.54 90.07 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.085 178.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.412 HG13 ' O ' ' A' ' 7' ' ' PRO . 7.8 p -66.09 -34.55 70.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-O 121.347 0.594 . . . . 0.0 110.043 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.492 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 64.4 mttp -65.04 -35.48 81.29 Favored 'General case' 0 C--O 1.217 -0.655 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 176.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.69 -42.47 98.97 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.461 ' HG2' HG23 ' A' ' 89' ' ' THR . 38.0 mtm180 -66.79 -30.2 70.34 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 121.724 0.774 . . . . 0.0 110.027 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 . . . . . 0 C--N 1.311 -1.065 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.621 177.679 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 9.2 m . . . . . 0 N--CA 1.435 -1.196 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -75.79 125.38 28.96 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -56.04 -36.12 67.66 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 123.521 0.513 . . . . 0.0 110.916 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -73.49 -31.55 63.79 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.045 -177.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.599 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.5 tp -76.61 -39.69 51.68 Favored 'General case' 0 N--CA 1.42 -1.927 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.217 -177.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.502 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 60.3 t -64.26 -44.4 97.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 176.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 14.9 tmm? -58.85 -32.4 69.4 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.465 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.676 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 63.8 tt0 -74.49 -42.13 59.5 Favored 'General case' 0 C--O 1.192 -1.933 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.483 176.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.599 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.2 mm -56.24 -44.51 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 CA-C-O 121.672 0.749 . . . . 0.0 109.255 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 69.9 mt -67.33 -31.34 71.55 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.668 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -72.4 -48.61 40.05 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.014 0.926 . . . . 0.0 110.115 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.676 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.2 mm-40 -53.79 -53.85 46.6 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.414 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.6 pt -66.77 -38.53 81.7 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.546 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.224 -177.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -58.71 -49.21 78.42 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.269 0.628 . . . . 0.0 111.494 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -71.38 -32.66 68.74 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -75.52 -36.99 60.38 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.8 0.81 . . . . 0.0 109.653 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 46.0 tp . . . . . 0 C--N 1.316 -0.89 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.265 177.355 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.538 ' O ' HG12 ' A' ' 45' ' ' ILE . 12.0 tt . . . . . 0 C--O 1.227 -0.118 0 CA-C-O 120.558 0.218 . . . . 0.0 110.812 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.419 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.5 pttp -61.86 -33.6 74.47 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.324 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.5 m -72.2 -43.1 65.0 Favored 'General case' 0 C--O 1.25 1.119 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.414 ' O ' HG23 ' A' ' 48' ' ' VAL . 16.5 m -58.58 -41.92 86.83 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.125 178.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 41' ' ' ILE . 37.0 mm -52.55 -46.69 48.76 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.388 177.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 42' ' ' LYS . 64.7 mt -56.05 -50.52 69.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.448 -176.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -58.18 -53.01 63.11 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.895 0.855 . . . . 0.0 109.9 -176.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 44' ' ' SER . 40.9 t -62.06 -47.56 92.58 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.712 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.718 -176.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -68.17 -35.93 78.81 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.665 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.1 t -77.4 -24.92 50.41 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.311 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.6 t -86.8 -19.47 28.98 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.16 0.505 . . . . 0.0 111.048 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.476 ' O ' HG12 ' A' ' 56' ' ' ILE . 76.7 m-70 -124.46 36.85 4.53 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 -177.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.49 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 82.9 mt -47.21 -41.8 18.94 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -174.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -53.66 -50.07 66.59 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -175.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.557 ' OE1' ' HD3' ' A' ' 58' ' ' LYS . 3.7 tp10 -72.99 -36.04 66.97 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.4 mm -63.21 -50.62 78.34 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.141 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.566 -177.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 6.9 ptm180 -70.49 -25.83 63.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.921 0.391 . . . . 0.0 111.762 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.557 ' HD3' ' OE1' ' A' ' 55' ' ' GLU . 78.7 tttt -65.33 -42.96 92.38 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 123.604 0.761 . . . . 0.0 109.984 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -127.22 58.79 1.44 Allowed 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 177.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.447 ' HG3' ' OE2' ' A' ' 61' ' ' GLU . 14.1 ptmm? -60.32 -32.32 71.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.828 -175.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.447 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 3.4 mp0 -65.57 -41.87 92.42 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.873 0.368 . . . . 0.0 110.213 177.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -64.01 -51.74 62.83 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.692 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.454 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.9 m-85 -67.01 -34.08 76.96 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -177.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -66.22 -45.36 80.96 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.585 177.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.8 mtm -66.22 -44.5 83.65 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.872 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.498 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 45.3 pt -67.37 -40.53 84.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.682 0 C-N-CA 118.939 -1.104 . . . . 0.0 112.348 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.496 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.92 -35.35 68.92 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 118.482 0.583 . . . . 0.0 110.876 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -67.09 -54.93 16.74 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.083 177.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.4 mt -62.7 -39.55 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.235 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 96.9 mt -54.55 -49.2 70.87 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.009 0.524 . . . . 0.0 111.433 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.496 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 55.1 mt-30 -65.17 -45.4 85.07 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.677 0.751 . . . . 0.0 109.646 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -57.57 -42.72 83.65 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 125.805 1.642 . . . . 0.0 112.07 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.438 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 64.3 m-85 -97.21 -15.83 20.68 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -178.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -34.42 77.41 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 118.881 0.764 . . . . 0.0 109.567 177.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -79.08 -17.68 54.74 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.533 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -99.83 -51.37 3.74 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.285 -172.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.3 pt -119.31 -20.71 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.563 ' O ' HG22 ' A' ' 82' ' ' VAL . . . 117.32 140.25 6.58 Favored Glycine 0 C--N 1.308 -0.988 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.6 tp -64.72 -37.89 81.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.908 0.354 . . . . 0.0 111.922 -173.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.72 -45.28 82.0 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 122.021 0.915 . . . . 0.0 109.722 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.45 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 79.8 m-20 -61.55 -48.62 80.16 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 113.953 -1.476 . . . . 0.0 111.112 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 78' ' ' GLY . 21.6 t -62.34 -44.77 99.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 O-C-N 123.59 0.556 . . . . 0.0 110.441 -177.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -55.1 -47.2 75.28 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.157 0.504 . . . . 0.0 111.973 -178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -40.24 86.69 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 99.0 mt -65.01 -36.92 85.93 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.665 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.3 mm -63.73 -40.25 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 121.136 0.493 . . . . 0.0 109.917 176.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 92.2 mt -65.2 -37.1 86.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.92 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 58.3 m -67.16 -33.62 75.81 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.81 0.814 . . . . 0.0 109.898 176.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.461 HG23 ' HG2' ' A' ' 13' ' ' ARG . 87.6 m -66.59 -44.54 81.88 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.927 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 41.6 pt . . . . . 0 C--N 1.323 -0.578 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -176.13 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.9 t70 . . . . . 0 N--CA 1.441 -0.887 0 N-CA-C 111.491 0.182 . . . . 0.0 111.491 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -72.04 -28.67 15.76 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.608 2.206 . . . . 0.0 112.813 -178.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.401 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 18.0 mm-40 -75.03 -35.69 61.93 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -61.03 -47.47 86.26 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.238 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.5 p -63.37 -34.67 68.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.472 0.653 . . . . 0.0 110.908 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -71.01 -31.82 68.44 Favored 'General case' 0 C--O 1.198 -1.61 0 O-C-N 121.951 -0.468 . . . . 0.0 112.245 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 94.0 mt -62.5 -36.79 83.67 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.277 0.56 . . . . 0.0 110.509 176.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -62.03 -38.82 90.14 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.697 177.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 . . . . . 0 C--N 1.313 -1.004 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.336 179.445 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.4 m . . . . . 0 C--O 1.256 1.43 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.418 ' O ' HG23 ' A' ' 24' ' ' VAL . 45.7 t-20 -81.33 117.87 22.17 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 174.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -58.31 -32.52 68.54 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 123.321 0.388 . . . . 0.0 111.09 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -66.74 -41.73 87.36 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.03 -174.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.574 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.1 tp -77.02 -38.7 52.43 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.234 -176.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 20' ' ' ASN . 56.6 t -59.86 -41.88 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 CA-C-O 121.088 0.471 . . . . 0.0 110.094 178.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 15.9 tmm? -57.92 -40.9 81.54 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.071 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -74.76 -36.26 62.58 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.005 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.574 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.5 mm -56.61 -47.12 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.0 mt -65.1 -41.16 95.23 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.332 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -64.56 -47.3 79.27 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.755 0.788 . . . . 0.0 110.655 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -59.57 -45.37 92.04 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.322 -177.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.402 ' CD1' HD13 ' A' ' 70' ' ' LEU . 35.4 pt -71.71 -39.67 69.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.376 178.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -54.69 -51.6 65.02 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.501 1.12 . . . . 0.0 111.347 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.38 -28.86 67.48 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -76.03 -49.94 16.19 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.746 0.784 . . . . 0.0 110.225 177.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.1 tp . . . . . 0 C--N 1.314 -0.971 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.581 -177.654 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.501 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.5 tt . . . . . 0 N--CA 1.473 0.679 0 CA-C-O 121.29 0.567 . . . . 0.0 110.358 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.525 ' O ' HG13 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.18 -28.19 68.95 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.967 177.019 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.402 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 11.9 m -79.01 -37.58 38.8 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.458 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 16.1 m -59.96 -40.71 89.97 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 41' ' ' ILE . 44.2 mm -55.64 -49.72 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.245 175.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 42' ' ' LYS . 78.1 mt -53.59 -49.02 58.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.369 -177.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.458 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 22.9 m-85 -60.03 -52.83 63.72 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.734 0.778 . . . . 0.0 110.141 -177.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.6 t -63.83 -43.76 97.96 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.796 -174.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -68.88 -34.38 75.34 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.358 -179.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.6 m -75.99 -21.51 56.85 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.194 0.521 . . . . 0.0 110.978 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 37.5 t -86.09 -41.12 15.04 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.009 0.433 . . . . 0.0 110.701 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.502 ' O ' HG12 ' A' ' 56' ' ' ILE . 84.1 m-70 -107.22 43.31 1.19 Allowed 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -176.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 81.0 mt -47.01 -41.93 17.28 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -175.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.647 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 34.0 t70 -58.93 -50.39 74.22 Favored 'General case' 0 C--O 1.209 -1.039 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -172.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.43 ' CG ' ' HH ' ' A' ' 63' ' ' TYR . 9.8 tp10 -72.0 -28.41 63.38 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.998 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.502 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.7 mm -64.92 -45.04 95.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 0.5 OUTLIER -73.67 -25.2 60.14 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.428 178.513 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.647 ' HG2' ' O ' ' A' ' 54' ' ' ASP . 74.2 mmtt -65.37 -51.39 60.79 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 176.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -123.34 65.62 1.0 Allowed 'General case' 0 CA--C 1.496 -1.121 0 CA-C-O 121.433 0.635 . . . . 0.0 111.655 -178.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -17.3 64.84 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.174 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.3 mp0 -64.71 -58.19 6.96 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 173.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -60.08 -49.7 76.6 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.122 -1.399 . . . . 0.0 111.014 -176.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.43 ' HH ' ' CG ' ' A' ' 55' ' ' GLU . 75.1 m-85 -67.68 -30.26 69.74 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -176.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -73.87 -41.47 62.14 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 119.452 -0.899 . . . . 0.0 109.825 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 84.8 mtp -63.72 -49.24 73.86 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.162 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.496 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.9 pt -66.2 -38.6 82.29 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.316 0 C-N-CA 119.729 -0.789 . . . . 0.0 111.741 -179.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.518 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -55.62 -39.7 71.15 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.616 0.246 . . . . 0.0 111.147 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -67.85 -51.7 45.28 Favored 'General case' 0 C--O 1.251 1.155 0 CA-C-O 121.598 0.713 . . . . 0.0 109.694 178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.3 mt -57.84 -45.01 87.36 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.317 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.558 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 85.4 mt -55.22 -46.37 75.95 Favored 'General case' 0 C--O 1.212 -0.874 0 C-N-CA 123.173 0.589 . . . . 0.0 110.97 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 75.5 mt-30 -61.53 -52.12 65.76 Favored 'General case' 0 C--O 1.256 1.418 0 CA-C-O 121.372 0.606 . . . . 0.0 110.363 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -57.7 -54.74 43.43 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.631 -176.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -82.65 -16.36 48.56 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -173.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.558 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -63.79 -39.06 93.33 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 176.16 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -81.32 -37.05 28.97 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.422 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -72.21 -50.63 26.07 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.991 -176.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.8 pt -118.69 -29.99 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -178.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.573 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 129.67 136.02 4.0 Favored Glycine 0 C--N 1.31 -0.878 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.412 ' HB ' ' HB2' ' A' ' 74' ' ' TYR . 9.0 tp -60.01 -38.78 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 CA-C-N 117.298 0.549 . . . . 0.0 111.978 -174.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.94 -45.99 82.38 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.274 0.559 . . . . 0.0 110.197 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.442 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 94.4 m-20 -62.65 -45.92 90.61 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.962 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.5 t -63.41 -47.78 90.22 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.576 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -55.12 -45.54 75.55 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.346 0.593 . . . . 0.0 110.881 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.29 -44.48 87.83 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 115.359 -0.837 . . . . 0.0 108.866 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.2 mt -64.9 -36.24 83.72 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 82' ' ' VAL . 45.3 mm -63.09 -44.7 99.65 Favored 'Isoleucine or valine' 0 C--O 1.244 0.769 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.28 -41.56 97.16 Favored 'General case' 0 C--O 1.214 -0.794 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.303 177.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.2 m -60.37 -38.86 85.2 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.226 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.6 m -71.79 -39.6 69.8 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.281 -176.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 41.2 pt . . . . . 0 C--N 1.321 -0.662 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.982 179.809 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.428 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 22.8 t70 . . . . . 0 C--O 1.242 0.662 0 N-CA-C 114.017 1.118 . . . . 0.0 114.017 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.498 ' O ' HG13 ' A' ' 10' ' ' VAL . 15.0 Cg_exo -70.77 -31.37 16.13 Favored 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 123.024 2.483 . . . . 0.0 113.422 177.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -75.17 -38.26 60.94 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.697 0.761 . . . . 0.0 109.021 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.503 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 67.7 t80 -63.93 -38.28 90.52 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.699 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 7' ' ' PRO . 4.3 p -67.29 -33.53 63.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 120.87 0.367 . . . . 0.0 110.305 178.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -58.19 -43.03 87.35 Favored 'General case' 0 C--N 1.342 0.262 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.74 -38.32 84.77 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.038 177.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.503 ' HG2' ' O ' ' A' ' 9' ' ' PHE . 19.8 mmm180 -60.12 -42.22 94.28 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.023 179.592 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.241 0.612 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -75.27 121.58 22.39 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 174.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -54.02 -39.16 65.89 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.314 0.578 . . . . 0.0 111.41 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -75.05 -33.1 61.69 Favored 'General case' 0 CA--C 1.485 -1.535 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.077 -171.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.59 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.9 tp -76.57 -36.64 57.47 Favored 'General case' 0 N--CA 1.419 -2.002 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.265 -177.047 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.424 HG23 ' HH ' ' A' ' 63' ' ' TYR . 61.0 t -65.02 -42.44 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.678 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 56.3 ttp -58.46 -41.2 84.65 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.325 177.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -68.86 -39.88 79.61 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.461 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.59 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.8 mm -57.06 -51.22 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 176.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.5 mt -63.04 -37.89 89.01 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.633 -179.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -66.49 -49.06 67.86 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 123.99 0.916 . . . . 0.0 110.449 179.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.3 -41.05 97.05 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.165 -175.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 38.7 pt -72.86 -35.16 48.61 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.587 0 C-N-CA 120.112 -0.635 . . . . 0.0 109.499 176.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -60.95 -54.57 43.4 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 123.018 0.527 . . . . 0.0 110.421 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.421 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.5 pp -62.24 -34.76 77.13 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.922 -178.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.421 ' N ' HD12 ' A' ' 33' ' ' LEU . 25.9 t70 -75.36 -48.55 22.5 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.914 -178.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 54.1 tp . . . . . 0 N--CA 1.466 0.354 0 C-N-CA 123.662 0.785 . . . . 0.0 112.118 -179.186 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.519 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.7 tt . . . . . 0 C--O 1.222 -0.354 0 N-CA-C 111.265 0.098 . . . . 0.0 111.265 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.493 ' O ' HG13 ' A' ' 46' ' ' ILE . 21.1 pttm -62.69 -32.9 74.07 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 119.951 -0.7 . . . . 0.0 110.794 178.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.0 m -69.11 -43.45 74.42 Favored 'General case' 0 N--CA 1.428 -1.526 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.321 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.477 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 25.0 m -60.4 -37.96 82.47 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.438 176.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.519 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.1 mm -55.95 -49.19 76.71 Favored 'Isoleucine or valine' 0 C--N 1.344 0.338 0 C-N-CA 123.397 0.679 . . . . 0.0 110.035 176.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 42' ' ' LYS . 75.6 mt -52.29 -47.47 45.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 C-N-CA 123.528 0.731 . . . . 0.0 112.161 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.477 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 25.9 m-85 -61.8 -53.13 60.19 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-O 121.43 0.633 . . . . 0.0 110.453 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.3 -43.6 95.04 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 CA-C-N 114.638 -1.164 . . . . 0.0 111.662 -173.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -67.31 -34.42 77.34 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.419 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.425 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 37.2 m -77.57 -21.96 51.69 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.283 0.563 . . . . 0.0 111.099 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.4 t -77.85 -49.11 14.91 Favored 'General case' 0 N--CA 1.434 -1.248 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.49 ' O ' HG12 ' A' ' 56' ' ' ILE . 79.9 m-70 -104.99 45.55 0.96 Allowed 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -175.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 50' ' ' SER . 81.1 mt -46.81 -43.75 18.65 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -175.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.431 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 7.9 t70 -53.58 -51.67 62.24 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -174.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -74.0 -32.68 63.51 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.461 -177.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.49 HG12 ' O ' ' A' ' 52' ' ' HIS . 41.8 mm -62.95 -35.65 72.33 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.477 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 177.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -77.66 -43.95 29.65 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.166 -179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 52.9 mtpt -60.96 -46.25 91.48 Favored 'General case' 0 CA--C 1.505 -0.771 0 C-N-CA 122.975 0.51 . . . . 0.0 110.754 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -122.34 60.33 1.0 Allowed 'General case' 0 C--N 1.302 -1.472 0 CA-C-O 121.562 0.696 . . . . 0.0 111.432 -177.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -22.94 66.13 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.762 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -63.09 -49.76 73.19 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 123.503 0.502 . . . . 0.0 109.661 175.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -63.09 -49.6 73.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.874 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.431 ' HA ' HG12 ' A' ' 66' ' ' ILE . 81.2 m-85 -68.49 -33.42 74.12 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -178.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.54 -50.04 72.93 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.164 0.507 . . . . 0.0 109.802 174.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.2 mtm -61.16 -48.88 79.55 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.364 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.538 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 46.4 pt -67.78 -39.89 82.78 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.826 -177.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.533 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.53 -39.81 68.03 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 118.348 0.522 . . . . 0.0 111.587 -178.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -63.39 -55.73 22.06 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.575 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.0 mt -60.63 -40.41 84.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.747 -176.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.574 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 93.0 mt -55.61 -50.32 70.44 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 122.929 0.492 . . . . 0.0 111.636 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 43.2 mt-30 -70.36 -46.79 63.4 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 122.297 1.046 . . . . 0.0 109.858 -176.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -60.91 -44.55 97.02 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 113.51 -1.677 . . . . 0.0 111.43 -175.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.428 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 32.5 m-85 -91.98 -15.28 28.17 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -177.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.574 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.94 -30.26 70.34 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 119.929 -0.708 . . . . 0.0 109.098 175.127 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -79.78 -17.46 53.37 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.099 176.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -97.42 -51.3 4.21 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.028 -176.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.5 pt -118.17 -25.9 2.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -176.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.525 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 120.42 143.83 6.94 Favored Glycine 0 C--N 1.308 -0.978 0 C-N-CA 120.064 -1.065 . . . . 0.0 111.213 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tp -60.68 -42.78 93.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -175.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.76 -41.84 87.53 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.554 0.692 . . . . 0.0 110.417 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.547 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 2.4 m-20 -63.07 -48.4 78.82 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.592 -1.186 . . . . 0.0 109.823 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.525 HG21 ' O ' ' A' ' 78' ' ' GLY . 33.9 t -62.29 -46.82 95.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.586 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -53.62 -46.7 70.54 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.203 0.525 . . . . 0.0 111.345 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -42.01 95.34 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 115.476 -0.784 . . . . 0.0 108.916 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 88.7 mt -65.44 -35.46 80.99 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.32 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 82' ' ' VAL . 49.0 mm -66.22 -45.82 89.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.53 -42.29 91.95 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.588 178.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 50.9 m -64.14 -33.69 76.36 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.127 0.489 . . . . 0.0 111.047 177.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.468 HG23 ' HD2' ' A' ' 13' ' ' ARG . 91.5 m -68.79 -37.44 79.28 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.779 179.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.6 pt . . . . . 0 C--N 1.329 -0.315 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.712 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.506 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 6.2 t70 . . . . . 0 N--CA 1.44 -0.952 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.07 -27.31 42.27 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.882 2.388 . . . . 0.0 112.438 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -75.01 -25.27 58.67 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -177.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -70.46 -39.56 74.21 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.357 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.4 p -68.4 -34.48 66.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.213 0.53 . . . . 0.0 109.574 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.68 -42.01 99.4 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 174.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.45 -44.51 84.83 Favored 'General case' 0 C--O 1.195 -1.789 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.276 176.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -58.11 -32.84 68.49 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 118.659 0.663 . . . . 0.0 112.566 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 . . . . . 0 C--N 1.301 -1.512 0 CA-C-O 121.903 0.859 . . . . 0.0 110.117 177.71 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.0 m . . . . . 0 C--O 1.245 0.833 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.406 ' O ' HG21 ' A' ' 24' ' ' VAL . 14.5 t-20 -94.23 138.94 31.67 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -61.37 -44.07 97.8 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 122.569 0.348 . . . . 0.0 111.761 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 -71.56 -31.22 66.75 Favored 'General case' 0 CA--C 1.492 -1.257 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -173.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.482 ' O ' HG12 ' A' ' 27' ' ' ILE . 30.8 tp -69.69 -47.86 61.7 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.453 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.504 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 94.6 t -63.52 -42.2 95.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -56.8 -43.73 81.25 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -65.54 -43.18 90.72 Favored 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.944 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.5 HD12 ' OE2' ' A' ' 55' ' ' GLU . 46.5 mm -58.74 -50.26 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-O 121.274 0.559 . . . . 0.0 109.811 177.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 82.7 mt -61.72 -36.24 80.37 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.325 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -71.84 -47.69 51.37 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.38 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -59.2 -41.08 87.71 Favored 'General case' 0 C--O 1.248 1.025 0 C-N-CA 124.307 1.043 . . . . 0.0 110.292 -177.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.411 ' CD1' HD12 ' A' ' 70' ' ' LEU . 45.8 pt -73.03 -40.31 58.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 120.596 -0.442 . . . . 0.0 109.996 176.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -60.95 -47.64 85.48 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 123.516 0.726 . . . . 0.0 111.051 -178.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.83 -30.1 71.23 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -75.0 -50.56 16.14 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 119.147 -1.021 . . . . 0.0 110.04 174.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 69.2 tp . . . . . 0 C--O 1.241 0.63 0 C-N-CA 123.966 0.906 . . . . 0.0 111.692 -177.515 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.549 ' O ' HG12 ' A' ' 45' ' ' ILE . 10.9 tt . . . . . 0 N--CA 1.444 -0.742 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.448 ' O ' HG13 ' A' ' 46' ' ' ILE . 64.6 pttt -71.86 -28.23 63.4 Favored 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 119.126 -1.029 . . . . 0.0 110.084 -177.214 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.2 m -73.91 -40.59 63.04 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.248 -0.887 . . . . 0.0 108.871 175.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.421 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 18.4 m -57.52 -40.7 79.32 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 121.021 0.439 . . . . 0.0 110.094 174.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.8 mm -54.51 -47.19 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 123.814 0.846 . . . . 0.0 109.897 175.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 42' ' ' LYS . 63.4 mt -52.93 -50.7 42.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.364 -0.834 . . . . 0.0 112.538 -177.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.421 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 31.0 m-85 -57.91 -49.84 75.38 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 121.164 0.507 . . . . 0.0 110.436 -175.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.4 t -66.78 -47.75 81.96 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 CA-C-N 114.508 -1.224 . . . . 0.0 111.671 -174.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -65.84 -39.01 90.37 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.823 0.344 . . . . 0.0 110.85 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.9 t -69.32 -22.06 63.8 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.306 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.9 t -97.16 -0.92 46.1 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-O 121.346 0.593 . . . . 0.0 109.944 -178.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.556 ' O ' HG12 ' A' ' 56' ' ' ILE . 26.8 m-70 -134.42 32.79 3.33 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.534 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 95.2 mt -47.37 -51.35 19.92 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -172.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.407 ' CG ' ' HZ2' ' A' ' 58' ' ' LYS . 31.1 t70 -62.53 -44.21 96.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.041 0.448 . . . . 0.0 111.104 -175.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.5 ' OE2' HD12 ' A' ' 27' ' ' ILE . 24.4 tt0 -60.76 -49.83 75.9 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 124.534 1.134 . . . . 0.0 110.17 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 52' ' ' HIS . 43.6 mm -55.75 -43.01 72.26 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.147 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.018 176.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 69.2 mtm180 -64.25 -34.46 78.16 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.407 ' HZ2' ' CG ' ' A' ' 54' ' ' ASP . 14.3 mptt -61.35 -51.43 68.84 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 120.863 0.363 . . . . 0.0 110.947 177.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -121.77 60.7 0.96 Allowed 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 121.346 0.593 . . . . 0.0 110.434 -177.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.648 ' HG2' ' OE1' ' A' ' 61' ' ' GLU . 4.3 ptpp? -65.07 -33.86 77.05 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.128 -177.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.648 ' OE1' ' HG2' ' A' ' 60' ' ' LYS . 3.1 mp0 -63.81 -45.87 87.67 Favored 'General case' 0 N--CA 1.414 -2.226 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.424 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -63.83 -52.39 60.35 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.124 179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -68.46 -34.61 76.25 Favored 'General case' 0 N--CA 1.432 -1.347 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.66 -43.77 65.46 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.343 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.3 mtm -67.67 -39.78 84.5 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.665 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.511 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.8 pt -67.2 -41.59 86.99 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.993 0 C-N-CA 118.342 -1.343 . . . . 0.0 110.732 177.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.2 -36.57 68.55 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 121.141 0.496 . . . . 0.0 111.144 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -68.55 -55.29 12.16 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.738 177.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.8 mt -61.53 -38.96 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.837 -178.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.585 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 93.1 mt -56.65 -48.05 78.42 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 123.069 0.548 . . . . 0.0 111.347 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.523 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 69.8 mt-30 -66.21 -46.63 76.6 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -55.51 -52.46 63.62 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.817 1.647 . . . . 0.0 112.386 -176.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.506 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 84.2 m-85 -90.13 -14.83 32.82 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -175.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.585 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.36 -28.32 67.85 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.354 0.597 . . . . 0.0 109.4 174.729 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -73.56 -22.14 60.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.106 176.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -96.3 -51.15 4.5 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.6 pt -119.79 -30.83 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.487 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 136.53 173.66 13.02 Favored Glycine 0 C--O 1.212 -1.24 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -178.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.5 tp -91.91 -40.59 12.45 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.105 0 CA-C-N 118.362 1.081 . . . . 0.0 110.506 -174.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -59.66 -33.97 72.23 Favored 'General case' 0 N--CA 1.421 -1.876 0 C-N-CA 123.975 0.91 . . . . 0.0 110.218 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.517 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 12.2 m120 -69.39 -48.14 62.07 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.396 -1.275 . . . . 0.0 109.366 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 78' ' ' GLY . 44.2 t -66.57 -38.55 81.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.3 -178.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -56.4 -45.61 80.54 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.257 0.551 . . . . 0.0 110.392 177.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -44.92 94.63 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 87.0 mt -59.43 -42.31 91.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.452 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.6 mm -64.08 -38.76 83.27 Favored 'Isoleucine or valine' 0 C--O 1.269 2.114 0 C-N-CA 122.637 0.375 . . . . 0.0 110.685 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.75 -40.5 95.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.562 0.696 . . . . 0.0 110.131 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 49.7 m -62.07 -33.27 74.11 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.322 177.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -69.7 -34.57 74.1 Favored 'General case' 0 CA--C 1.562 1.415 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 23.8 pt . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -176.696 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.1 t70 . . . . . 0 N--CA 1.436 -1.165 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -71.23 -24.59 23.06 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.99 2.46 . . . . 0.0 112.721 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -75.52 -37.83 59.83 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -59.46 -44.51 92.98 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.955 178.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.6 p -65.77 -37.36 79.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.19 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -70.68 -29.17 65.41 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.175 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 64.1 mt -61.11 -39.32 89.53 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.212 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.4 mtm180 -72.05 -27.19 62.53 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.082 -179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 . . . . . 0 C--N 1.318 -0.767 0 CA-C-O 121.455 0.645 . . . . 0.0 109.736 176.758 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.9 m . . . . . 0 N--CA 1.446 -0.662 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -76.84 123.88 26.89 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -53.6 -38.37 63.92 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 123.607 0.763 . . . . 0.0 110.824 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -70.97 -31.22 67.71 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.57 -173.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.552 ' O ' HG12 ' A' ' 27' ' ' ILE . 34.8 tp -76.42 -41.71 46.68 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.695 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.454 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 62.1 t -63.11 -44.09 99.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 177.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 62.3 ttp -57.32 -35.13 69.47 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.118 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -74.64 -41.93 59.47 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.999 177.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.62 -49.93 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-O 121.488 0.661 . . . . 0.0 109.314 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 78.6 mt -61.96 -40.5 95.78 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.548 -1.205 . . . . 0.0 110.406 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -64.3 -47.38 79.7 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.781 0.801 . . . . 0.0 110.827 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -62.28 -42.69 99.56 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.992 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 32.8 pt -71.87 -38.38 64.86 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.481 175.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.87 -50.73 72.92 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.069 0.948 . . . . 0.0 111.239 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.412 HD11 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -65.21 -32.41 74.07 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.38 -179.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.412 ' N ' HD11 ' A' ' 33' ' ' LEU . 20.3 t70 -75.73 -48.5 21.61 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.141 0.496 . . . . 0.0 111.08 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.412 HD12 ' N ' ' A' ' 41' ' ' ILE . 57.1 tp . . . . . 0 C--N 1.317 -0.816 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.29 -178.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.455 ' O ' HG12 ' A' ' 45' ' ' ILE . 12.7 tt . . . . . 0 C--O 1.217 -0.647 0 CA-C-O 121.073 0.463 . . . . 0.0 109.892 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.465 ' O ' HG13 ' A' ' 46' ' ' ILE . 10.2 ptmm? -59.35 -36.45 75.74 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.195 176.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 19.0 m -79.62 -35.61 39.2 Favored 'General case' 0 N--CA 1.417 -2.09 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.286 -178.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.8 m -59.22 -43.48 92.31 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 41' ' ' ILE . 29.8 mm -55.44 -41.29 62.17 Favored 'Isoleucine or valine' 0 C--N 1.346 0.419 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.008 177.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 42' ' ' LYS . 70.4 mt -57.37 -51.06 74.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.557 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -62.35 -52.44 63.62 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.564 0.697 . . . . 0.0 110.258 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.9 t -62.0 -46.95 95.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 114.585 -1.189 . . . . 0.0 112.084 -174.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -66.46 -36.44 82.78 Favored 'General case' 0 C--O 1.212 -0.888 0 C-N-CA 121.173 -0.211 . . . . 0.0 111.545 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.1 m -72.73 -25.4 61.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.979 0.418 . . . . 0.0 111.444 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.6 t -83.65 -40.39 19.04 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-O 121.167 0.508 . . . . 0.0 110.561 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.461 ' O ' HG12 ' A' ' 56' ' ' ILE . 64.1 m-70 -103.21 35.52 2.53 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.445 -175.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.1 mt -47.14 -43.17 20.62 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -175.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -53.99 -51.12 64.93 Favored 'General case' 0 C--N 1.318 -0.781 0 O-C-N 123.557 0.536 . . . . 0.0 112.226 -175.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -73.9 -34.36 64.36 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.044 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 52' ' ' HIS . 46.3 mm -61.19 -37.44 77.49 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -73.56 -43.15 60.57 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.682 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -58.33 -50.24 74.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.248 0.547 . . . . 0.0 111.565 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -120.02 54.14 1.04 Allowed 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 122.035 0.921 . . . . 0.0 110.39 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -53.47 -37.53 62.76 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 113.764 -1.562 . . . . 0.0 112.932 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -60.98 -46.82 89.2 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 120.954 0.406 . . . . 0.0 110.59 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -63.36 -51.02 67.63 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.056 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.441 ' HA ' HG12 ' A' ' 66' ' ' ILE . 85.9 m-85 -70.4 -28.16 64.86 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -175.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -75.68 -44.34 42.74 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.134 177.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.7 mtm -62.76 -45.77 91.13 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.038 178.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.481 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.0 pt -64.82 -36.9 78.82 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.217 0 C-N-CA 119.354 -0.938 . . . . 0.0 111.276 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.54 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -53.53 -46.63 70.22 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.351 0.407 . . . . 0.0 112.006 -177.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -76.3 -35.61 58.77 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.144 -0.622 . . . . 0.0 112.014 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 82.3 mt -64.05 -45.29 97.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 177.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.573 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.9 mt -52.88 -45.95 67.71 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 123.461 0.704 . . . . 0.0 110.988 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.0 mt-30 -66.29 -48.39 70.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.472 0.653 . . . . 0.0 110.52 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 39.5 ttm180 -59.19 -50.95 72.05 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.245 1.418 . . . . 0.0 111.436 -177.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -86.56 -15.44 39.93 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -176.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.573 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.37 -34.8 78.04 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.2 174.419 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -74.88 -39.58 61.42 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.008 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -75.26 -47.06 29.82 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -174.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.8 pt -123.39 -30.72 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 O-C-N 121.721 -0.612 . . . . 0.0 112.569 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.493 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.95 142.5 5.89 Favored Glycine 0 C--N 1.309 -0.929 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.2 tp -61.14 -38.45 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 117.096 0.448 . . . . 0.0 111.876 -174.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -53.47 -45.75 69.68 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.713 0.768 . . . . 0.0 110.475 179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.459 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 42.6 m-80 -65.59 -45.68 82.28 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.189 -1.368 . . . . 0.0 110.195 -178.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 78' ' ' GLY . 15.0 t -65.01 -45.66 93.92 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.12 -176.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -55.56 -43.75 76.18 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.335 0.588 . . . . 0.0 110.844 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -45.49 83.7 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 98.7 mt -62.39 -39.67 93.97 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.669 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.5 mm -62.89 -40.48 88.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-O 120.847 0.356 . . . . 0.0 110.073 177.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 98.6 mt -63.71 -38.62 91.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.867 0.842 . . . . 0.0 110.32 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.7 m -67.07 -34.36 77.5 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.033 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 56.4 m -64.95 -46.21 82.53 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 124.324 1.05 . . . . 0.0 110.805 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.9 pt . . . . . 0 C--O 1.239 0.506 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -177.481 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.401 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 7.1 t70 . . . . . 0 C--O 1.247 0.964 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.443 ' O ' HG13 ' A' ' 10' ' ' VAL . 2.9 Cg_exo -72.1 -30.36 13.52 Favored 'Trans proline' 0 C--O 1.241 0.638 0 C-N-CA 122.848 2.366 . . . . 0.0 113.108 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -76.2 -28.73 57.35 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -64.43 -41.82 96.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.389 178.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 7' ' ' PRO . 10.3 p -63.44 -34.86 69.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -59.18 -43.85 92.17 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.358 171.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.71 -35.48 78.17 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 122.907 0.483 . . . . 0.0 110.962 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -61.5 -36.78 81.45 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.185 0.594 . . . . 0.0 110.641 177.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 . . . . . 0 C--N 1.313 -1.02 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.996 179.153 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 31.0 m . . . . . 0 N--CA 1.448 -0.526 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.407 ' O ' HG23 ' A' ' 24' ' ' VAL . 79.5 m-20 -84.32 110.54 18.67 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 120.072 -0.651 . . . . 0.0 109.671 173.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.403 ' CE1' HD22 ' A' ' 87' ' ' LEU . 52.5 t80 -48.82 -47.94 41.98 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.319 1.048 . . . . 0.0 112.888 -178.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -64.65 -31.88 73.29 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -176.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.621 ' O ' HG12 ' A' ' 27' ' ' ILE . 31.1 tp -76.79 -40.63 47.48 Favored 'General case' 0 N--CA 1.426 -1.648 0 C-N-CA 119.819 -0.752 . . . . 0.0 110.067 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 20' ' ' ASN . 53.9 t -60.55 -42.3 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 177.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -57.2 -44.38 83.58 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.356 176.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -68.24 -38.13 81.53 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.943 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.621 HG12 ' O ' ' A' ' 23' ' ' LEU . 49.6 mm -56.81 -51.71 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.02 -40.98 97.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.493 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -66.02 -47.52 74.17 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.509 0.671 . . . . 0.0 111.35 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -62.02 -39.71 93.2 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.703 -176.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 31.0 pt -73.01 -39.21 57.33 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.234 175.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.99 -52.93 63.31 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.7 0.8 . . . . 0.0 111.406 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -66.6 -28.78 68.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -178.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -76.09 -49.71 16.7 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.633 0.73 . . . . 0.0 109.816 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 63.8 tp . . . . . 0 C--N 1.318 -0.766 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.276 -178.871 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.488 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.8 tt . . . . . 0 N--CA 1.451 -0.378 0 N-CA-C 111.506 0.187 . . . . 0.0 111.506 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -66.46 -31.72 72.64 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.834 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.2 m -73.12 -41.61 63.81 Favored 'General case' 0 N--CA 1.426 -1.67 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 177.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.448 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 15.6 m -59.63 -39.71 85.21 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.783 177.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 41' ' ' ILE . 23.8 mm -52.39 -46.74 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 124.054 0.942 . . . . 0.0 110.278 175.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 60.2 mt -57.69 -47.66 85.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.986 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.448 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 19.5 m-85 -59.75 -42.59 93.58 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.812 0.815 . . . . 0.0 110.299 -177.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 44' ' ' SER . 46.5 t -71.85 -49.22 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.75 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.364 -176.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -62.98 -40.39 97.58 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.764 -178.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.5 t -66.78 -31.25 71.76 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 122.58 0.352 . . . . 0.0 111.665 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.7 t -84.68 -27.57 26.96 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.136 0.493 . . . . 0.0 111.008 -178.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.547 ' O ' HG12 ' A' ' 56' ' ' ILE . 83.1 m-70 -117.15 35.36 4.68 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -174.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 81.6 mt -47.13 -40.0 14.65 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 -174.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -56.78 -51.27 69.58 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -174.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -72.99 -32.61 65.29 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.185 0.517 . . . . 0.0 109.648 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 52' ' ' HIS . 44.9 mm -62.7 -45.4 98.93 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.786 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.623 -178.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.3 ptp85 -77.22 -28.06 53.67 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.224 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.49 ' HD2' ' ND2' ' A' ' 59' ' ' ASN . 0.0 OUTLIER -69.33 -32.6 71.81 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -175.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.49 ' ND2' ' HD2' ' A' ' 58' ' ' LYS . 55.8 m-80 -128.47 55.34 1.7 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.357 174.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -63.7 -24.08 67.63 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.522 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -63.86 -57.53 9.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 175.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -59.53 -51.21 70.83 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.692 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.403 ' HA ' HG12 ' A' ' 66' ' ' ILE . 72.6 m-85 -67.59 -26.12 66.11 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -176.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -77.07 -46.05 24.96 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.611 176.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.5 mtm -59.09 -50.59 73.48 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.664 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.561 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.7 pt -63.31 -41.69 93.66 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.698 0 C-N-CA 119.617 -0.833 . . . . 0.0 112.038 -178.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.539 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.85 -39.65 74.65 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.046 0.45 . . . . 0.0 110.91 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.56 -52.49 31.26 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.578 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.8 mt -60.34 -42.91 92.45 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.6 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 98.0 mt -52.66 -46.72 67.29 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 123.277 0.631 . . . . 0.0 111.265 178.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.539 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 63.7 mt-30 -68.57 -43.31 76.86 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.015 0.436 . . . . 0.0 110.565 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -62.07 -47.56 84.12 Favored 'General case' 0 N--CA 1.428 -1.534 0 C-N-CA 123.755 0.822 . . . . 0.0 111.556 -178.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -85.75 -15.48 42.01 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 -177.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.54 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.01 -33.3 75.27 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 174.931 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -73.46 -34.71 65.51 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.483 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -85.35 -51.46 6.55 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.161 0.801 . . . . 0.0 113.161 -175.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.0 pt -118.48 -29.11 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -173.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.534 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.95 143.91 6.21 Favored Glycine 0 N--CA 1.438 -1.186 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.0 tp -61.33 -37.16 76.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 122.44 0.296 . . . . 0.0 111.243 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -65.02 -35.5 81.38 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.627 -177.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.617 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.4 t-20 -67.73 -45.53 74.74 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.824 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.1 t -66.77 -38.22 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.626 -177.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.454 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 47.3 t-20 -50.78 -50.0 56.99 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.126 0.97 . . . . 0.0 108.898 177.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -40.84 81.96 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.109 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 81.5 mt -61.16 -42.01 97.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.528 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.6 mm -64.42 -44.47 97.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 177.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 80.9 mt -61.38 -34.71 75.78 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.267 0.556 . . . . 0.0 110.948 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.8 m -66.47 -46.33 76.72 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.235 177.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.6 m -64.27 -35.28 80.32 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.436 0.694 . . . . 0.0 111.864 -175.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.5 pt . . . . . 0 C--O 1.242 0.694 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -179.23 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.2 t70 . . . . . 0 C--O 1.244 0.801 0 N-CA-C 112.727 0.639 . . . . 0.0 112.727 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.495 ' O ' HG13 ' A' ' 10' ' ' VAL . 7.2 Cg_exo -71.85 -24.6 21.0 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.462 2.774 . . . . 0.0 113.866 176.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.34 -38.52 74.87 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -178.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -59.81 -38.84 83.13 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.581 176.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 7' ' ' PRO . 8.6 p -69.49 -33.85 59.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.171 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.12 -36.42 79.67 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 175.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.411 HD23 ' CD1' ' A' ' 62' ' ' PHE . 98.0 mt -63.71 -41.93 98.02 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.139 0.495 . . . . 0.0 110.424 176.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -64.04 -30.65 71.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.7 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.71 178.112 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.506 HG11 ' CD2' ' A' ' 62' ' ' PHE . 24.7 m . . . . . 0 C--O 1.25 1.124 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.455 ' O ' HG22 ' A' ' 24' ' ' VAL . 18.3 t-20 -87.86 115.87 25.62 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.111 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -51.76 -38.44 55.47 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.462 0.476 . . . . 0.0 111.665 -178.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -72.88 -36.06 67.26 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.406 -172.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.61 ' O ' HG12 ' A' ' 27' ' ' ILE . 25.8 tp -76.64 -39.1 53.4 Favored 'General case' 0 N--CA 1.415 -2.196 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.987 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.463 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 72.8 t -57.84 -46.65 87.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 174.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 54.6 ttp -58.13 -40.0 80.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.055 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 -68.91 -41.06 78.73 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.229 175.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.61 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.3 mm -57.02 -51.93 62.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 177.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.7 mt -62.39 -38.09 88.28 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 114.515 -1.221 . . . . 0.0 110.541 -179.099 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -69.09 -46.16 68.45 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.136 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -61.86 -43.29 99.15 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.159 -176.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.401 ' CD1' HD12 ' A' ' 70' ' ' LEU . 39.4 pt -71.5 -38.73 69.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.599 177.103 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -59.03 -52.97 63.45 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 123.082 0.553 . . . . 0.0 111.363 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.419 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.6 pp -58.36 -37.35 75.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 120.823 0.344 . . . . 0.0 111.527 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.419 ' N ' HD12 ' A' ' 33' ' ' LEU . 27.8 t70 -73.78 -45.96 48.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.208 0.528 . . . . 0.0 110.328 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 C--N 1.315 -0.927 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.513 -177.346 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.434 HD12 ' HA ' ' A' ' 71' ' ' GLN . 9.7 tt . . . . . 0 N--CA 1.447 -0.599 0 CA-C-O 120.455 0.169 . . . . 0.0 111.274 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.529 ' O ' HG13 ' A' ' 46' ' ' ILE . 20.5 ptmt -67.94 -33.66 75.1 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 119.464 -0.895 . . . . 0.0 110.372 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.6 m -72.9 -33.69 66.18 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.469 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 14.0 m -62.05 -44.95 95.58 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 173.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.482 ' HB ' ' O ' ' A' ' 42' ' ' LYS . 27.6 mm -52.94 -48.45 51.6 Favored 'Isoleucine or valine' 0 C--N 1.344 0.351 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.468 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 42' ' ' LYS . 72.0 mt -55.38 -49.73 70.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.726 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.469 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 13.1 m-85 -58.43 -45.16 89.03 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 122.256 1.027 . . . . 0.0 110.481 -178.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 44' ' ' SER . 57.8 t -73.12 -49.26 39.66 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.771 0 CA-C-N 114.248 -1.342 . . . . 0.0 111.308 -173.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -63.5 -35.91 82.02 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.522 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.7 p -73.59 -22.18 60.12 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.068 0.461 . . . . 0.0 111.718 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.6 t -90.45 -25.95 20.08 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.651 0.739 . . . . 0.0 110.134 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.485 ' O ' HG12 ' A' ' 56' ' ' ILE . 81.2 m-70 -118.7 36.61 4.35 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 121.911 -0.493 . . . . 0.0 109.894 -175.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.5 mt -48.7 -44.11 37.74 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -175.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -56.61 -45.35 81.49 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 123.27 0.356 . . . . 0.0 111.936 -175.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -67.36 -44.77 78.18 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.621 0.724 . . . . 0.0 109.625 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 52' ' ' HIS . 45.6 mm -59.59 -46.57 92.99 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.862 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.294 -176.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -72.61 -24.56 61.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.898 0.38 . . . . 0.0 111.095 -178.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -72.78 -46.52 52.9 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.553 0.692 . . . . 0.0 109.47 -177.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.485 ' HB2' ' CE2' ' A' ' 63' ' ' TYR . 4.6 m120 -117.37 46.33 1.73 Allowed 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 -177.105 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.66 -34.59 18.84 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.114 1.366 . . . . 0.0 114.56 -173.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -67.09 -48.28 68.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.394 0.616 . . . . 0.0 110.311 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.506 ' CD2' HG11 ' A' ' 19' ' ' VAL . 85.4 t80 -64.03 -51.3 64.85 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.811 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.485 ' CE2' ' HB2' ' A' ' 59' ' ' ASN . 82.1 m-85 -66.22 -26.15 67.25 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -175.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.42 -47.24 17.95 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 119.442 -0.903 . . . . 0.0 111.051 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.3 mtm -65.74 -36.09 82.58 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.073 -178.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.46 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 41.2 pt -67.19 -38.33 80.87 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.669 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.33 175.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.52 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -57.27 -42.02 80.83 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.918 0.39 . . . . 0.0 110.139 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -62.04 -56.47 18.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.013 176.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 99.2 mt -60.97 -40.87 86.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.686 0.795 . . . . 0.0 112.403 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.494 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 88.2 mt -55.1 -49.64 71.21 Favored 'General case' 0 C--O 1.212 -0.906 0 C-N-CA 123.208 0.603 . . . . 0.0 112.015 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 49.4 mt-30 -69.02 -50.25 50.45 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 122.101 0.953 . . . . 0.0 109.361 -178.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -55.88 -47.13 77.94 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.137 -1.847 . . . . 0.0 111.901 -176.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -88.87 -15.93 33.21 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.494 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.79 -32.95 73.88 Favored 'General case' 0 N--CA 1.439 -0.989 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.775 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -69.15 -28.21 66.23 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.427 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -90.81 -52.17 5.0 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.9 pt -119.2 -27.67 2.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.5 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 120.62 144.12 6.98 Favored Glycine 0 C--N 1.305 -1.161 0 C-N-CA 120.411 -0.899 . . . . 0.0 110.872 178.2 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.3 tp -61.56 -38.5 80.36 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 C-N-CA 122.44 0.296 . . . . 0.0 111.739 -174.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -55.84 -44.28 77.83 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 122.541 1.162 . . . . 0.0 109.706 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.511 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 51.0 m-80 -67.64 -44.34 78.18 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 113.557 -1.656 . . . . 0.0 110.982 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.5 HG21 ' O ' ' A' ' 78' ' ' GLY . 17.9 t -67.69 -39.87 82.92 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.175 -177.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -55.76 -45.37 78.09 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.276 0.56 . . . . 0.0 110.779 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -41.75 95.5 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 89.1 mt -62.13 -42.14 98.95 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.423 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 82' ' ' VAL . 51.1 mm -63.96 -39.12 84.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.887 0.375 . . . . 0.0 110.094 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.88 -39.44 94.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.404 0.621 . . . . 0.0 110.109 176.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 27.3 m -66.89 -33.82 76.44 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.103 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 47.3 m -60.76 -42.88 98.34 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.905 0.882 . . . . 0.0 111.12 -178.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 23.7 pt . . . . . 0 C--N 1.311 -1.088 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.398 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.521 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 15.1 t70 . . . . . 0 N--CA 1.439 -1.001 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.541 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 26.5 Cg_exo -63.12 -30.6 75.45 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 123.067 2.512 . . . . 0.0 113.23 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.39 -41.75 46.76 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -178.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -57.29 -46.21 83.38 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.684 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.0 p -64.42 -34.57 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.67 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.541 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 64.1 mttp -62.63 -44.66 95.72 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 175.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.7 mt -58.45 -42.11 86.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.804 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -59.67 -37.19 78.08 Favored 'General case' 0 N--CA 1.476 0.838 0 O-C-N 123.444 0.465 . . . . 0.0 111.21 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 . . . . . 0 C--N 1.314 -0.976 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.817 -179.297 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 6.5 m . . . . . 0 CA--C 1.503 -0.844 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -67.85 133.53 49.33 Favored 'General case' 0 C--N 1.309 -1.194 0 O-C-N 124.109 0.881 . . . . 0.0 109.1 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -57.16 -39.76 75.9 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.417 0.627 . . . . 0.0 110.63 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -72.09 -29.19 63.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.552 -175.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.515 HD22 ' CD ' ' A' ' 55' ' ' GLU . 61.0 tp -70.24 -45.26 66.84 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.676 178.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.86 -40.84 88.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 41.5 ttm -57.31 -41.54 80.09 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.23 174.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -66.85 -43.05 84.65 Favored 'General case' 0 C--O 1.208 -1.126 0 O-C-N 123.217 0.323 . . . . 0.0 110.92 177.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.463 HD12 ' OE2' ' A' ' 55' ' ' GLU . 47.3 mm -56.97 -50.04 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.319 0.58 . . . . 0.0 109.839 178.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.8 mt -63.56 -42.07 98.38 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.893 -1.048 . . . . 0.0 110.534 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -62.96 -46.23 88.73 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 123.719 0.808 . . . . 0.0 110.458 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -63.68 -47.79 79.82 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.77 -177.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.402 ' CD1' HD12 ' A' ' 70' ' ' LEU . 38.2 pt -66.67 -40.4 86.07 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.077 178.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.04 -46.45 89.5 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 123.585 0.754 . . . . 0.0 111.641 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.406 HD11 ' N ' ' A' ' 34' ' ' ASP . 4.3 pp -60.07 -37.32 79.54 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -177.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.406 ' N ' HD11 ' A' ' 33' ' ' LEU . 20.1 t70 -76.06 -51.09 13.01 Favored 'General case' 0 CA--C 1.508 -0.646 0 O-C-N 123.412 0.445 . . . . 0.0 110.306 177.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.435 HD21 ' CD2' ' A' ' 74' ' ' TYR . 57.0 tp . . . . . 0 N--CA 1.473 0.695 0 C-N-CA 124.683 1.193 . . . . 0.0 113.322 -175.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.516 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.7 tt . . . . . 0 C--O 1.214 -0.786 0 CA-C-O 120.725 0.297 . . . . 0.0 110.764 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.499 ' O ' HG13 ' A' ' 46' ' ' ILE . 21.0 ptmt -63.44 -34.45 77.77 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.182 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.1 m -76.65 -33.09 58.32 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.501 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 13.2 m -63.52 -40.38 96.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.516 HG12 ' O ' ' A' ' 41' ' ' ILE . 36.1 mm -54.87 -48.37 74.33 Favored 'Isoleucine or valine' 0 C--N 1.346 0.446 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.199 174.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 42' ' ' LYS . 72.7 mt -53.89 -48.69 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.438 -178.289 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.501 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 18.5 m-85 -58.89 -53.01 63.27 Favored 'General case' 0 C--O 1.244 0.788 0 CA-C-O 121.225 0.536 . . . . 0.0 109.844 -177.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.4 t -62.44 -49.81 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.543 -176.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -65.55 -33.96 77.15 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 39.9 m -75.42 -21.93 57.81 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.918 0.389 . . . . 0.0 111.917 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.9 t -93.53 -8.81 40.31 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.973 0.892 . . . . 0.0 109.429 179.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.549 ' O ' HG12 ' A' ' 56' ' ' ILE . 35.6 m-70 -126.46 30.96 5.46 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.158 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.2 mt -48.85 -56.55 8.4 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -170.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.603 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 17.3 t70 -62.27 -44.08 97.36 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.42 -175.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.528 ' HB3' ' O ' ' A' ' 52' ' ' HIS . 26.7 tt0 -53.81 -51.22 64.2 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 124.819 1.248 . . . . 0.0 110.111 175.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 52' ' ' HIS . 51.7 mm -58.57 -44.25 88.97 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.721 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.241 177.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 -65.12 -33.66 76.54 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 178.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.603 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 66.4 mttm -56.85 -47.52 80.18 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.074 0.464 . . . . 0.0 109.778 178.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -127.67 65.42 1.34 Allowed 'General case' 0 C--N 1.317 -0.848 0 CA-C-O 121.982 0.896 . . . . 0.0 110.429 -178.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -66.09 -33.66 76.3 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 114.534 -1.212 . . . . 0.0 112.605 -176.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -65.03 -47.1 78.61 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.279 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -62.5 -52.14 64.65 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.294 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.455 ' CD2' ' HA ' ' A' ' 56' ' ' ILE . 45.0 m-85 -66.82 -30.54 70.75 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -176.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -78.6 -40.12 35.43 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.975 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.6 mtm -63.63 -43.16 97.65 Favored 'General case' 0 CA--C 1.502 -0.886 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.654 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.498 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 36.8 pt -64.68 -38.54 82.93 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.246 0 C-N-CA 119.39 -0.924 . . . . 0.0 111.369 178.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.55 -34.0 68.7 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 121.205 0.526 . . . . 0.0 111.368 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -69.1 -54.49 14.7 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.2 mt -59.95 -44.1 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.269 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.57 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.2 mt -53.31 -51.76 61.33 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 123.451 0.701 . . . . 0.0 111.588 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -65.41 -43.48 90.43 Favored 'General case' 0 C--O 1.257 1.458 0 CA-C-O 121.377 0.608 . . . . 0.0 110.802 -178.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -60.26 -49.03 79.21 Favored 'General case' 0 N--CA 1.426 -1.647 0 C-N-CA 124.538 1.135 . . . . 0.0 111.767 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.521 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 87.7 m-85 -91.61 -15.1 29.08 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.57 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.07 -32.24 73.58 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.829 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -72.83 -24.26 60.87 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.531 175.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -98.01 -51.79 3.92 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -172.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.3 pt -110.75 -29.52 2.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.254 0 C-N-CA 119.898 -0.721 . . . . 0.0 112.478 -176.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.5 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 123.19 147.53 7.37 Favored Glycine 0 C--N 1.306 -1.106 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.5 tp -63.81 -35.62 73.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.949 0.374 . . . . 0.0 111.637 -176.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.98 -44.52 94.44 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 122.282 1.039 . . . . 0.0 109.966 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.467 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 18.1 m120 -64.47 -45.71 86.2 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.772 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.5 HG21 ' O ' ' A' ' 78' ' ' GLY . 21.4 t -66.72 -38.1 80.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 -52.92 -50.17 64.5 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.416 1.087 . . . . 0.0 109.38 177.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -44.24 81.47 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.208 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.7 mt -61.41 -44.39 97.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.14 -178.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.0 mm -62.96 -37.84 80.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 120.853 0.359 . . . . 0.0 110.343 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.31 -44.95 95.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.525 0.679 . . . . 0.0 110.399 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.3 m -64.31 -33.34 75.6 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.073 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.7 m -58.77 -45.7 89.18 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.668 0.787 . . . . 0.0 111.581 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 33.9 pt . . . . . 0 C--O 1.242 0.673 0 CA-C-O 120.967 0.413 . . . . 0.0 111.869 -178.086 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.539 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 10.2 t70 . . . . . 0 C--O 1.246 0.884 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.475 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 17.3 Cg_exo -64.34 -31.75 62.2 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.42 2.08 . . . . 0.0 113.094 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.83 -32.62 61.99 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.833 -175.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -69.59 -42.92 73.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.577 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.52 -34.19 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.322 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.7 mttt -60.23 -45.39 93.38 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.394 175.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.7 mt -56.55 -40.84 75.81 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.566 0.541 . . . . 0.0 111.871 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -71.0 -29.77 65.82 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.492 -177.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 . . . . . 0 C--N 1.313 -0.998 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.327 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.4 m . . . . . 0 N--CA 1.441 -0.922 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -63.5 130.26 43.62 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 122.632 0.373 . . . . 0.0 110.961 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -56.62 -39.45 73.63 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 123.461 0.704 . . . . 0.0 110.451 177.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.426 ' N ' HD21 ' A' ' 22' ' ' ASN . 0.8 OUTLIER -71.47 -28.82 64.2 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.193 -176.05 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.53 ' O ' HG12 ' A' ' 27' ' ' ILE . 59.3 tp -71.48 -49.43 41.33 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.33 178.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.437 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 47.5 t -63.03 -42.3 96.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.6 ttp -57.19 -39.85 76.18 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.056 177.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -69.82 -41.64 74.72 Favored 'General case' 0 C--O 1.215 -0.729 0 O-C-N 123.292 0.37 . . . . 0.0 111.11 177.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.7 mm -56.87 -47.6 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 177.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 79.5 mt -66.58 -42.49 86.88 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.469 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.05 -43.28 96.01 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 123.27 0.628 . . . . 0.0 110.639 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -61.64 -44.22 97.38 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.833 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.2 pt -72.79 -35.06 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.855 177.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -60.7 -49.11 78.81 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 123.648 0.779 . . . . 0.0 110.719 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 pp -69.41 -28.89 66.55 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.972 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -76.29 -49.55 16.7 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.015 0.436 . . . . 0.0 111.951 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 43.2 tp . . . . . 0 C--N 1.314 -0.961 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.756 -176.274 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.456 ' O ' HG12 ' A' ' 45' ' ' ILE . 13.3 tt . . . . . 0 N--CA 1.441 -0.903 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.595 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.2 ptmt -60.74 -36.42 78.85 Favored 'General case' 0 C--O 1.211 -0.921 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.274 177.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.8 m -69.84 -37.81 76.28 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.486 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 34.7 m -64.83 -40.69 95.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 175.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 41' ' ' ILE . 38.6 mm -55.46 -49.1 75.69 Favored 'Isoleucine or valine' 0 C--N 1.345 0.373 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 174.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.595 HG13 ' O ' ' A' ' 42' ' ' LYS . 78.4 mt -53.5 -50.84 46.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.702 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.486 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 15.5 m-85 -57.82 -43.39 85.73 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.79 0.805 . . . . 0.0 111.078 -176.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.0 t -73.95 -46.88 44.88 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.877 -175.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -69.74 -27.43 64.95 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 122.775 0.43 . . . . 0.0 111.86 -178.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.5 p -79.48 -22.33 44.22 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.7 t -95.08 -36.54 11.48 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.781 0.8 . . . . 0.0 109.89 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.602 ' O ' HG12 ' A' ' 56' ' ' ILE . 78.9 m-70 -92.54 42.41 1.1 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.018 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -48.82 -48.02 41.87 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 125.353 1.461 . . . . 0.0 114.403 -175.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -61.3 -45.62 93.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 120.874 0.368 . . . . 0.0 111.417 -174.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.457 ' CG ' HD22 ' A' ' 23' ' ' LEU . 1.7 mp0 -55.4 -53.12 60.2 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 123.879 0.871 . . . . 0.0 110.22 176.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 52' ' ' HIS . 34.3 mm -60.91 -47.04 95.19 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-N 113.727 -1.579 . . . . 0.0 111.289 -176.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -69.95 -28.22 65.39 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -72.59 -49.25 33.57 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.24 0.543 . . . . 0.0 111.168 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -118.93 60.34 0.81 Allowed 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 122.071 0.938 . . . . 0.0 109.742 -176.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -55.35 -37.63 67.74 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 113.466 -1.697 . . . . 0.0 112.487 -176.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER -78.44 -31.73 48.21 Favored 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -176.307 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -68.04 -51.15 50.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.428 ' HA ' HG12 ' A' ' 66' ' ' ILE . 84.9 m-85 -69.08 -31.25 69.86 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.064 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.44 -51.11 64.81 Favored 'General case' 0 C--O 1.245 0.834 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.104 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 72.8 mtm -65.43 -39.6 92.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.41 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.566 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 36.8 pt -66.93 -43.21 89.47 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 C-N-CA 118.367 -1.333 . . . . 0.0 111.024 177.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.14 -39.7 75.69 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.817 0.341 . . . . 0.0 110.756 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -58.69 -56.2 25.23 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.607 176.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.5 mt -65.88 -39.62 85.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 123.985 0.914 . . . . 0.0 112.946 -176.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.597 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 96.6 mt -53.36 -46.98 69.8 Favored 'General case' 0 C--O 1.217 -0.614 0 C-N-CA 122.615 0.366 . . . . 0.0 111.445 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -72.53 -49.16 34.61 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 122.304 1.049 . . . . 0.0 109.784 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 19.6 ttt180 -53.45 -42.03 66.74 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 127.194 2.197 . . . . 0.0 111.725 -176.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.539 ' OH ' ' HB2' ' A' ' 6' ' ' ASP . 55.6 m-85 -100.48 -14.36 18.3 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -178.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.597 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.71 -28.4 68.4 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.636 -0.826 . . . . 0.0 109.781 178.64 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -74.96 -19.45 60.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.511 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -97.79 -50.31 4.49 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -174.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.8 pt -118.73 -29.81 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.531 ' O ' HG22 ' A' ' 82' ' ' VAL . . . 125.61 146.69 6.78 Favored Glycine 0 CA--C 1.5 -0.852 0 C-N-CA 120.299 -0.953 . . . . 0.0 110.893 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.3 tp -64.61 -38.72 83.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.972 0.386 . . . . 0.0 111.798 -175.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -59.22 -38.96 81.21 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.943 0.878 . . . . 0.0 110.133 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.436 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 1.8 m-20 -69.35 -48.57 60.97 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.354 -1.294 . . . . 0.0 109.774 -179.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 78' ' ' GLY . 21.9 t -62.9 -43.09 98.71 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.294 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.581 -177.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.422 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 95.5 m-20 -56.46 -44.9 80.97 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.094 0.474 . . . . 0.0 110.778 178.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -40.36 90.48 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.2 mt -65.26 -40.26 93.73 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.336 179.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.5 mm -62.81 -43.64 98.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 177.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 87.7 mt -59.69 -44.52 93.61 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.62 176.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.4 m -62.08 -34.22 75.87 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 121.233 0.539 . . . . 0.0 110.877 178.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 76.7 m -70.82 -31.91 68.79 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 123.177 0.591 . . . . 0.0 111.905 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.5 pt . . . . . 0 C--N 1.315 -0.93 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.383 178.327 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.458 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 13.8 t70 . . . . . 0 C--O 1.25 1.129 0 N-CA-C 110.601 -0.148 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.538 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 38.8 Cg_exo -62.38 -34.69 76.17 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.76 2.307 . . . . 0.0 113.206 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -76.21 -34.5 59.26 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.666 0.746 . . . . 0.0 109.598 -178.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -64.47 -41.36 96.55 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.63 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.27 -33.77 65.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 C-N-CA 120.595 -0.442 . . . . 0.0 109.962 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.3 mttt -61.05 -43.27 99.14 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 174.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.0 mt -56.64 -42.58 79.14 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.014 0.525 . . . . 0.0 111.245 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.1 mmt180 -59.47 -39.37 83.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.155 178.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 . . . . . 0 C--N 1.312 -1.044 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.262 -179.137 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 16.5 m . . . . . 0 N--CA 1.431 -1.413 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.413 ' O ' HG23 ' A' ' 24' ' ' VAL . 49.7 t-20 -66.71 125.27 25.3 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -54.1 -37.42 64.27 Favored 'General case' 0 C--N 1.321 -0.658 0 O-C-N 123.955 0.785 . . . . 0.0 111.091 178.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -68.11 -36.62 80.04 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.137 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.632 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.3 tp -76.45 -39.13 54.2 Favored 'General case' 0 N--CA 1.416 -2.148 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.186 -177.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 20' ' ' ASN . 61.8 t -58.17 -48.07 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 176.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 48.4 ttp -58.29 -40.47 82.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.331 177.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -70.65 -36.2 73.28 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.396 178.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.632 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -58.93 -51.74 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 176.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 78.1 mt -60.66 -38.14 83.89 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.613 -179.326 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -71.15 -47.14 59.53 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.925 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.414 ' OE2' HG23 ' A' ' 48' ' ' VAL . 15.4 tt0 -63.46 -42.9 98.63 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.375 -176.563 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 32.5 pt -68.67 -37.63 77.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.696 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.931 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.37 -52.5 65.38 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 123.203 0.601 . . . . 0.0 111.48 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.98 -29.26 69.62 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.208 -177.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -76.21 -46.91 26.05 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.004 0.43 . . . . 0.0 110.476 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 20.7 tp . . . . . 0 C--O 1.253 1.243 0 C-N-CA 124.223 1.009 . . . . 0.0 112.451 -179.726 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.5 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.4 tt . . . . . 0 N--CA 1.446 -0.658 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.471 ' O ' HG13 ' A' ' 46' ' ' ILE . 65.2 pttt -69.28 -28.41 66.27 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.836 -178.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.0 m -71.33 -43.8 66.33 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.353 -0.84 . . . . 0.0 108.966 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.4 m -59.52 -40.61 87.68 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.092 176.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 41' ' ' ILE . 26.7 mm -51.66 -45.66 37.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.948 0.899 . . . . 0.0 110.108 175.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 42' ' ' LYS . 70.2 mt -56.85 -51.8 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.441 -177.244 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -60.57 -43.86 96.83 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.432 0.634 . . . . 0.0 110.871 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.414 HG23 ' OE2' ' A' ' 30' ' ' GLU . 46.6 t -69.15 -45.96 78.79 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.023 -174.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -68.05 -37.94 81.9 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.259 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 75.7 p -70.51 -21.46 62.74 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.119 0.485 . . . . 0.0 112.033 -178.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.3 t -92.86 -48.14 6.69 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.972 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.464 ' O ' HG12 ' A' ' 56' ' ' ILE . 86.2 m-70 -96.15 41.07 1.11 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 -174.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.449 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 85.6 mt -47.66 -41.32 22.04 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.679 1.592 . . . . 0.0 114.386 -175.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -53.56 -52.93 58.16 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.556 0.535 . . . . 0.0 112.431 -172.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -73.56 -34.06 64.97 Favored 'General case' 0 C--O 1.249 1.063 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.263 -176.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.52 ' HA ' ' CD2' ' A' ' 63' ' ' TYR . 40.1 mm -59.4 -43.45 90.37 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.66 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.449 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 50.1 mtp180 -70.84 -28.09 64.34 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -60.71 -55.83 28.57 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-O 121.676 0.75 . . . . 0.0 110.447 174.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.3 m-80 -116.14 60.88 0.72 Allowed 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.514 -174.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -56.94 -36.65 70.49 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.544 -178.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -65.22 -39.47 92.81 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.682 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -64.6 -51.49 62.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.8 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.52 ' CD2' ' HA ' ' A' ' 56' ' ' ILE . 68.7 m-85 -68.72 -34.13 75.11 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -177.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -70.21 -45.49 66.48 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.858 0.361 . . . . 0.0 110.103 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.1 mtm -67.56 -41.74 83.74 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.244 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.487 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.7 pt -65.02 -35.96 76.69 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.013 0 C-N-CA 118.695 -1.202 . . . . 0.0 111.131 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.543 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -55.67 -44.56 77.38 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 123.409 0.443 . . . . 0.0 111.734 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -74.06 -37.96 64.09 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.375 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 90.3 mt -65.4 -42.42 93.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.543 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.6 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.6 mt -54.59 -46.13 73.73 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.728 178.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 64.2 mt-30 -62.34 -52.22 64.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.629 0.728 . . . . 0.0 109.828 179.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -58.9 -52.75 64.38 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.364 1.465 . . . . 0.0 112.403 -174.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.458 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 45.5 m-85 -83.99 -22.54 31.34 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -175.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.6 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.98 -30.79 71.0 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 118.993 -1.083 . . . . 0.0 109.709 176.814 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -73.89 -19.84 60.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.943 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -99.66 -51.28 3.79 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.0 pt -113.95 -29.66 2.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.053 0.454 . . . . 0.0 111.803 -174.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.487 ' O ' HG22 ' A' ' 82' ' ' VAL . . . 122.71 146.97 7.32 Favored Glycine 0 CA--C 1.491 -1.419 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 178.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tp -63.09 -35.91 73.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.938 0.369 . . . . 0.0 111.063 -175.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -55.36 -46.8 76.43 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-O 121.255 0.55 . . . . 0.0 110.729 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.452 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.0 t-20 -63.71 -49.49 72.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.237 -177.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 78' ' ' GLY . 20.6 t -62.59 -45.87 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.712 -175.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -53.83 -43.65 69.62 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.284 0.564 . . . . 0.0 111.26 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -44.46 78.59 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 84.6 mt -62.46 -38.07 88.39 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.637 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.4 mm -61.79 -41.94 92.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.09 -41.44 99.41 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.175 178.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.9 m -61.13 -34.29 74.74 Favored 'General case' 0 CA--C 1.555 1.161 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.985 176.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 36.5 m -63.4 -39.46 94.56 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 123.205 0.602 . . . . 0.0 111.453 -176.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 27.1 pt . . . . . 0 C--N 1.315 -0.925 0 CA-C-O 121.259 0.552 . . . . 0.0 111.748 179.989 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.509 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 18.2 t70 . . . . . 0 N--CA 1.439 -1.022 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.97 -29.92 82.64 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.72 2.947 . . . . 0.0 113.95 177.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.98 -45.63 63.72 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -177.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -61.1 -44.83 96.76 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.313 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.2 p -62.62 -34.32 64.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 120.936 0.398 . . . . 0.0 110.65 -179.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.48 ' HE3' ' SD ' ' A' ' 65' ' ' MET . 55.8 mtmt -65.66 -43.26 89.9 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 122.221 -0.299 . . . . 0.0 110.697 173.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 94.9 mt -57.73 -38.63 75.63 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.117 0.484 . . . . 0.0 110.893 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -59.46 -40.52 87.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.426 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 . . . . . 0 C--N 1.314 -0.94 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.192 179.552 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 29.3 m . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -86.06 128.4 34.86 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -57.08 -39.93 75.93 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 123.041 0.536 . . . . 0.0 111.998 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -72.56 -34.61 67.62 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -174.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.624 ' O ' HG12 ' A' ' 27' ' ' ILE . 38.5 tp -71.75 -41.92 67.86 Favored 'General case' 0 N--CA 1.425 -1.696 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.233 -177.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.434 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 91.0 t -66.18 -41.62 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 120.829 0.347 . . . . 0.0 110.098 178.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 50.7 ttp -61.23 -37.08 81.79 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.891 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -69.48 -40.62 76.95 Favored 'General case' 0 C--O 1.205 -1.239 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.545 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.6 mm -56.66 -47.17 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 94.1 mt -62.22 -44.79 95.77 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.996 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.92 -46.92 73.33 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.304 0.573 . . . . 0.0 110.503 -178.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -62.04 -40.84 97.09 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.102 -175.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.424 ' CD1' HD11 ' A' ' 70' ' ' LEU . 45.2 pt -72.98 -40.71 59.61 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.676 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.045 176.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.14 -49.7 76.17 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 122.98 0.512 . . . . 0.0 111.423 -178.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.47 -31.85 72.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.989 0.423 . . . . 0.0 111.154 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -75.35 -44.47 45.0 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 57.0 tp . . . . . 0 N--CA 1.477 0.916 0 C-N-CA 124.636 1.174 . . . . 0.0 112.807 179.7 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.518 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.5 tt . . . . . 0 N--CA 1.444 -0.766 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.448 ' O ' HG13 ' A' ' 46' ' ' ILE . 64.8 pttt -66.49 -34.61 78.31 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.668 178.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.2 m -64.25 -44.87 90.43 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 176.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.6 m -57.53 -41.66 81.33 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.643 176.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.518 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.0 mm -55.64 -44.78 78.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 123.476 0.71 . . . . 0.0 110.104 177.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 42' ' ' LYS . 68.3 mt -52.27 -51.05 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.372 0.669 . . . . 0.0 111.875 -178.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -63.72 -52.74 59.17 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.438 0.637 . . . . 0.0 110.716 -176.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.8 t -62.53 -43.4 98.35 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.039 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.402 ' CE2' ' HB3' ' A' ' 63' ' ' TYR . 2.1 m-85 -72.19 -31.51 65.96 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.286 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.423 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 29.2 t -73.78 -31.27 63.21 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.384 0.612 . . . . 0.0 109.377 177.182 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.6 t -73.51 -53.39 10.7 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.424 178.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.51 ' O ' HG12 ' A' ' 56' ' ' ILE . 78.8 m-70 -100.68 42.62 1.1 Allowed 'General case' 0 C--N 1.304 -1.394 0 O-C-N 122.034 -0.416 . . . . 0.0 110.642 -172.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 50' ' ' SER . 82.1 mt -48.61 -38.75 21.72 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.529 1.132 . . . . 0.0 113.022 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -53.24 -50.81 64.01 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -75.2 -34.04 61.46 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.209 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.51 HG12 ' O ' ' A' ' 52' ' ' HIS . 42.5 mm -60.34 -42.46 90.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-O 120.969 0.414 . . . . 0.0 110.39 -178.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.466 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 34.2 ptt180 -71.63 -33.65 69.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.07 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.3 tttm -66.56 -50.41 63.21 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 123.208 0.603 . . . . 0.0 109.615 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -114.71 60.38 0.68 Allowed 'General case' 0 CA--C 1.48 -1.725 0 CA-C-O 122.168 0.985 . . . . 0.0 111.279 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.466 ' HE3' ' O ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -55.59 -37.63 68.33 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 113.627 -1.624 . . . . 0.0 112.267 -177.088 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -70.93 -41.26 71.4 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 120.698 0.285 . . . . 0.0 110.78 -178.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.454 ' O ' HG12 ' A' ' 66' ' ' ILE . 83.3 t80 -62.91 -51.48 66.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.125 -178.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.466 ' HA ' HG12 ' A' ' 66' ' ' ILE . 93.4 m-85 -73.47 -24.69 60.23 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -177.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -72.93 -50.09 25.6 Favored 'General case' 0 C--O 1.265 1.902 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.48 ' SD ' ' HE3' ' A' ' 11' ' ' LYS . 79.2 mtm -65.37 -47.93 74.69 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.421 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.499 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 48.5 pt -63.95 -34.5 68.81 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.525 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.69 -178.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.534 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.01 -45.47 79.08 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 123.125 0.266 . . . . 0.0 111.614 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.71 -34.3 58.16 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 118.67 -1.212 . . . . 0.0 111.789 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 65' ' ' MET . 85.0 mt -60.59 -45.08 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.608 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 87.3 mt -55.65 -45.64 77.61 Favored 'General case' 0 C--O 1.21 -1.021 0 C-N-CA 123.535 0.734 . . . . 0.0 110.89 179.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.534 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.7 mt-30 -68.86 -49.34 59.14 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 121.31 0.576 . . . . 0.0 110.566 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -61.86 -49.17 77.32 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 124.161 0.984 . . . . 0.0 111.817 -177.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.509 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 63.6 m-85 -82.38 -16.9 47.45 Favored 'General case' 0 N--CA 1.427 -1.581 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -177.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.608 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.46 -29.79 69.33 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 172.651 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -79.63 -44.11 21.57 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.904 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.458 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 65.7 tttm -72.85 -44.82 60.91 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.76 -25.92 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.574 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 122.05 141.36 6.02 Favored Glycine 0 C--N 1.311 -0.824 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 178.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.3 tp -61.06 -37.66 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 117.202 0.501 . . . . 0.0 112.061 -173.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -60.41 -43.73 96.41 Favored 'General case' 0 C--O 1.244 0.796 0 CA-C-O 122.136 0.969 . . . . 0.0 109.667 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.409 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 94.0 m-20 -67.66 -40.39 84.49 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.729 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.574 HG21 ' O ' ' A' ' 78' ' ' GLY . 17.5 t -66.52 -41.42 88.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.408 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.9 OUTLIER -52.43 -49.58 64.27 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 121.218 0.532 . . . . 0.0 110.199 177.559 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -44.9 92.09 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.401 -177.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.7 mt -66.18 -35.96 81.83 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.462 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.8 mm -65.53 -41.64 91.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 175.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 94.8 mt -63.34 -40.1 96.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.98 176.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 94.3 m -59.07 -33.61 71.0 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 123.859 0.864 . . . . 0.0 110.914 176.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.4 m -69.14 -48.29 62.77 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.94 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.2 pt . . . . . 0 C--O 1.237 0.434 0 CA-C-O 121.037 0.446 . . . . 0.0 112.061 -178.886 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.463 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 4.8 t70 . . . . . 0 N--CA 1.447 -0.608 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -65.57 -28.92 52.84 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.624 2.216 . . . . 0.0 112.522 175.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -74.84 -39.32 61.67 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 121.765 -0.584 . . . . 0.0 109.425 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -65.51 -44.04 88.22 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.143 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.07 -34.71 70.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 121.195 0.521 . . . . 0.0 110.14 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.418 ' HZ1' ' HB2' ' A' ' 11' ' ' LYS . 10.4 mtmp? -67.83 -36.95 81.26 Favored 'General case' 0 C--O 1.198 -1.64 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.165 175.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.9 mt -59.29 -40.46 86.22 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.778 0.263 . . . . 0.0 111.337 176.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -61.37 -41.18 96.66 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.273 0.559 . . . . 0.0 111.644 177.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 . . . . . 0 C--N 1.305 -1.347 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.961 -178.426 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.7 m . . . . . 0 C--O 1.252 1.196 0 CA-C-O 120.946 0.403 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -85.76 119.72 26.4 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 171.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -54.62 -35.96 63.99 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 123.486 0.491 . . . . 0.0 111.552 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -70.22 -35.0 73.57 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-O 121.252 0.548 . . . . 0.0 109.964 -176.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.594 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.1 tp -76.83 -42.32 40.75 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.16 -177.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.524 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 62.9 t -61.2 -43.6 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.442 ' O ' ' HB2' ' A' ' 29' ' ' ASP . 58.8 ttp -60.52 -33.68 72.99 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.236 178.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -75.4 -38.86 59.64 Favored 'General case' 0 C--O 1.206 -1.212 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.613 176.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.594 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.2 mm -56.99 -52.39 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 121.331 0.586 . . . . 0.0 110.161 -179.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 3.2 pp -71.4 -30.57 66.25 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.582 -178.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.442 ' HB2' ' O ' ' A' ' 25' ' ' MET . 30.8 t70 -68.38 -44.37 75.3 Favored 'General case' 0 C--N 1.299 -1.587 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.019 176.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.19 -38.19 90.16 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.75 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.6 pt -70.15 -41.43 78.97 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.188 176.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.438 ' OE1' ' HG2' ' A' ' 80' ' ' GLU . 37.2 tt0 -59.13 -54.45 46.82 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.013 0.925 . . . . 0.0 111.383 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.473 HD13 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -63.63 -34.52 78.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -178.271 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.473 ' N ' HD13 ' A' ' 33' ' ' LEU . 18.4 t0 -76.28 -40.73 50.94 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.139 -178.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.9 tp . . . . . 0 C--O 1.249 1.059 0 C-N-CA 124.776 1.231 . . . . 0.0 111.792 179.827 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.551 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.5 tt . . . . . 0 CA--C 1.547 0.862 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.438 ' O ' HG13 ' A' ' 46' ' ' ILE . 58.6 pttt -61.75 -33.7 74.52 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.19 0.519 . . . . 0.0 110.445 175.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.4 m -74.55 -41.65 60.21 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.235 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 12.8 m -58.45 -40.77 83.5 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.835 175.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.551 HG12 ' O ' ' A' ' 41' ' ' ILE . 32.8 mm -54.34 -46.92 69.71 Favored 'Isoleucine or valine' 0 C--N 1.349 0.555 0 C-N-CA 123.815 0.846 . . . . 0.0 110.256 176.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 42' ' ' LYS . 71.8 mt -52.13 -51.43 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 123.481 0.712 . . . . 0.0 111.789 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -59.73 -53.26 60.09 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.676 0.75 . . . . 0.0 110.971 -175.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.1 t -66.83 -41.91 88.42 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.665 -174.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -68.86 -38.98 80.1 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.314 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.4 t -69.96 -26.71 64.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.417 0.627 . . . . 0.0 110.292 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.8 t -82.31 -48.21 11.46 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-O 121.341 0.591 . . . . 0.0 110.696 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.478 ' O ' HG12 ' A' ' 56' ' ' ILE . 73.9 m-70 -101.19 40.9 1.23 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.73 -174.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 89.5 mt -47.04 -39.87 13.71 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.332 1.453 . . . . 0.0 113.893 -177.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -54.14 -50.79 66.12 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -175.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.446 ' CG ' ' HH ' ' A' ' 63' ' ' TYR . 4.5 tp10 -73.07 -35.79 66.74 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 120.991 0.424 . . . . 0.0 109.861 -178.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 52' ' ' HIS . 43.6 mm -58.58 -51.16 75.08 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.165 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.915 -179.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -77.47 -16.09 58.95 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -74.99 -48.56 23.57 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -116.83 53.55 0.89 Allowed 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.073 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -57.23 -39.96 76.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.012 -0.995 . . . . 0.0 113.408 -174.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -62.03 -37.27 84.31 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.268 0.556 . . . . 0.0 110.957 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -69.01 -49.3 58.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.897 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.477 ' HA ' HG12 ' A' ' 66' ' ' ILE . 72.9 m-85 -68.31 -33.45 74.34 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.19 -48.12 82.99 Favored 'General case' 0 C--O 1.254 1.339 0 CA-C-O 121.209 0.528 . . . . 0.0 109.882 177.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.406 ' O ' ' HB3' ' A' ' 68' ' ' GLU . 79.2 mtm -68.9 -45.8 69.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.82 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.6 pt -69.23 -37.86 76.79 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.448 0 C-N-CA 119.014 -1.075 . . . . 0.0 112.968 -177.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.12 -38.39 76.41 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.427 0.632 . . . . 0.0 109.815 177.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 65' ' ' MET . 19.3 tp10 -63.51 -56.38 16.48 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.27 176.191 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.6 mt -59.47 -39.08 78.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.208 0.603 . . . . 0.0 112.498 -178.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.8 mt -53.98 -50.95 65.4 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 122.658 0.383 . . . . 0.0 111.771 178.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -70.84 -49.4 46.65 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 122.241 1.02 . . . . 0.0 109.385 -178.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.403 ' HD2' ' OE2' ' A' ' 68' ' ' GLU . 29.0 ttt180 -54.93 -38.95 68.34 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 127.655 2.382 . . . . 0.0 111.797 -177.047 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.463 ' HH ' ' HB2' ' A' ' 6' ' ' ASP 0.257 28.6 m-85 -99.83 -14.69 18.69 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -178.652 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.427 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.26 -26.58 66.64 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 174.374 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -78.13 -17.87 56.36 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.653 176.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -99.93 -51.57 3.67 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.389 0.614 . . . . 0.0 112.307 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.4 pt -117.37 -27.23 2.45 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.072 -173.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.544 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 116.83 148.66 8.95 Favored Glycine 0 N--CA 1.434 -1.46 0 C-N-CA 120.297 -0.954 . . . . 0.0 111.076 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 5.5 tp -59.71 -42.41 88.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -175.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.438 ' HG2' ' OE1' ' A' ' 32' ' ' GLU . 41.6 mt-10 -64.59 -35.85 82.34 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 121.151 0.5 . . . . 0.0 111.56 -176.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -64.51 -47.3 79.4 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.552 174.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.544 HG21 ' O ' ' A' ' 78' ' ' GLY . 21.7 t -63.83 -42.32 95.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.08 -178.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.48 ' HB3' HD12 ' A' ' 28' ' ' LEU . 95.3 m-20 -51.92 -47.93 64.44 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.513 0.725 . . . . 0.0 111.307 177.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -45.02 76.92 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.295 -0.866 . . . . 0.0 108.868 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.414 ' O ' ' HB ' ' A' ' 88' ' ' THR . 95.7 mt -61.98 -39.59 92.72 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.426 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.9 mm -63.56 -40.2 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 120.915 0.388 . . . . 0.0 109.958 177.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 92.6 mt -64.35 -37.09 86.28 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.801 0.81 . . . . 0.0 109.467 177.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.414 ' HB ' ' O ' ' A' ' 85' ' ' LEU . 86.4 m -66.05 -34.31 77.78 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.59 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 m -64.48 -40.9 96.55 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 120.822 0.344 . . . . 0.0 110.508 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.0 pt . . . . . 0 C--N 1.318 -0.795 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -177.048 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.439 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 13.6 t70 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 120.396 0.141 . . . . 0.0 110.773 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.497 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 39.4 Cg_exo -61.87 -28.03 80.86 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.165 2.576 . . . . 0.0 113.664 -179.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -72.23 -32.21 66.53 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.586 -176.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -66.86 -44.11 81.83 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.349 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.8 p -67.44 -34.21 67.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-O 121.269 0.557 . . . . 0.0 109.859 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.497 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 68.5 mttm -62.37 -42.65 99.58 Favored 'General case' 0 C--O 1.207 -1.17 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.731 174.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.9 mt -58.62 -34.97 71.76 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.586 0.231 . . . . 0.0 111.564 179.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.4 mmm180 -63.86 -32.02 73.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.117 0.484 . . . . 0.0 110.416 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 . . . . . 0 C--N 1.316 -0.869 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.356 177.987 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 m . . . . . 0 N--CA 1.445 -0.709 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.422 ' O ' HG21 ' A' ' 24' ' ' VAL . 48.7 t-20 -86.91 113.14 22.44 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 106.533 -1.654 . . . . 0.0 106.533 173.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -53.09 -36.88 61.18 Favored 'General case' 0 C--N 1.314 -0.958 0 O-C-N 123.657 0.598 . . . . 0.0 111.166 179.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -74.49 -35.17 63.23 Favored 'General case' 0 CA--C 1.487 -1.478 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.646 -172.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.61 ' O ' HG12 ' A' ' 27' ' ' ILE . 25.0 tp -76.64 -39.08 53.44 Favored 'General case' 0 N--CA 1.418 -2.051 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.162 -178.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.422 HG21 ' O ' ' A' ' 20' ' ' ASN . 61.2 t -62.44 -40.91 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.1 ttp -59.65 -43.18 94.0 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.722 176.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -67.2 -38.28 85.06 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.911 177.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.61 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.75 -52.08 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 176.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.5 mt -62.02 -41.42 98.07 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.961 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -66.93 -47.29 72.14 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-O 121.436 0.636 . . . . 0.0 110.472 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -64.16 -40.79 96.88 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.907 -176.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.1 pt -70.09 -40.05 77.9 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.933 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.808 176.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.63 -50.21 74.68 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.076 0.95 . . . . 0.0 111.407 -178.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.416 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.3 pp -62.59 -34.09 76.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.184 -178.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.416 ' N ' HD12 ' A' ' 33' ' ' LEU . 29.4 t70 -76.75 -50.26 14.01 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.728 176.071 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.0 tp . . . . . 0 C--O 1.247 0.964 0 C-N-CA 125.258 1.423 . . . . 0.0 113.05 -176.421 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.521 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.8 tt . . . . . 0 C--O 1.206 -1.231 0 CA-C-O 120.936 0.398 . . . . 0.0 110.328 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.408 ' O ' HG13 ' A' ' 46' ' ' ILE . 40.4 mtmt -56.68 -46.96 80.85 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.524 0.729 . . . . 0.0 109.764 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.6 m -71.65 -36.62 70.75 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 114.667 -1.151 . . . . 0.0 109.754 -179.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.5 m -61.4 -39.68 91.59 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.917 176.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 41' ' ' ILE . 35.7 mm -56.9 -48.75 80.9 Favored 'Isoleucine or valine' 0 C--N 1.351 0.637 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 42' ' ' LYS . 68.1 mt -52.93 -48.72 51.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 115.333 -0.848 . . . . 0.0 112.473 -177.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -60.96 -53.36 58.16 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.769 0.795 . . . . 0.0 110.312 -176.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.04 -46.04 94.96 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.634 -174.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -66.49 -37.7 85.65 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.32 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.9 t -71.81 -26.93 62.6 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-O 120.983 0.421 . . . . 0.0 110.775 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.2 t -81.79 -44.73 16.58 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.376 0.608 . . . . 0.0 109.97 178.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.482 ' O ' HG12 ' A' ' 56' ' ' ILE . 82.7 m-70 -102.14 38.97 1.55 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.349 -175.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 77.8 mt -47.64 -36.79 11.5 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 -177.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.528 ' O ' ' HD3' ' A' ' 58' ' ' LYS . 26.1 t70 -54.43 -51.55 64.58 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -176.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.406 ' CG ' ' HH ' ' A' ' 63' ' ' TYR . 11.6 tp10 -73.55 -29.72 62.61 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.65 -177.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 52' ' ' HIS . 37.8 mm -64.19 -45.74 95.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.054 179.336 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -74.3 -32.71 62.98 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.537 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.528 ' HD3' ' O ' ' A' ' 54' ' ' ASP . 2.1 mptm? -63.8 -43.44 96.27 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 120.769 0.319 . . . . 0.0 110.87 177.145 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -123.92 60.99 1.1 Allowed 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.864 0.84 . . . . 0.0 111.076 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -64.06 -25.88 68.31 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.156 -176.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -69.41 -52.16 29.5 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -59.41 -50.66 73.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.778 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.473 ' HA ' HG12 ' A' ' 66' ' ' ILE . 74.2 m-85 -67.05 -32.29 73.38 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -67.74 -44.94 76.38 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.17 0.51 . . . . 0.0 110.297 177.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 88.2 mtp -67.55 -45.8 74.61 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.694 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.518 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 48.0 pt -66.64 -36.36 77.06 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.566 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.681 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.78 -40.7 80.43 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.112 0.415 . . . . 0.0 110.424 178.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -62.71 -51.38 67.39 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.268 177.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 82.0 mt -63.64 -41.29 92.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.956 -178.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 86.5 mt -58.51 -48.71 79.92 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.85 0.46 . . . . 0.0 111.554 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -64.43 -48.7 74.33 Favored 'General case' 0 C--O 1.251 1.17 0 CA-C-O 122.192 0.996 . . . . 0.0 109.815 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -60.0 -45.7 91.88 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 113.833 -1.531 . . . . 0.0 110.905 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.493 ' CE2' ' HD3' ' A' ' 76' ' ' LYS 0.252 31.5 m-85 -91.81 -21.28 20.75 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -174.921 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -67.5 -31.19 71.15 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 118.37 -1.332 . . . . 0.0 108.543 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -74.26 -38.16 63.53 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.177 0.513 . . . . 0.0 110.141 176.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.493 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 87.1 tttt -75.66 -51.02 13.72 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.711 -175.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.5 pt -122.27 -30.7 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.533 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 127.58 143.8 5.8 Favored Glycine 0 C--N 1.315 -0.602 0 C-N-CA 120.347 -0.93 . . . . 0.0 111.997 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tp -60.87 -40.55 85.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -175.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -59.58 -39.6 84.66 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.678 0.752 . . . . 0.0 110.225 -178.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.486 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.3 m-20 -66.24 -50.26 64.38 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.291 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 78' ' ' GLY . 25.3 t -63.88 -38.34 82.1 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.885 -176.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 -52.94 -50.11 64.68 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.024 0.929 . . . . 0.0 109.715 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -39.47 80.6 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.009 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 91.7 mt -66.22 -38.4 87.86 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -178.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.7 mm -66.11 -39.44 84.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.06 -39.25 93.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.325 176.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 86.0 m -58.87 -34.03 71.15 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.426 0.69 . . . . 0.0 110.193 176.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 65.1 m -65.18 -45.94 82.83 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.825 -178.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.1 pt . . . . . 0 C--N 1.32 -0.717 0 CA-C-O 121.288 0.566 . . . . 0.0 112.095 -177.977 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.8 t70 . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.473 ' O ' HG11 ' A' ' 10' ' ' VAL . 9.1 Cg_exo -72.16 -28.73 15.31 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.042 2.494 . . . . 0.0 113.19 178.298 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -76.23 -31.33 58.31 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 122.038 0.923 . . . . 0.0 109.052 -177.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -59.4 -43.06 93.05 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.512 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.473 HG11 ' O ' ' A' ' 7' ' ' PRO . 7.5 p -68.05 -33.8 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 C-N-CA 120.171 -0.611 . . . . 0.0 110.19 178.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.27 -38.09 79.24 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.868 0.365 . . . . 0.0 110.08 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.67 -38.72 90.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.689 176.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -61.9 -38.57 88.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.576 177.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 . . . . . 0 C--N 1.317 -0.806 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.915 178.354 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.407 ' CG2' HG21 ' A' ' 24' ' ' VAL . 27.2 m . . . . . 0 C--O 1.249 1.047 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.462 ' O ' HG22 ' A' ' 24' ' ' VAL . 48.9 m-80 -72.95 107.09 5.14 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -51.91 -48.29 64.25 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -68.56 -29.45 68.0 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-O 121.155 0.502 . . . . 0.0 110.341 -175.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.549 ' O ' HG12 ' A' ' 27' ' ' ILE . 32.7 tp -77.34 -41.83 38.97 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.934 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 20' ' ' ASN . 60.8 t -61.81 -43.96 98.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.4 ttp -56.37 -36.64 69.05 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.682 177.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -75.62 -38.44 58.98 Favored 'General case' 0 C--O 1.211 -0.942 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.221 177.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.8 mm -57.0 -50.62 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.452 ' HB3' ' CG ' ' A' ' 83' ' ' ASN . 86.3 mt -61.61 -42.92 99.57 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.325 -1.307 . . . . 0.0 110.273 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -62.05 -48.29 80.89 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.65 178.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -62.53 -39.89 95.02 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.516 -175.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 38.7 pt -73.54 -37.9 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.807 176.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -59.54 -52.7 64.44 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.943 0.897 . . . . 0.0 110.844 -178.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.405 HD13 ' N ' ' A' ' 34' ' ' ASP . 4.4 pp -68.12 -28.6 67.47 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.086 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.405 ' N ' HD13 ' A' ' 33' ' ' LEU . 26.9 t70 -70.74 -44.02 67.65 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.011 0.434 . . . . 0.0 110.357 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.0 tt . . . . . 0 C--O 1.248 1.005 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 176.081 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.501 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.0 tt . . . . . 0 N--CA 1.434 -1.23 0 N-CA-C 111.472 0.175 . . . . 0.0 111.472 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.531 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.5 ptmt -64.48 -32.64 74.36 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.356 -179.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.6 m -67.31 -45.77 75.51 Favored 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.7 m -61.24 -40.64 94.8 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.608 177.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 41' ' ' ILE . 30.1 mm -53.67 -44.3 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.904 0.881 . . . . 0.0 109.948 176.087 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 42' ' ' LYS . 77.2 mt -54.75 -52.46 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.87 -177.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.38 -46.07 90.3 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-O 121.35 0.595 . . . . 0.0 111.349 -176.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.54 -46.21 71.14 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.581 -172.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -65.18 -38.81 91.71 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.232 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 82.9 p -73.81 -21.77 60.03 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.379 0.609 . . . . 0.0 111.692 -177.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.7 t -93.58 -20.33 20.32 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-O 121.1 0.476 . . . . 0.0 110.99 -178.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.511 ' O ' HG12 ' A' ' 56' ' ' ILE . 62.5 m-70 -123.8 39.27 4.0 Favored 'General case' 0 C--N 1.317 -0.805 0 O-C-N 121.804 -0.56 . . . . 0.0 109.738 -176.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 93.8 mt -49.32 -36.79 22.19 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -174.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -56.59 -51.51 68.34 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -176.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -73.14 -36.91 66.75 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.511 HG12 ' O ' ' A' ' 52' ' ' HIS . 42.4 mm -62.36 -49.3 84.48 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.648 -177.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -77.18 -26.58 53.07 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.254 0.55 . . . . 0.0 111.398 -175.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -71.41 -43.49 66.67 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.561 0.696 . . . . 0.0 109.681 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -116.32 46.54 1.57 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 114.909 -1.041 . . . . 0.0 108.479 -177.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -59.97 -32.64 71.01 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.561 -174.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -64.14 -43.36 95.44 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -66.07 -51.57 56.9 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.999 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.435 ' HA ' HG12 ' A' ' 66' ' ' ILE . 68.3 m-85 -67.82 -28.95 68.01 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -74.05 -44.47 54.11 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.467 177.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.8 mtm -65.07 -45.85 83.6 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.664 179.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.7 pt -63.38 -41.96 94.6 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.028 0 C-N-CA 119.519 -0.872 . . . . 0.0 111.912 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.516 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.88 -36.69 65.39 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.193 0.52 . . . . 0.0 111.433 -178.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.51 -54.9 10.37 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.602 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 78.9 mt -60.57 -40.73 85.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.146 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 97.1 mt -55.22 -46.89 75.95 Favored 'General case' 0 C--O 1.213 -0.854 0 C-N-CA 123.129 0.571 . . . . 0.0 111.436 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.516 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 63.2 mt-30 -69.33 -41.37 76.75 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.314 0.578 . . . . 0.0 110.15 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -59.97 -47.04 87.44 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.214 1.006 . . . . 0.0 110.308 -178.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -87.14 -15.51 38.18 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.485 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.81 -29.65 69.64 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 176.369 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -78.76 -28.11 44.76 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.404 176.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -90.18 -51.31 5.51 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -174.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.3 pt -121.47 -19.07 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -176.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.574 ' O ' HG22 ' A' ' 82' ' ' VAL . . . 109.0 140.6 9.08 Favored Glycine 0 C--N 1.305 -1.188 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 178.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.2 tp -57.26 -40.47 73.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -174.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -57.69 -41.77 82.33 Favored 'General case' 0 C--O 1.251 1.142 0 CA-C-O 122.252 1.025 . . . . 0.0 109.993 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.52 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 49.0 m-80 -70.51 -43.53 69.45 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 113.971 -1.468 . . . . 0.0 111.379 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.574 HG22 ' O ' ' A' ' 78' ' ' GLY . 12.6 t -63.51 -46.21 95.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 O-C-N 123.231 0.332 . . . . 0.0 110.293 -177.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.452 ' CG ' ' HB3' ' A' ' 28' ' ' LEU . 95.1 m-20 -52.31 -47.06 66.17 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.818 0.699 . . . . 0.0 110.83 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -60.84 -41.33 95.61 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.378 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 65.7 mt -74.34 -31.24 62.36 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.368 -177.166 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.7 mm -63.2 -37.49 79.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 84.9 mt -63.31 -39.52 94.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.549 176.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 17.3 m -66.39 -33.67 76.23 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.556 0.693 . . . . 0.0 110.056 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 78.6 m -64.72 -48.62 73.98 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.102 -178.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 36.6 pt . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.44 -179.576 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.2 t70 . . . . . 0 N--CA 1.435 -1.221 0 CA-C-O 120.325 0.107 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.489 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 26.8 Cg_exo -63.02 -34.67 69.65 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.652 2.235 . . . . 0.0 113.018 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.438 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 5.6 mm-40 -77.64 -30.13 52.05 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.309 0.576 . . . . 0.0 111.528 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -66.35 -38.71 88.23 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.762 176.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.439 HG13 ' O ' ' A' ' 7' ' ' PRO . 9.3 p -68.6 -33.43 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.817 177.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 7' ' ' PRO . 40.1 mmtm -55.04 -36.03 65.09 Favored 'General case' 0 C--N 1.361 1.104 0 CA-C-O 121.054 0.454 . . . . 0.0 110.038 173.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.34 -38.41 81.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.068 179.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -65.28 -32.89 74.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.569 0.699 . . . . 0.0 109.708 176.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 . . . . . 0 C--N 1.309 -1.165 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.079 177.522 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 15.7 m . . . . . 0 C--O 1.247 0.972 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -78.78 118.64 21.03 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 173.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -55.37 -35.51 65.35 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 123.643 0.777 . . . . 0.0 111.657 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -74.24 -31.52 62.62 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.12 -174.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.599 ' O ' HG12 ' A' ' 27' ' ' ILE . 31.4 tp -76.48 -41.95 45.3 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.434 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.3 t -61.54 -42.17 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 176.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 38.1 ttm -55.61 -44.65 77.24 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 175.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -67.12 -40.84 86.9 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.133 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.599 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.2 mm -56.74 -52.03 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.05 -40.88 99.03 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.683 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -65.22 -49.02 71.3 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.418 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -60.95 -42.5 98.36 Favored 'General case' 0 C--O 1.246 0.891 0 C-N-CA 124.643 1.177 . . . . 0.0 110.471 -176.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 41.2 pt -72.69 -38.99 59.77 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.96 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.542 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -61.94 -48.72 79.12 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 123.523 0.729 . . . . 0.0 112.022 -176.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.89 -27.0 64.44 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.996 0.427 . . . . 0.0 111.711 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -75.78 -43.4 46.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.286 0.565 . . . . 0.0 109.6 177.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 58.6 tp . . . . . 0 C--N 1.316 -0.888 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.885 -179.606 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.479 ' O ' HG12 ' A' ' 45' ' ' ILE . 6.7 tt . . . . . 0 N--CA 1.445 -0.69 0 CA-C-O 120.168 0.032 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.524 ' O ' HG13 ' A' ' 46' ' ' ILE . 60.4 pttt -56.49 -38.62 72.0 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-O 120.712 0.291 . . . . 0.0 111.142 176.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.0 m -69.55 -42.05 75.09 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.684 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.422 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 22.8 m -62.15 -38.19 88.06 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.496 176.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 41' ' ' ILE . 33.5 mm -56.55 -48.96 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.53 0.732 . . . . 0.0 110.055 176.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 42' ' ' LYS . 77.1 mt -52.89 -47.58 52.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.537 -177.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.422 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 23.9 m-85 -61.07 -53.36 58.1 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.661 0.744 . . . . 0.0 109.939 -175.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -64.77 -44.77 96.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-N 114.295 -1.321 . . . . 0.0 111.481 -174.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -63.41 -39.28 94.06 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.265 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.411 ' HA ' ' CD2' ' A' ' 53' ' ' LEU . 21.9 t -73.52 -21.82 60.28 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 120.677 0.275 . . . . 0.0 111.165 -179.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.1 t -94.1 -3.96 50.17 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.433 0.635 . . . . 0.0 110.333 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.53 ' O ' HG12 ' A' ' 56' ' ' ILE . 91.6 m-70 -140.48 37.47 1.86 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.411 ' CD2' ' HA ' ' A' ' 50' ' ' SER . 84.0 mt -47.62 -45.18 27.42 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -172.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -60.1 -48.94 79.62 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -172.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -67.38 -33.95 76.28 Favored 'General case' 0 C--O 1.245 0.819 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 52' ' ' HIS . 39.3 mm -63.94 -42.14 94.81 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.25 0 CA-C-N 115.19 -0.913 . . . . 0.0 108.969 178.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.493 ' HA ' ' NE ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -65.15 -50.05 67.51 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 123.351 0.661 . . . . 0.0 111.06 -177.386 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -57.75 -33.78 68.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.461 -178.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -127.3 46.52 2.51 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -175.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -53.45 -36.6 61.77 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.774 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -71.32 -42.04 69.09 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -62.18 -49.6 75.14 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.895 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.445 ' HA ' HG12 ' A' ' 66' ' ' ILE . 61.5 m-85 -67.7 -32.89 73.85 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -178.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -69.2 -47.41 64.91 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.142 -0.623 . . . . 0.0 109.966 174.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.8 mtm -59.18 -46.54 88.13 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.92 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.515 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 37.9 pt -66.71 -41.03 87.44 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.974 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.231 178.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.18 -41.63 93.3 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.102 0.477 . . . . 0.0 110.191 179.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -58.71 -55.99 27.94 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.002 177.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.5 mt -61.8 -40.62 87.6 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.838 0 C-N-CA 124.173 0.989 . . . . 0.0 112.301 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 89.7 mt -55.8 -46.02 78.12 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.556 0.343 . . . . 0.0 111.321 177.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.466 ' HG2' HG22 ' A' ' 41' ' ' ILE . 44.7 mt-30 -69.99 -51.67 30.59 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.934 0.873 . . . . 0.0 109.792 179.295 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.8 ttt85 -54.84 -43.82 73.39 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 125.709 1.604 . . . . 0.0 111.506 -179.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -95.92 -14.87 22.77 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 115.601 1.704 . . . . 0.0 115.601 -176.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.503 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -64.84 -31.45 72.69 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 174.058 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 71' ' ' GLN . 91.3 mttt -70.47 -46.25 64.13 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.05 177.203 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -76.66 -50.53 13.49 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -173.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.7 pt -121.23 -29.64 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -174.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.52 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 124.33 145.13 6.6 Favored Glycine 0 C--N 1.317 -0.488 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.8 tp -62.69 -39.26 84.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -175.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -62.83 -36.22 82.49 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-O 121.29 0.567 . . . . 0.0 111.808 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.566 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 16.3 m120 -65.54 -48.26 73.06 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.632 178.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.52 HG21 ' O ' ' A' ' 78' ' ' GLY . 19.5 t -64.42 -44.98 97.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.415 -177.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -50.82 -49.94 57.61 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.618 1.167 . . . . 0.0 110.137 179.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -43.31 79.48 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.604 -178.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 81.3 mt -64.85 -35.4 80.99 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.484 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.9 mm -64.97 -43.06 96.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.3 mt -62.0 -42.12 98.8 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.797 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.1 m -62.58 -32.16 73.1 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 123.911 0.885 . . . . 0.0 110.78 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.6 m -69.57 -43.95 71.82 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.279 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.7 pt . . . . . 0 C--N 1.317 -0.837 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.518 -179.346 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 C--O 1.241 0.614 0 CA-C-O 121.564 0.697 . . . . 0.0 110.025 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.2 m -138.6 179.89 6.21 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.1 tp -156.26 14.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 84.0 mt -97.87 -14.88 20.46 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 113.79 -1.55 . . . . 0.0 111.833 -168.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.37 -18.61 61.97 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -177.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -112.06 131.55 22.45 Favored Pre-proline 0 C--N 1.314 -0.973 0 C-N-CA 118.779 -1.169 . . . . 0.0 113.648 -174.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.09 -23.69 62.37 Favored 'Trans proline' 0 CA--C 1.548 1.218 0 C-N-CA 123.804 3.002 . . . . 0.0 115.274 175.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.433 ' OE1' ' HG2' ' A' ' 65' ' ' MET . 32.8 mm-40 -65.14 -34.57 78.72 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.382 0.992 . . . . 0.0 109.917 179.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -67.36 -42.78 82.9 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.753 -177.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.483 ' O ' ' HG3' ' A' ' 14' ' ' GLN . 11.5 p -65.02 -34.59 71.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.123 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.415 ' HZ3' ' CD ' ' A' ' 8' ' ' GLU . 56.8 mtmt -65.69 -38.03 88.12 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.914 178.077 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.53 -44.58 93.15 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.503 0.668 . . . . 0.0 109.614 174.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -39.09 90.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.672 178.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 10' ' ' VAL . 26.4 mt-30 -63.92 -41.14 97.74 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 122.73 0.412 . . . . 0.0 111.516 178.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -74.46 -13.98 60.77 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt 69.7 2.58 3.87 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.736 1.214 . . . . 0.0 111.473 177.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 95.43 -80.26 0.83 Allowed Glycine 0 N--CA 1.435 -1.378 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt 63.71 10.76 5.31 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.976 1.311 . . . . 0.0 113.11 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 34.3 m -100.62 169.69 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 C-N-CA 123.321 0.648 . . . . 0.0 110.773 -176.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -76.69 113.25 14.12 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -58.31 -34.8 70.97 Favored 'General case' 0 C--N 1.308 -1.239 0 O-C-N 123.557 0.536 . . . . 0.0 110.607 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -74.94 -37.8 61.9 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.809 -173.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.541 ' O ' HG12 ' A' ' 27' ' ' ILE . 19.3 tp -77.44 -40.81 42.09 Favored 'General case' 0 N--CA 1.423 -1.817 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.747 -177.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 86.1 t -65.13 -39.1 84.44 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 59.9 ttp -57.86 -37.11 73.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.711 176.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -75.86 -40.13 55.27 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.431 177.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.4 mm -56.99 -51.75 64.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.05 -41.54 98.23 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-N 115.047 -0.978 . . . . 0.0 110.247 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -63.31 -45.12 92.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.412 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -62.9 -44.96 94.68 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.847 -175.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.503 ' CD1' HD11 ' A' ' 70' ' ' LEU . 46.0 pt -70.31 -37.01 69.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 119.875 -0.73 . . . . 0.0 109.74 176.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.607 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 35.9 tt0 -62.19 -53.4 55.8 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 123.017 0.527 . . . . 0.0 111.223 -178.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.462 HD11 ' N ' ' A' ' 34' ' ' ASP . 4.1 pp -59.45 -33.69 71.59 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.462 ' N ' HD11 ' A' ' 33' ' ' LEU . 14.9 t70 -71.04 -47.89 55.94 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.3 tp -65.56 -23.78 66.94 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.429 0.692 . . . . 0.0 112.266 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 20.3 mtm180 -71.02 -33.12 70.05 Favored 'General case' 0 C--N 1.314 -0.946 0 O-C-N 121.725 -0.609 . . . . 0.0 110.625 176.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -91.15 -38.25 6.04 Favored Glycine 0 C--N 1.315 -0.632 0 C-N-CA 120.571 -0.824 . . . . 0.0 111.268 177.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.8 m -94.52 -170.35 2.23 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 123.324 0.65 . . . . 0.0 110.119 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -128.17 -7.63 5.37 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -113.3 106.09 14.19 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 120.59 -0.444 . . . . 0.0 109.961 -172.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.516 ' O ' HG12 ' A' ' 45' ' ' ILE . 14.4 tt -75.05 -27.63 20.09 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.892 -176.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.53 ' HG2' ' OE1' ' A' ' 71' ' ' GLN . 42.7 mtmt -59.36 -48.67 80.75 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 177.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.1 m -65.21 -38.74 91.4 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.589 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.8 m -58.81 -41.09 85.96 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 120.863 0.363 . . . . 0.0 110.405 175.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.516 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.5 mm -58.77 -46.31 90.84 Favored 'Isoleucine or valine' 0 C--N 1.343 0.314 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 176.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 42' ' ' LYS . 67.6 mt -51.76 -49.61 35.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.208 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -61.14 -53.72 53.5 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.408 0.623 . . . . 0.0 110.71 -176.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 51.7 t -66.79 -42.82 89.82 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.891 -172.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -70.95 -37.63 72.82 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.44 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.526 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 36.2 t -73.47 -31.41 63.76 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.567 0.699 . . . . 0.0 109.798 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.3 t -73.54 -43.83 59.0 Favored 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.509 ' O ' HG12 ' A' ' 56' ' ' ILE . 68.9 m-70 -103.34 37.42 2.0 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 -176.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 50' ' ' SER . 80.0 mt -47.11 -41.66 17.7 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -57.46 -46.65 83.4 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.522 ' HA ' ' OE1' ' A' ' 55' ' ' GLU . 2.2 tp10 -74.58 -34.31 62.86 Favored 'General case' 0 N--CA 1.432 -1.325 0 C-N-CA 119.626 -0.83 . . . . 0.0 111.312 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 52' ' ' HIS . 47.1 mm -61.26 -45.28 98.92 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.174 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -71.76 -22.97 61.53 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.79 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.448 ' HB2' ' NZ ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -68.53 -52.72 28.95 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.628 ' HB2' ' CE2' ' A' ' 63' ' ' TYR . 16.9 m120 -112.53 52.66 0.77 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.8 pttp -60.7 -31.55 70.82 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -66.44 -47.53 72.86 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 121.457 0.646 . . . . 0.0 109.396 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.402 ' O ' HG12 ' A' ' 66' ' ' ILE . 93.1 t80 -63.12 -51.5 66.27 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 114.412 -1.267 . . . . 0.0 110.714 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.628 ' CE2' ' HB2' ' A' ' 59' ' ' ASN . 79.0 m-85 -68.99 -26.44 65.02 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -176.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -71.23 -50.72 30.0 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.146 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.433 ' HG2' ' OE1' ' A' ' 8' ' ' GLU . 73.6 mtm -66.0 -43.27 88.2 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.54 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.542 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 46.2 pt -65.93 -41.71 90.44 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.634 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.195 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.26 -39.0 71.9 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 117.893 0.315 . . . . 0.0 110.909 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -64.33 -56.6 13.33 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 177.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 95.2 mt -56.63 -44.33 80.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.446 1.099 . . . . 0.0 112.514 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.55 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 82.5 mt -54.57 -50.45 67.95 Favored 'General case' 0 C--O 1.212 -0.876 0 C-N-CA 123.531 0.732 . . . . 0.0 111.826 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.53 ' OE1' ' HG2' ' A' ' 42' ' ' LYS . 46.3 mt-30 -70.16 -45.67 66.27 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 121.984 0.897 . . . . 0.0 109.917 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 46.4 ttt85 -57.91 -45.41 86.54 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 126.62 1.968 . . . . 0.0 111.319 -176.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -94.48 -16.54 23.26 Favored 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.55 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.23 -33.91 77.12 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.054 178.601 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -68.12 -25.61 65.38 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.384 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -99.38 -47.61 5.09 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.9 pt -115.88 -20.79 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -177.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.544 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 111.15 142.43 9.01 Favored Glycine 0 CA--C 1.501 -0.795 0 N-CA-C 110.999 -0.841 . . . . 0.0 110.999 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tp -62.45 -37.43 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 117.203 0.502 . . . . 0.0 111.559 -174.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -53.19 -48.09 68.34 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.858 0.837 . . . . 0.0 109.455 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.424 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 85.4 m-20 -68.0 -42.97 79.91 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 113.787 -1.551 . . . . 0.0 112.204 -178.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.544 HG21 ' O ' ' A' ' 78' ' ' GLY . 16.8 t -65.49 -45.8 91.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.3 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -56.64 -42.81 79.52 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.435 0.636 . . . . 0.0 111.075 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -45.7 86.84 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.9 mt -63.09 -36.28 83.06 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.632 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.6 mm -64.44 -41.08 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.7 mt -62.41 -38.74 90.84 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-O 121.363 0.601 . . . . 0.0 110.558 176.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.4 m -64.91 -33.44 76.02 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.473 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 29.5 m -72.1 -31.7 66.3 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.488 0.715 . . . . 0.0 111.479 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.6 pt -92.71 -9.11 10.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.621 -178.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -99.57 128.71 45.68 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.7 mp -78.68 144.66 35.12 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 106.004 -1.85 . . . . 0.0 106.004 167.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . 0.266 8.3 tm-20 -46.73 -80.5 0.01 OUTLIER 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -172.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 61.6 m80 -143.57 1.42 1.18 Allowed 'General case' 0 N--CA 1.483 1.188 0 O-C-N 120.914 -1.116 . . . . 0.0 111.728 177.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -96.92 95.15 7.64 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 34.9 m-70 -123.21 -63.59 1.24 Allowed 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.507 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 12.7 p-80 -67.68 -29.07 68.26 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.639 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 27.8 t60 -121.56 87.86 2.83 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 172.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 . . . . . 0 C--N 1.29 -2.002 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 -178.465 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 CA--C 1.513 -0.459 0 CA-C-O 120.926 0.393 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.4 m -113.78 139.47 49.1 Favored 'General case' 0 N--CA 1.423 -1.817 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.5 tt -92.77 -2.72 10.7 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-O 122.487 1.137 . . . . 0.0 108.964 177.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 86.4 mt -72.56 9.93 0.95 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 114.784 -1.098 . . . . 0.0 112.363 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.417 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 34.1 mt-10 -77.44 -21.18 53.37 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 178.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.431 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 14.3 t70 -87.36 135.45 34.54 Favored Pre-proline 0 C--N 1.313 -1.01 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.03 -173.353 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.438 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 13.9 Cg_exo -70.82 -31.53 15.65 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.665 2.243 . . . . 0.0 113.088 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.67 -35.95 57.61 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -61.32 -42.72 99.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.434 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.73 -34.26 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 CA-C-O 121.055 0.455 . . . . 0.0 109.988 178.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.438 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 63.5 mttp -63.08 -37.02 85.54 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 174.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.5 mt -63.31 -37.33 86.82 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.115 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.447 HH11 ' HA ' ' A' ' 89' ' ' THR . 24.9 tpt180 -67.5 -35.25 78.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.362 0.601 . . . . 0.0 109.76 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -73.65 -31.01 63.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.084 178.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -74.77 -33.31 62.27 Favored 'General case' 0 C--O 1.251 1.183 0 C-N-CA 123.762 0.825 . . . . 0.0 109.004 177.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.538 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 86.9 tttt 72.97 -67.61 0.26 Allowed 'General case' 0 C--O 1.208 -1.083 0 C-N-CA 126.727 2.011 . . . . 0.0 111.617 178.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 156.6 104.92 0.22 Allowed Glycine 0 N--CA 1.427 -1.937 0 C-N-CA 120.628 -0.796 . . . . 0.0 111.654 -178.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -112.05 21.7 15.62 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 123.103 1.43 . . . . 0.0 107.743 179.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 30.1 m -110.3 164.37 6.54 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 CA-C-N 112.868 -1.969 . . . . 0.0 109.444 -176.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -81.16 119.63 23.83 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 174.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.403 ' CE1' HD23 ' A' ' 87' ' ' LEU . 86.2 t80 -53.25 -47.89 68.68 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.683 0.615 . . . . 0.0 111.692 -179.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -59.15 -36.01 74.51 Favored 'General case' 0 CA--C 1.497 -1.09 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.173 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.586 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.2 tp -76.51 -42.62 42.68 Favored 'General case' 0 N--CA 1.419 -2.006 0 C-N-CA 119.441 -0.904 . . . . 0.0 111.248 -178.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.598 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 65.0 t -59.22 -44.71 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 118.205 0.457 . . . . 0.0 109.874 177.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 52.1 ttp -58.76 -38.03 77.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.991 177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -72.69 -38.59 67.52 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.123 176.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.1 mm -57.25 -49.61 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 66.8 mt -63.96 -35.23 79.99 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.743 -1.117 . . . . 0.0 110.496 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.73 -44.64 63.77 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 124.139 0.976 . . . . 0.0 110.092 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.563 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 17.3 tt0 -69.7 -39.5 76.88 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.759 -177.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 41.7 pt -68.34 -37.05 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 119.832 -0.747 . . . . 0.0 109.185 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -58.73 -46.28 87.75 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.589 0.555 . . . . 0.0 111.086 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 30' ' ' GLU . 4.4 pp -63.88 -32.85 74.52 Favored 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -177.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.53 -48.74 18.41 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.364 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 51.8 tp -56.86 -38.63 72.97 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.748 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.5 ttp180 -63.46 97.83 0.15 Allowed 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 175.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.23 -20.07 3.59 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.254 -176.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.7 p -147.11 -159.43 1.02 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -132.98 12.69 4.31 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 173.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -90.8 63.02 5.2 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.233 -173.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.542 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.8 tt -61.71 -31.2 50.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.333 -178.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -63.21 -34.36 77.48 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.925 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.9 m -79.24 -33.86 43.22 Favored 'General case' 0 N--CA 1.419 -2.007 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 15.3 m -59.59 -41.26 89.89 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.571 176.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.542 HG12 ' O ' ' A' ' 41' ' ' ILE . 43.1 mm -53.76 -48.87 60.57 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.853 176.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 69.6 mt -53.5 -49.12 56.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.228 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.63 -53.01 58.15 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.124 0.487 . . . . 0.0 110.417 -176.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.3 t -60.29 -46.03 95.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.449 -174.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -65.7 -37.54 86.74 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.06 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.0 m -72.85 -22.16 60.83 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.116 0.484 . . . . 0.0 111.092 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.1 t -90.09 -9.99 46.38 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.686 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.447 ' O ' HG12 ' A' ' 56' ' ' ILE . 87.2 m-70 -138.46 36.33 2.26 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 -178.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.413 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 80.9 mt -47.64 -38.62 15.15 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -174.107 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -53.79 -50.26 66.48 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.256 0.622 . . . . 0.0 112.275 -175.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.453 ' OE2' ' HD3' ' A' ' 58' ' ' LYS . 9.2 tp10 -73.69 -35.41 65.16 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.286 0.565 . . . . 0.0 109.654 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.5 mm -60.12 -50.0 81.9 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.301 -176.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.413 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 13.6 ptt180 -77.6 -24.73 49.6 Favored 'General case' 0 C--N 1.312 -1.041 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.533 -178.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.453 ' HD3' ' OE2' ' A' ' 55' ' ' GLU . 62.7 tttt -60.1 -43.28 95.66 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 123.204 0.601 . . . . 0.0 109.457 177.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -126.32 57.24 1.41 Allowed 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.898 178.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -60.77 -28.54 68.81 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.341 -175.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -61.52 -53.25 58.87 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.39 -50.6 73.33 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.08 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.447 ' HA ' HG12 ' A' ' 66' ' ' ILE . 71.2 m-85 -68.94 -30.4 68.84 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -176.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -75.03 -37.97 61.61 Favored 'General case' 0 C--O 1.248 1.0 0 C-N-CA 119.506 -0.877 . . . . 0.0 109.101 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.6 mtm -69.49 -48.08 61.8 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.142 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.5 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.6 pt -64.11 -38.84 83.49 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.713 0 C-N-CA 119.404 -0.919 . . . . 0.0 111.573 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.533 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.28 -39.74 67.21 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.884 0.373 . . . . 0.0 110.978 178.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.1 -55.69 11.57 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.377 178.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.4 mt -58.12 -41.3 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.805 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.612 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 94.5 mt -56.44 -47.93 78.08 Favored 'General case' 0 C--O 1.213 -0.837 0 C-N-CA 122.633 0.373 . . . . 0.0 111.11 179.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.0 mt-30 -65.08 -50.01 67.81 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.726 0.774 . . . . 0.0 109.714 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -57.9 -52.95 63.39 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-N 114.009 -1.45 . . . . 0.0 112.076 -177.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.431 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 29.5 m-85 -83.41 -19.88 35.18 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.612 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.36 -34.41 77.24 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.509 -0.876 . . . . 0.0 109.708 175.714 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.491 ' HG3' ' CE2' ' A' ' 74' ' ' TYR . 55.2 mttp -81.62 -16.76 50.46 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 174.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -86.84 -51.33 6.13 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.564 177.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.8 pt -121.23 -30.5 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.527 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 128.65 138.83 4.61 Favored Glycine 0 C--N 1.314 -0.676 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.237 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.5 tp -58.39 -39.34 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 122.968 0.507 . . . . 0.0 112.112 -174.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -57.9 -43.99 86.5 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.581 0.705 . . . . 0.0 110.609 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.432 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 40.4 m-80 -67.26 -46.83 72.52 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.34 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.527 HG21 ' O ' ' A' ' 78' ' ' GLY . 23.5 t -61.96 -47.69 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.129 -176.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -56.86 -42.06 79.06 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 123.58 0.55 . . . . 0.0 111.339 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -47.7 79.48 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 179.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 88.3 mt -62.74 -29.6 70.8 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.8 mm -64.82 -42.28 94.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.403 HD23 ' CE1' ' A' ' 21' ' ' PHE . 85.4 mt -64.01 -38.67 91.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.936 178.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.1 m -61.53 -33.92 74.64 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.146 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.447 ' HA ' HH11 ' A' ' 13' ' ' ARG . 23.0 m -73.61 -40.17 64.03 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 120.592 0.235 . . . . 0.0 111.425 -178.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.538 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 42.3 pt -85.68 -42.5 16.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -99.42 -39.56 8.31 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -172.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.5 tt -84.0 120.9 26.67 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.334 1.064 . . . . 0.0 112.181 -172.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.429 ' HG3' ' H ' ' A' ' 95' ' ' HIS . 14.5 pt-20 -149.18 -145.01 0.16 Allowed 'General case' 0 C--N 1.287 -2.115 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 177.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -99.62 22.15 11.29 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 119.763 1.165 . . . . 0.0 109.989 176.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.429 ' H ' ' HG3' ' A' ' 93' ' ' GLU . 0.1 OUTLIER -66.92 -54.91 17.41 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.86 -175.589 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 37.3 p-80 -93.42 97.29 10.46 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 174.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -72.45 -14.6 61.72 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 114.064 -1.425 . . . . 0.0 110.642 -171.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -146.06 179.97 7.12 Favored 'General case' 0 C--N 1.313 -1.022 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 178.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.0 m80 . . . . . 0 C--N 1.301 -1.536 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 174.544 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.502 -0.883 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.4 m -112.42 151.88 29.32 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-O 120.943 0.402 . . . . 0.0 110.116 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.7 tt -111.31 -9.88 11.82 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 CA-C-O 121.807 0.813 . . . . 0.0 108.955 175.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 74.7 mt -69.04 -0.89 6.34 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.178 173.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -76.72 -11.78 59.89 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.633 175.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.424 ' OD2' ' HD2' ' A' ' 72' ' ' ARG . 12.1 t70 -90.54 126.8 55.04 Favored Pre-proline 0 C--O 1.245 0.838 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.761 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -68.19 -30.66 30.87 Favored 'Trans proline' 0 C--O 1.24 0.593 0 C-N-CA 122.707 2.271 . . . . 0.0 113.466 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -76.11 -38.17 57.19 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -59.29 -43.57 92.57 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.151 -1.386 . . . . 0.0 111.366 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.6 p -65.38 -34.96 73.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.606 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HE3' ' SD ' ' A' ' 65' ' ' MET . 56.6 mtmt -66.8 -36.45 82.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.744 176.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.8 -39.54 94.57 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -57.95 -37.79 74.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.318 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -80.09 -24.45 40.59 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.779 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.3 m-30 -80.56 -35.73 33.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.583 0.23 . . . . 0.0 110.878 177.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.0 mttt 71.67 -0.03 3.32 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.916 1.287 . . . . 0.0 113.997 175.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 132.67 -85.27 0.29 Allowed Glycine 0 N--CA 1.437 -1.283 0 C-N-CA 120.01 -1.09 . . . . 0.0 114.556 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.4 11.09 7.99 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.749 1.62 . . . . 0.0 110.219 -171.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 27.6 m -131.11 168.83 22.92 Favored 'Isoleucine or valine' 0 C--O 1.252 1.223 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.003 -171.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -91.68 129.93 37.57 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -51.99 -41.41 62.16 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 124.034 0.934 . . . . 0.0 111.195 177.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -67.7 -37.46 82.32 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.532 -175.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.516 ' O ' HG12 ' A' ' 27' ' ' ILE . 15.9 tp -77.19 -35.93 55.38 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.119 -176.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.414 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 88.6 t -68.88 -42.57 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 56.1 ttp -60.91 -33.61 73.4 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.931 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -70.63 -42.93 70.24 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 123.085 0.24 . . . . 0.0 110.747 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.516 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.83 -49.07 80.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.6 mt -63.76 -40.09 95.87 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.713 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -67.41 -47.39 70.39 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.148 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -62.01 -38.96 90.6 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.704 -176.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.456 ' CD1' HD13 ' A' ' 70' ' ' LEU . 35.0 pt -73.06 -38.25 55.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.705 176.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -58.22 -52.85 63.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 124.124 0.97 . . . . 0.0 111.029 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -63.52 -30.07 71.25 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.179 -178.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.7 -49.51 18.09 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.391 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.4 tp -67.31 -58.24 5.16 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.356 -175.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 63.54 -74.47 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.956 1.302 . . . . 0.0 110.463 -174.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -158.62 28.91 0.43 Allowed Glycine 0 N--CA 1.431 -1.671 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.5 t -83.67 -175.84 6.01 Favored 'General case' 0 C--O 1.249 1.058 0 CA-C-O 121.062 0.458 . . . . 0.0 110.201 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -100.1 -24.41 14.6 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -173.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -101.95 80.62 2.02 Favored 'General case' 0 CA--C 1.502 -0.894 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.699 -175.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.502 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.5 tt -76.83 -28.08 16.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.479 ' O ' HG13 ' A' ' 46' ' ' ILE . 63.7 pttt -61.21 -36.03 78.82 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.159 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.4 m -74.01 -35.29 64.39 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.783 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.411 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 16.7 m -63.17 -39.63 95.2 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 175.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.502 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.7 mm -57.07 -46.36 84.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.698 176.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 42' ' ' LYS . 69.7 mt -53.22 -47.01 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.871 -178.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.411 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 14.4 m-85 -62.35 -52.15 64.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.555 0.693 . . . . 0.0 110.233 -177.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.0 t -66.19 -42.64 91.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.904 -173.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -67.94 -34.58 76.86 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.215 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.9 m -76.36 -24.24 54.17 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.323 0.582 . . . . 0.0 111.058 178.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.3 t -79.67 -29.31 40.82 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.037 0.446 . . . . 0.0 110.488 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.468 ' O ' HG12 ' A' ' 56' ' ' ILE . 67.4 m-70 -120.76 37.64 4.24 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -175.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.47 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 87.5 mt -47.02 -51.7 16.69 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 -175.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 3.8 p30 -59.68 -33.02 71.04 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -73.89 -46.3 45.41 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 121.193 0.52 . . . . 0.0 110.041 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.468 HG12 ' O ' ' A' ' 52' ' ' HIS . 47.3 mm -56.27 -40.96 68.91 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.15 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.627 179.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.47 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 82.8 mtp180 -63.38 -38.73 92.3 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 177.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 50.5 mttp -63.15 -48.37 78.74 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.861 0.838 . . . . 0.0 110.532 -176.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -123.43 51.72 1.46 Allowed 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.918 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -59.7 -19.62 50.98 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.955 -1.021 . . . . 0.0 111.986 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -61.01 -57.81 11.05 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.374 1.083 . . . . 0.0 108.094 174.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -65.87 -51.25 60.38 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.194 -1.821 . . . . 0.0 109.969 -176.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.419 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.7 m-85 -66.99 -25.95 66.57 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -175.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -83.68 -39.43 20.21 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 118.728 -1.189 . . . . 0.0 109.896 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.472 ' O ' HG13 ' A' ' 69' ' ' ILE . 73.3 mtm -64.11 -44.27 92.77 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.476 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.475 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.6 pt -62.74 -38.59 82.1 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.302 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.938 178.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.43 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -52.68 -45.5 66.84 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.399 0.437 . . . . 0.0 111.797 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -74.5 -36.33 63.22 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 119.922 -0.711 . . . . 0.0 112.139 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 65' ' ' MET . 80.4 mt -63.99 -46.23 94.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-O 120.627 0.251 . . . . 0.0 110.347 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 79.6 mt -54.07 -45.33 71.69 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 123.461 0.704 . . . . 0.0 110.987 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 48.5 mt-30 -66.65 -49.38 66.38 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.574 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.424 ' HD2' ' OD2' ' A' ' 6' ' ' ASP . 41.4 ttm180 -61.31 -45.22 95.33 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 124.48 1.112 . . . . 0.0 111.74 -177.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -88.93 -18.09 28.19 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -176.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.534 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.49 -29.4 68.82 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 173.094 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -71.9 -31.58 66.55 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.871 175.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -86.44 -52.08 5.81 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -177.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.1 pt -121.25 -27.22 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -172.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.59 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 121.85 146.66 7.4 Favored Glycine 0 CA--C 1.496 -1.124 0 C-N-CA 119.513 -1.327 . . . . 0.0 111.804 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.1 tp -61.8 -40.14 85.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -56.16 -46.35 79.34 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-O 121.825 0.821 . . . . 0.0 110.137 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.417 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 91.4 m-20 -65.03 -44.16 90.01 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 114.051 -1.431 . . . . 0.0 111.623 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.59 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.9 t -65.45 -42.79 94.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.467 -177.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -57.33 -44.97 84.71 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.264 0.554 . . . . 0.0 110.655 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.75 -43.06 94.56 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 86.7 mt -65.95 -37.34 85.78 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.1 mm -63.87 -41.06 91.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 176.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.2 mt -62.98 -39.45 94.76 Favored 'General case' 0 C--O 1.21 -1.01 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.515 175.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 50.0 m -63.82 -33.31 75.4 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.65 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 41.2 m -70.49 -37.71 74.24 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.336 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.5 pt -88.61 -29.22 5.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 C-N-CA 119.884 -0.726 . . . . 0.0 111.597 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 46.0 tptt -93.01 85.33 5.08 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-O 121.982 0.896 . . . . 0.0 110.378 -177.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 73.0 mt -101.78 165.16 11.35 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.34 -178.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.11 104.91 17.25 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -70.89 -22.91 62.21 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.132 -170.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -82.93 -22.91 33.7 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 21.2 m80 61.66 50.76 4.26 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 114.886 -1.052 . . . . 0.0 112.795 -178.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -77.4 -18.71 57.05 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 172.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 31.8 p-80 -147.72 147.58 30.08 Favored 'General case' 0 N--CA 1.432 -1.331 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 172.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 63.4 t-80 . . . . . 0 C--N 1.29 -2.009 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.933 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.508 -0.667 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m -119.12 136.78 53.99 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.019 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.465 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 19.7 tt -129.08 -14.66 2.41 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-O 121.486 0.66 . . . . 0.0 110.442 177.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.9 mt -74.98 6.11 4.46 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.468 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.14 -21.3 59.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -89.36 123.8 66.05 Favored Pre-proline 0 N--CA 1.44 -0.97 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.652 -174.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -69.84 -29.12 23.97 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.547 2.164 . . . . 0.0 113.131 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.459 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 20.0 mm-40 -75.38 -31.34 60.43 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -178.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -62.73 -40.75 98.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.902 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -71.28 -34.35 53.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.05 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -61.75 -36.07 79.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.037 173.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 95.5 mt -60.69 -35.84 77.29 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.602 176.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 mmt85 -65.04 -29.36 70.25 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.163 0.506 . . . . 0.0 110.318 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -76.25 -36.62 58.41 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.515 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -79.0 -35.73 42.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.692 0.282 . . . . 0.0 111.43 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.518 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 48.5 mmtt 74.34 -82.83 0.03 OUTLIER 'General case' 0 C--O 1.206 -1.225 0 C-N-CA 124.766 1.227 . . . . 0.0 110.645 -171.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.5 -74.33 0.02 OUTLIER Glycine 0 N--CA 1.427 -1.922 0 C-N-CA 118.931 -1.604 . . . . 0.0 113.036 -178.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp 68.12 6.11 5.04 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.54 1.136 . . . . 0.0 111.235 -175.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.6 m -125.09 167.73 18.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.307 0 C-N-CA 125.206 1.403 . . . . 0.0 107.981 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -74.72 121.81 22.28 Favored 'General case' 0 CA--C 1.499 -0.995 0 C-N-CA 119.881 -0.728 . . . . 0.0 109.522 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -55.48 -41.54 73.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -56.68 -42.13 78.52 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.79 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.589 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.6 tp -75.64 -43.1 49.51 Favored 'General case' 0 N--CA 1.417 -2.119 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.658 -175.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.479 HG22 ' HH ' ' A' ' 63' ' ' TYR . 61.0 t -63.82 -38.97 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.2 ttp -59.81 -35.04 73.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.989 176.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -75.83 -41.7 51.85 Favored 'General case' 0 C--O 1.197 -1.667 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.449 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.5 mm -55.97 -51.2 63.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 121.456 0.646 . . . . 0.0 109.73 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 76.2 mt -64.69 -34.14 77.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.878 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -72.45 -44.87 61.76 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 122.024 0.916 . . . . 0.0 109.979 -179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -65.62 -37.84 87.73 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.893 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.7 pt -72.07 -37.87 61.6 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.852 176.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.435 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 37.8 tt0 -61.5 -52.53 64.13 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 124.165 0.986 . . . . 0.0 110.908 -178.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.19 -30.9 71.95 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 116.322 -0.399 . . . . 0.0 112.06 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -75.43 -46.54 32.12 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.971 0.415 . . . . 0.0 110.231 178.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.481 HD21 ' CE1' ' A' ' 74' ' ' TYR . 58.7 tp -63.11 -23.5 67.47 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.889 -178.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.435 ' HG2' ' O ' ' A' ' 32' ' ' GLU . 27.0 mmm180 -66.12 97.99 0.42 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-O 121.711 0.767 . . . . 0.0 109.016 174.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 152.96 -96.77 0.17 Allowed Glycine 0 N--CA 1.401 -3.698 0 N-CA-C 108.503 -1.839 . . . . 0.0 108.503 -174.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 36.3 p 169.24 107.99 0.01 OUTLIER 'General case' 0 C--O 1.239 0.548 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -174.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -168.55 -79.53 0.02 OUTLIER 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 167.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -177.97 143.8 0.33 Allowed 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.574 ' O ' HG12 ' A' ' 45' ' ' ILE . 14.8 tt -65.57 -29.66 47.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.073 0 O-C-N 123.157 0.286 . . . . 0.0 110.454 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.485 ' O ' HG13 ' A' ' 46' ' ' ILE . 49.7 mtpt -55.31 -50.09 70.49 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-O 121.688 0.756 . . . . 0.0 110.008 174.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.0 m -59.05 -47.12 86.39 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 113.707 -1.588 . . . . 0.0 110.279 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 23.1 m -58.34 -39.55 79.77 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 123.771 0.669 . . . . 0.0 111.077 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.574 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.3 mm -58.2 -42.54 83.66 Favored 'Isoleucine or valine' 0 C--N 1.344 0.326 0 C-N-CA 123.145 0.578 . . . . 0.0 109.812 176.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 42' ' ' LYS . 63.9 mt -59.36 -47.45 90.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.59 -175.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -61.79 -50.79 70.92 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 121.671 0.748 . . . . 0.0 109.462 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.52 -47.22 93.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.573 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -64.99 -39.57 93.66 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.837 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.9 m -70.17 -27.57 64.64 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.135 0.493 . . . . 0.0 111.457 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -82.34 -32.11 29.52 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.306 0.574 . . . . 0.0 110.42 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.534 ' O ' HG12 ' A' ' 56' ' ' ILE . 90.0 m-70 -114.97 35.52 4.28 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.447 -174.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.6 mt -47.35 -39.0 14.01 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.65 1.18 . . . . 0.0 113.734 -177.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.515 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 12.3 t70 -54.17 -50.85 66.07 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -73.79 -38.08 64.75 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.624 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.534 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.8 mm -56.5 -52.14 56.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.668 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.949 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.06 -36.8 82.84 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -176.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 33.4 mtmm -71.78 -24.79 61.81 Favored 'General case' 0 CA--C 1.51 -0.572 0 C-N-CA 119.921 -0.712 . . . . 0.0 111.277 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -130.24 49.71 2.26 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -178.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.54 -31.07 65.73 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.58 -1.191 . . . . 0.0 112.773 -177.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.67 -50.23 67.84 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -59.84 -50.77 72.48 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.501 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.479 ' HH ' HG22 ' A' ' 24' ' ' VAL . 69.6 m-85 -69.7 -25.6 63.95 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -177.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -75.73 -44.63 40.91 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 176.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.1 mtm -61.13 -50.83 71.61 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.33 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.58 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.6 pt -64.43 -38.73 83.34 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.746 0 C-N-CA 119.47 -0.892 . . . . 0.0 111.801 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -59.31 -41.02 88.04 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 117.927 0.331 . . . . 0.0 110.642 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.28 -55.32 29.47 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 89.8 mt -58.03 -42.4 82.71 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 CA-C-N 115.212 -0.903 . . . . 0.0 111.929 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.4 mt -54.55 -47.87 72.69 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 122.812 0.445 . . . . 0.0 111.284 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 64.5 mt-30 -69.73 -47.95 61.24 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.74 0.781 . . . . 0.0 109.557 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -59.47 -43.06 93.31 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 113.989 -1.459 . . . . 0.0 110.782 -176.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.465 ' CE2' ' HA ' ' A' ' 3' ' ' ILE . 40.0 m-85 -93.68 -15.5 25.22 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -177.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.488 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.75 -29.71 69.0 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 174.291 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -77.61 -28.33 51.49 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.75 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -87.1 -51.64 5.88 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.256 -0.577 . . . . 0.0 111.486 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.3 pt -119.52 -26.71 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -173.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.527 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 117.04 148.17 8.77 Favored Glycine 0 C--N 1.307 -1.057 0 C-N-CA 120.298 -0.953 . . . . 0.0 110.996 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.8 tp -64.87 -37.87 81.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 117.029 0.414 . . . . 0.0 111.999 -174.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -55.92 -42.84 76.7 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 122.125 0.965 . . . . 0.0 110.148 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.47 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 48.6 m-80 -67.05 -50.06 63.15 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.145 -1.388 . . . . 0.0 111.324 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.527 HG21 ' O ' ' A' ' 78' ' ' GLY . 17.3 t -61.67 -39.55 83.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -177.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -51.05 -50.39 58.74 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.868 1.267 . . . . 0.0 110.129 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.11 -40.58 71.4 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.062 -177.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.7 mt -64.9 -34.8 79.25 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.125 -178.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.426 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.8 mm -68.38 -41.96 83.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.5 mt -62.11 -40.73 96.88 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.137 0.494 . . . . 0.0 110.889 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 48.9 m -63.96 -33.38 75.6 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.786 177.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.4 m -74.19 -48.26 30.24 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.989 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.518 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 39.4 pt -74.02 -32.51 33.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -176.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.46 ' HG3' ' H ' ' A' ' 92' ' ' LEU . 20.7 tptp -104.75 -147.9 0.4 Allowed 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.46 ' H ' ' HG3' ' A' ' 91' ' ' LYS . 18.9 tp 58.76 69.32 0.74 Allowed 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.042 0.937 . . . . 0.0 110.218 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -96.21 124.35 40.18 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.805 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -137.19 165.07 26.98 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.817 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 75.8 m-70 69.17 -170.21 0.18 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.515 1.126 . . . . 0.0 108.207 -176.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 -70.77 -61.38 1.79 Allowed 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 119.319 -0.952 . . . . 0.0 108.79 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 53.3 t60 34.09 62.58 0.45 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 126.361 1.864 . . . . 0.0 113.479 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -156.57 138.53 14.42 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.217 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 . . . . . 0 C--N 1.31 -1.151 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 175.525 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.357 0 CA-C-O 120.942 0.401 . . . . 0.0 110.515 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.5 m -168.36 149.34 4.9 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 178.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.5 pt -76.08 81.9 0.65 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.412 0 CA-C-O 122.265 1.031 . . . . 0.0 111.253 176.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.9 mt -87.4 11.99 13.2 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 114.792 -1.094 . . . . 0.0 110.997 -176.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -71.41 -11.45 60.89 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.2 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.535 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 15.0 t70 -111.59 130.95 22.6 Favored Pre-proline 0 N--CA 1.448 -0.562 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.745 -176.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.522 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 17.3 Cg_exo -69.76 -28.26 25.48 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.947 2.432 . . . . 0.0 113.9 177.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -75.16 -33.27 61.48 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -60.17 -44.57 94.92 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.484 -1.234 . . . . 0.0 110.552 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -66.78 -34.09 67.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.235 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.2 mttt -62.77 -37.2 85.7 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.38 -38.17 88.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.151 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.6 mtp180 -72.4 -25.43 61.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.31 0.576 . . . . 0.0 110.339 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -80.51 -20.73 42.91 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.212 174.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -83.81 -49.02 9.46 Favored 'General case' 0 C--O 1.246 0.907 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.428 ' HZ3' ' C ' ' A' ' 99' ' ' HIS . 91.3 mttt 72.44 -171.52 0.14 Allowed 'General case' 0 C--O 1.242 0.698 0 C-N-CA 125.35 1.46 . . . . 0.0 113.274 175.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.4 77.8 1.68 Allowed Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 114.718 0.647 . . . . 0.0 114.718 -171.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -97.23 5.95 49.22 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 122.706 1.241 . . . . 0.0 108.333 172.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 29.7 m -117.4 158.32 18.12 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 CA-C-N 113.275 -1.784 . . . . 0.0 107.939 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -74.92 121.85 22.54 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.316 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -53.43 -50.62 64.83 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.681 0.613 . . . . 0.0 111.658 -178.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -64.61 -29.54 70.55 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.359 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.604 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.2 tp -75.93 -39.6 55.85 Favored 'General case' 0 N--CA 1.425 -1.703 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.054 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 62.8 t -63.36 -43.21 98.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 175.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 60.7 ttp -57.94 -39.34 77.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.667 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.72 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 58.9 tt0 -67.63 -45.42 75.44 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.736 176.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.604 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.6 mm -55.93 -44.8 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 CA-C-O 121.403 0.621 . . . . 0.0 110.047 -179.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 68.5 mt -68.65 -33.87 74.74 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.7 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -71.63 -43.6 65.87 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.197 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.72 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.7 mm-40 -53.66 -53.99 44.19 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.664 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 31.7 pt -67.59 -34.28 67.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.37 -177.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -63.23 -51.46 66.17 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.317 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.4 pp -72.19 -30.29 64.81 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.462 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.42 ' N ' HD12 ' A' ' 33' ' ' LEU . 15.6 t70 -75.11 -45.43 41.18 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.245 -178.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.2 tt -69.45 -61.52 1.75 Allowed 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -176.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 55.04 -85.65 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.909 0 O-C-N 123.727 0.642 . . . . 0.0 109.398 -170.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -155.31 32.3 0.65 Allowed Glycine 0 N--CA 1.433 -1.531 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 174.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 51.0 p -87.03 -87.25 0.14 Allowed 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -175.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -101.42 -72.93 0.67 Allowed 'General case' 0 CA--C 1.512 -0.492 0 C-N-CA 119.946 -0.701 . . . . 0.0 112.643 -174.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.568 ' OD1' ' HG2' ' A' ' 42' ' ' LYS . 7.8 t-20 -170.29 157.59 6.28 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.442 ' O ' HG12 ' A' ' 45' ' ' ILE . 13.9 tt -68.13 -37.7 78.58 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.425 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.568 ' HG2' ' OD1' ' A' ' 40' ' ' ASN . 11.2 ptmm? -65.52 -32.33 73.87 Favored 'General case' 0 CA--C 1.509 -0.624 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.535 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.4 m -66.3 -44.61 82.99 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.065 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.422 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 48.4 m -63.68 -38.36 90.83 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.339 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 41' ' ' ILE . 25.7 mm -54.68 -43.57 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.55 0.74 . . . . 0.0 110.077 175.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.553 HG13 ' O ' ' A' ' 42' ' ' LYS . 74.6 mt -54.6 -50.26 60.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.597 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.422 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 20.2 m-85 -62.88 -53.1 59.34 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.511 0.672 . . . . 0.0 110.321 -177.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.417 HG21 ' O ' ' A' ' 44' ' ' SER . 60.2 t -58.78 -44.94 91.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.667 -176.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -71.21 -27.37 63.45 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.9 m -80.95 -25.48 37.36 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.372 0.606 . . . . 0.0 110.372 176.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.1 t -78.07 -52.94 7.98 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.489 177.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.56 ' O ' HG12 ' A' ' 56' ' ' ILE . 86.0 m-70 -98.46 48.53 0.99 Allowed 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.316 -172.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 98.2 mt -48.59 -48.04 39.34 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -175.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.412 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 3.1 t70 -54.11 -52.04 62.26 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -174.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.437 ' CG ' ' HH ' ' A' ' 63' ' ' TYR . 5.0 tp10 -72.59 -32.18 65.78 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.759 -0.776 . . . . 0.0 110.031 -176.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.56 HG12 ' O ' ' A' ' 52' ' ' HIS . 44.7 mm -63.57 -49.74 81.18 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.033 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.101 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.3 ptt-85 -69.76 -29.81 67.24 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -175.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 54' ' ' ASP . 32.5 mmtp -70.98 -34.05 71.03 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.012 0.434 . . . . 0.0 110.661 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -131.36 53.91 1.95 Allowed 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -59.65 -35.04 73.63 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.208 -176.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -64.38 -40.47 95.89 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 120.955 0.407 . . . . 0.0 110.925 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -65.61 -50.13 66.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.382 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.476 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.3 m-85 -68.88 -34.26 75.14 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -177.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.61 -45.09 76.45 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.274 177.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.6 mtm -65.69 -44.0 87.54 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.998 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.581 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 45.0 pt -66.04 -39.08 83.54 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.824 0 C-N-CA 118.588 -1.245 . . . . 0.0 111.173 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.569 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.05 -40.67 73.87 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 117.99 0.359 . . . . 0.0 110.839 178.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.89 -54.15 35.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.749 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 98.1 mt -58.27 -41.47 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.289 -179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 96.9 mt -55.97 -48.73 75.28 Favored 'General case' 0 C--O 1.216 -0.694 0 C-N-CA 122.989 0.516 . . . . 0.0 111.506 178.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.569 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 57.3 mt-30 -68.37 -45.82 71.76 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.483 0.658 . . . . 0.0 109.78 -178.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 45.3 ttm180 -57.81 -49.34 76.98 Favored 'General case' 0 N--CA 1.424 -1.76 0 C-N-CA 124.71 1.204 . . . . 0.0 111.831 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.535 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 66.1 m-85 -87.86 -15.06 37.8 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 -176.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.529 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.14 -32.37 73.44 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 174.753 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.425 ' NZ ' ' HB3' ' A' ' 75' ' ' LYS . 7.2 mtpm? -81.25 -18.02 47.44 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.144 176.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -94.48 -47.42 6.56 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.163 -176.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.1 pt -126.55 -30.09 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.572 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 123.77 142.89 6.13 Favored Glycine 0 CA--C 1.499 -0.908 0 C-N-CA 120.238 -0.982 . . . . 0.0 112.043 177.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.3 tp -62.03 -33.64 59.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 117.018 0.409 . . . . 0.0 111.372 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -53.59 -49.47 67.7 Favored 'General case' 0 C--O 1.248 0.979 0 CA-C-O 122.376 1.084 . . . . 0.0 109.156 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -68.47 -46.98 68.27 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 113.795 -1.548 . . . . 0.0 110.756 -177.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.3 t -62.99 -38.24 81.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.737 -177.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -52.92 -50.34 64.16 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.673 0.749 . . . . 0.0 109.429 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -39.33 73.71 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.234 -178.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.446 ' O ' ' HB ' ' A' ' 88' ' ' THR . 87.0 mt -68.12 -32.77 73.29 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -178.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.4 ' O ' ' HB ' ' A' ' 89' ' ' THR . 43.7 mm -67.12 -37.69 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 CA-C-O 121.777 0.799 . . . . 0.0 108.983 175.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.36 -38.68 88.16 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.135 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.446 ' HB ' ' O ' ' A' ' 85' ' ' LEU . 90.5 m -61.3 -34.47 75.27 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.973 0.909 . . . . 0.0 110.562 175.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 86' ' ' ILE . 28.7 m -57.32 -49.97 74.43 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.955 0.902 . . . . 0.0 110.47 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.5 pt -89.65 -40.76 13.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.985 -176.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -75.09 -29.25 60.59 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -171.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.3 mt -89.57 34.55 0.82 Allowed 'General case' 0 C--O 1.24 0.557 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.984 178.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -65.93 -68.59 0.36 Allowed 'General case' 0 C--O 1.243 0.711 0 N-CA-C 104.266 -2.494 . . . . 0.0 104.266 171.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 41.4 t60 57.56 -62.41 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.787 2.035 . . . . 0.0 115.224 170.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -83.5 87.04 7.0 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -75.1 98.0 3.58 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 113.926 -1.488 . . . . 0.0 112.116 -168.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -86.55 99.02 11.4 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 176.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 43.2 t60 68.34 -65.34 0.27 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.368 1.467 . . . . 0.0 111.703 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.428 ' C ' ' HZ3' ' A' ' 16' ' ' LYS . 81.0 t60 . . . . . 0 C--N 1.297 -1.702 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.501 -0.909 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.8 t -144.73 142.3 29.93 Favored 'General case' 0 N--CA 1.422 -1.863 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 175.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.44 ' C ' ' H ' ' A' ' 5' ' ' GLU 0.3 14.0 tt 69.2 -32.45 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 C-N-CA 127.424 2.29 . . . . 0.0 113.276 178.462 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.4 mt -73.41 5.06 4.0 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.917 0.865 . . . . 0.0 109.976 175.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.44 ' H ' ' C ' ' A' ' 3' ' ' ILE . 21.0 mt-10 -83.78 -6.15 59.36 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 125.878 1.671 . . . . 0.0 108.312 178.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.438 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 14.3 t70 -103.06 126.93 30.98 Favored Pre-proline 0 N--CA 1.441 -0.923 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.92 -178.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.492 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 5.5 Cg_exo -71.58 -25.62 20.76 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.59 2.193 . . . . 0.0 113.426 -178.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -76.84 -40.13 48.83 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -59.49 -41.54 90.07 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.085 178.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.412 HG13 ' O ' ' A' ' 7' ' ' PRO . 7.8 p -66.09 -34.55 70.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-O 121.347 0.594 . . . . 0.0 110.043 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.492 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 64.4 mttp -65.04 -35.48 81.29 Favored 'General case' 0 C--O 1.217 -0.655 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 176.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.69 -42.47 98.97 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.461 ' HG2' HG23 ' A' ' 89' ' ' THR . 38.0 mtm180 -66.79 -30.2 70.34 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 121.724 0.774 . . . . 0.0 110.027 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -78.8 -32.02 46.21 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.621 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -77.11 -48.19 18.41 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 123.856 0.862 . . . . 0.0 110.51 -176.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 58.3 mttp 71.29 177.24 0.27 Allowed 'General case' 0 C--O 1.242 0.691 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 179.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -104.89 104.57 2.39 Favored Glycine 0 N--CA 1.418 -2.545 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.906 -173.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.402 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -94.82 38.3 1.12 Allowed 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 174.478 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 9.2 m -130.62 167.28 26.12 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.782 0 CA-C-N 112.498 -2.137 . . . . 0.0 108.192 -176.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -75.79 125.38 28.96 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -56.04 -36.12 67.66 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 123.521 0.513 . . . . 0.0 110.916 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -73.49 -31.55 63.79 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.045 -177.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.599 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.5 tp -76.61 -39.69 51.68 Favored 'General case' 0 N--CA 1.42 -1.927 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.217 -177.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.502 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 60.3 t -64.26 -44.4 97.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 176.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 14.9 tmm? -58.85 -32.4 69.4 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.465 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.676 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 63.8 tt0 -74.49 -42.13 59.5 Favored 'General case' 0 C--O 1.192 -1.933 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.483 176.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.599 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.2 mm -56.24 -44.51 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 CA-C-O 121.672 0.749 . . . . 0.0 109.255 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 69.9 mt -67.33 -31.34 71.55 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.668 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -72.4 -48.61 40.05 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.014 0.926 . . . . 0.0 110.115 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.676 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.2 mm-40 -53.79 -53.85 46.6 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.414 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.6 pt -66.77 -38.53 81.7 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.546 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.224 -177.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -58.71 -49.21 78.42 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.269 0.628 . . . . 0.0 111.494 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -71.38 -32.66 68.74 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -75.52 -36.99 60.38 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.8 0.81 . . . . 0.0 109.653 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 46.0 tp -65.81 -37.94 87.62 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.265 177.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -73.55 -15.32 61.3 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.123 0.487 . . . . 0.0 111.166 173.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -70.49 -20.4 77.01 Favored Glycine 0 C--O 1.219 -0.796 0 N-CA-C 108.895 -1.682 . . . . 0.0 108.895 171.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.6 m 76.1 90.38 0.08 Allowed 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 171.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -141.2 -83.73 0.21 Allowed 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 169.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.529 ' HB2' ' OG1' ' A' ' 43' ' ' THR . 43.9 m-80 -158.4 137.98 11.88 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 177.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.538 ' O ' HG12 ' A' ' 45' ' ' ILE . 12.0 tt -64.38 -32.47 57.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 118.065 0.393 . . . . 0.0 110.812 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.419 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.5 pttp -61.86 -33.6 74.47 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.324 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.529 ' OG1' ' HB2' ' A' ' 40' ' ' ASN . 8.5 m -72.2 -43.1 65.0 Favored 'General case' 0 C--O 1.25 1.119 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.414 ' O ' HG23 ' A' ' 48' ' ' VAL . 16.5 m -58.58 -41.92 86.83 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.125 178.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 41' ' ' ILE . 37.0 mm -52.55 -46.69 48.76 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.388 177.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 42' ' ' LYS . 64.7 mt -56.05 -50.52 69.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.448 -176.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -58.18 -53.01 63.11 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.895 0.855 . . . . 0.0 109.9 -176.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 44' ' ' SER . 40.9 t -62.06 -47.56 92.58 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.712 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.718 -176.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -68.17 -35.93 78.81 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.665 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.1 t -77.4 -24.92 50.41 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.311 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.6 t -86.8 -19.47 28.98 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.16 0.505 . . . . 0.0 111.048 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.476 ' O ' HG12 ' A' ' 56' ' ' ILE . 76.7 m-70 -124.46 36.85 4.53 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 -177.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.49 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 82.9 mt -47.21 -41.8 18.94 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -174.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -53.66 -50.07 66.59 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -175.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.557 ' OE1' ' HD3' ' A' ' 58' ' ' LYS . 3.7 tp10 -72.99 -36.04 66.97 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.4 mm -63.21 -50.62 78.34 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.141 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.566 -177.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 6.9 ptm180 -70.49 -25.83 63.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.921 0.391 . . . . 0.0 111.762 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.557 ' HD3' ' OE1' ' A' ' 55' ' ' GLU . 78.7 tttt -65.33 -42.96 92.38 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 123.604 0.761 . . . . 0.0 109.984 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -127.22 58.79 1.44 Allowed 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 177.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.447 ' HG3' ' OE2' ' A' ' 61' ' ' GLU . 14.1 ptmm? -60.32 -32.32 71.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.828 -175.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.447 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 3.4 mp0 -65.57 -41.87 92.42 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.873 0.368 . . . . 0.0 110.213 177.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -64.01 -51.74 62.83 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.692 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.454 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.9 m-85 -67.01 -34.08 76.96 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -177.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -66.22 -45.36 80.96 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.585 177.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.8 mtm -66.22 -44.5 83.65 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.872 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.498 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 45.3 pt -67.37 -40.53 84.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.682 0 C-N-CA 118.939 -1.104 . . . . 0.0 112.348 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.496 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.92 -35.35 68.92 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 118.482 0.583 . . . . 0.0 110.876 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -67.09 -54.93 16.74 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.083 177.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.4 mt -62.7 -39.55 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.235 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 96.9 mt -54.55 -49.2 70.87 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.009 0.524 . . . . 0.0 111.433 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.496 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 55.1 mt-30 -65.17 -45.4 85.07 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.677 0.751 . . . . 0.0 109.646 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -57.57 -42.72 83.65 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 125.805 1.642 . . . . 0.0 112.07 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.438 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 64.3 m-85 -97.21 -15.83 20.68 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -178.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -34.42 77.41 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 118.881 0.764 . . . . 0.0 109.567 177.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -79.08 -17.68 54.74 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.533 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -99.83 -51.37 3.74 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.285 -172.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.3 pt -119.31 -20.71 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.563 ' O ' HG22 ' A' ' 82' ' ' VAL . . . 117.32 140.25 6.58 Favored Glycine 0 C--N 1.308 -0.988 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.6 tp -64.72 -37.89 81.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.908 0.354 . . . . 0.0 111.922 -173.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.72 -45.28 82.0 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 122.021 0.915 . . . . 0.0 109.722 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.45 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 79.8 m-20 -61.55 -48.62 80.16 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 113.953 -1.476 . . . . 0.0 111.112 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 78' ' ' GLY . 21.6 t -62.34 -44.77 99.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 O-C-N 123.59 0.556 . . . . 0.0 110.441 -177.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -55.1 -47.2 75.28 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.157 0.504 . . . . 0.0 111.973 -178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -40.24 86.69 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 99.0 mt -65.01 -36.92 85.93 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.665 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.3 mm -63.73 -40.25 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 121.136 0.493 . . . . 0.0 109.917 176.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 92.2 mt -65.2 -37.1 86.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.92 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 58.3 m -67.16 -33.62 75.81 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.81 0.814 . . . . 0.0 109.898 176.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.461 HG23 ' HG2' ' A' ' 13' ' ' ARG . 87.6 m -66.59 -44.54 81.88 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.927 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 41.6 pt -83.04 -34.02 10.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -176.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -92.76 120.35 33.05 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -176.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 46.8 tp -80.08 67.64 5.95 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 122.4 1.095 . . . . 0.0 110.311 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -159.63 152.49 21.69 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 102.441 -3.17 . . . . 0.0 102.441 178.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -161.38 -68.07 0.06 Allowed 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 118.977 0.808 . . . . 0.0 109.782 -175.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 46.2 t60 -80.54 98.24 7.52 Favored 'General case' 0 N--CA 1.426 -1.632 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -74.41 105.75 5.7 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.502 -173.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -147.12 77.1 1.44 Allowed 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 35.7 t-80 -99.32 -26.28 14.21 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 165.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 33.6 t-80 . . . . . 0 N--CA 1.405 -2.711 0 N-CA-C 103.202 -2.888 . . . . 0.0 103.202 176.679 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.8 ptp . . . . . 0 CA--C 1.497 -1.062 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.467 ' HB3' ' OE1' ' A' ' 5' ' ' GLU . 45.3 m 64.76 89.48 0.09 Allowed 'General case' 0 CA--C 1.533 0.303 0 O-C-N 124.6 1.188 . . . . 0.0 112.492 177.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.543 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 10.1 tp -154.58 -30.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.792 178.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.3 mt -81.82 13.97 2.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.403 0.621 . . . . 0.0 111.112 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.467 ' OE1' ' HB3' ' A' ' 2' ' ' SER . 39.2 mt-10 -86.65 8.66 21.45 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 123.328 0.651 . . . . 0.0 109.603 178.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -126.56 129.39 24.12 Favored Pre-proline 0 N--CA 1.441 -0.887 0 C-N-CA 120.411 -0.516 . . . . 0.0 111.491 -174.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -72.04 -28.67 15.76 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.608 2.206 . . . . 0.0 112.813 -178.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.401 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 18.0 mm-40 -75.03 -35.69 61.93 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -61.03 -47.47 86.26 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.238 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.5 p -63.37 -34.67 68.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.472 0.653 . . . . 0.0 110.908 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -71.01 -31.82 68.44 Favored 'General case' 0 C--O 1.198 -1.61 0 O-C-N 121.951 -0.468 . . . . 0.0 112.245 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 94.0 mt -62.5 -36.79 83.67 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.277 0.56 . . . . 0.0 110.509 176.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -62.03 -38.82 90.14 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.697 177.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -80.17 -33.52 38.28 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.336 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -62.62 -43.54 98.55 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 124.589 1.155 . . . . 0.0 108.359 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.2 tttt 59.26 69.73 0.7 Allowed 'General case' 0 C--O 1.247 0.923 0 C-N-CA 125.234 1.414 . . . . 0.0 113.228 175.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 74.81 -94.94 0.89 Allowed Glycine 0 N--CA 1.437 -1.299 0 CA-C-N 114.527 -1.215 . . . . 0.0 114.832 173.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp 60.0 17.0 6.28 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.172 1.389 . . . . 0.0 111.395 -172.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.4 m -131.48 168.93 22.77 Favored 'Isoleucine or valine' 0 C--O 1.256 1.43 0 C-N-CA 124.523 1.129 . . . . 0.0 108.649 -177.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.418 ' O ' HG23 ' A' ' 24' ' ' VAL . 45.7 t-20 -81.33 117.87 22.17 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 174.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -58.31 -32.52 68.54 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 123.321 0.388 . . . . 0.0 111.09 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -66.74 -41.73 87.36 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.03 -174.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.574 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.1 tp -77.02 -38.7 52.43 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.234 -176.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 20' ' ' ASN . 56.6 t -59.86 -41.88 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 CA-C-O 121.088 0.471 . . . . 0.0 110.094 178.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 15.9 tmm? -57.92 -40.9 81.54 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.071 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -74.76 -36.26 62.58 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.005 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.574 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.5 mm -56.61 -47.12 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.0 mt -65.1 -41.16 95.23 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.332 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -64.56 -47.3 79.27 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.755 0.788 . . . . 0.0 110.655 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -59.57 -45.37 92.04 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.322 -177.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.402 ' CD1' HD13 ' A' ' 70' ' ' LEU . 35.4 pt -71.71 -39.67 69.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.376 178.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -54.69 -51.6 65.02 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.501 1.12 . . . . 0.0 111.347 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.38 -28.86 67.48 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -76.03 -49.94 16.19 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.746 0.784 . . . . 0.0 110.225 177.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.1 tp -62.03 -59.94 4.34 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.581 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 59.22 -83.27 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.382 1.073 . . . . 0.0 111.189 -175.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.29 20.04 2.63 Favored Glycine 0 N--CA 1.441 -0.984 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.3 m -80.1 174.61 11.42 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.548 ' HA ' ' OH ' ' A' ' 74' ' ' TYR . 6.6 p-10 -105.66 -14.64 15.2 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 121.821 -0.549 . . . . 0.0 111.62 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -85.28 53.07 2.62 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.501 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.5 tt -62.47 -34.81 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-O 121.29 0.567 . . . . 0.0 110.358 178.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.525 ' O ' HG13 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.18 -28.19 68.95 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.967 177.019 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.402 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 11.9 m -79.01 -37.58 38.8 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.458 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 16.1 m -59.96 -40.71 89.97 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 41' ' ' ILE . 44.2 mm -55.64 -49.72 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.245 175.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 42' ' ' LYS . 78.1 mt -53.59 -49.02 58.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.369 -177.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.458 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 22.9 m-85 -60.03 -52.83 63.72 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.734 0.778 . . . . 0.0 110.141 -177.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.6 t -63.83 -43.76 97.96 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.796 -174.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -68.88 -34.38 75.34 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.358 -179.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.6 m -75.99 -21.51 56.85 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.194 0.521 . . . . 0.0 110.978 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 37.5 t -86.09 -41.12 15.04 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.009 0.433 . . . . 0.0 110.701 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.502 ' O ' HG12 ' A' ' 56' ' ' ILE . 84.1 m-70 -107.22 43.31 1.19 Allowed 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -176.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 81.0 mt -47.01 -41.93 17.28 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -175.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.647 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 34.0 t70 -58.93 -50.39 74.22 Favored 'General case' 0 C--O 1.209 -1.039 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -172.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.43 ' CG ' ' HH ' ' A' ' 63' ' ' TYR . 9.8 tp10 -72.0 -28.41 63.38 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.998 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.502 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.7 mm -64.92 -45.04 95.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 0.5 OUTLIER -73.67 -25.2 60.14 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.428 178.513 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.647 ' HG2' ' O ' ' A' ' 54' ' ' ASP . 74.2 mmtt -65.37 -51.39 60.79 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 176.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -123.34 65.62 1.0 Allowed 'General case' 0 CA--C 1.496 -1.121 0 CA-C-O 121.433 0.635 . . . . 0.0 111.655 -178.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -17.3 64.84 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.174 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.3 mp0 -64.71 -58.19 6.96 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 173.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -60.08 -49.7 76.6 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.122 -1.399 . . . . 0.0 111.014 -176.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.43 ' HH ' ' CG ' ' A' ' 55' ' ' GLU . 75.1 m-85 -67.68 -30.26 69.74 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -176.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -73.87 -41.47 62.14 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 119.452 -0.899 . . . . 0.0 109.825 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 84.8 mtp -63.72 -49.24 73.86 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.162 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.496 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.9 pt -66.2 -38.6 82.29 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.316 0 C-N-CA 119.729 -0.789 . . . . 0.0 111.741 -179.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.518 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -55.62 -39.7 71.15 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.616 0.246 . . . . 0.0 111.147 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -67.85 -51.7 45.28 Favored 'General case' 0 C--O 1.251 1.155 0 CA-C-O 121.598 0.713 . . . . 0.0 109.694 178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.3 mt -57.84 -45.01 87.36 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.317 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.558 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 85.4 mt -55.22 -46.37 75.95 Favored 'General case' 0 C--O 1.212 -0.874 0 C-N-CA 123.173 0.589 . . . . 0.0 110.97 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 75.5 mt-30 -61.53 -52.12 65.76 Favored 'General case' 0 C--O 1.256 1.418 0 CA-C-O 121.372 0.606 . . . . 0.0 110.363 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -57.7 -54.74 43.43 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.631 -176.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.543 ' CE2' ' HA ' ' A' ' 3' ' ' ILE . 88.5 m-85 -82.65 -16.36 48.56 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -173.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.558 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -63.79 -39.06 93.33 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 176.16 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -81.32 -37.05 28.97 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.422 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -72.21 -50.63 26.07 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.991 -176.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.8 pt -118.69 -29.99 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -178.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.573 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 129.67 136.02 4.0 Favored Glycine 0 C--N 1.31 -0.878 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.412 ' HB ' ' HB2' ' A' ' 74' ' ' TYR . 9.0 tp -60.01 -38.78 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 CA-C-N 117.298 0.549 . . . . 0.0 111.978 -174.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.94 -45.99 82.38 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.274 0.559 . . . . 0.0 110.197 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.442 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 94.4 m-20 -62.65 -45.92 90.61 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.962 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.5 t -63.41 -47.78 90.22 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.576 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -55.12 -45.54 75.55 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.346 0.593 . . . . 0.0 110.881 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.29 -44.48 87.83 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 115.359 -0.837 . . . . 0.0 108.866 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.2 mt -64.9 -36.24 83.72 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 82' ' ' VAL . 45.3 mm -63.09 -44.7 99.65 Favored 'Isoleucine or valine' 0 C--O 1.244 0.769 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.498 ' O ' ' HB2' ' A' ' 91' ' ' LYS . 94.2 mt -61.28 -41.56 97.16 Favored 'General case' 0 C--O 1.214 -0.794 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.303 177.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.2 m -60.37 -38.86 85.2 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.226 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.6 m -71.79 -39.6 69.8 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.281 -176.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 41.2 pt -83.78 -21.07 8.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.982 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 87' ' ' LEU . 18.8 tptm -66.02 -48.32 71.52 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 51.49 54.69 10.61 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -110.66 123.73 50.56 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.399 -174.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -112.52 -18.82 12.32 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -123.51 -75.1 0.6 Allowed 'General case' 0 N--CA 1.442 -0.875 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -167.43 129.19 1.58 Allowed 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 125.427 1.491 . . . . 0.0 108.339 176.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -93.54 76.18 4.4 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.076 -177.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 38.6 t60 72.05 -12.76 0.65 Allowed 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 125.7 1.6 . . . . 0.0 113.044 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 1.7 m170 . . . . . 0 C--N 1.295 -1.8 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.11 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtm . . . . . 0 CA--C 1.499 -1.002 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 m -141.46 -69.55 0.37 Allowed 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.402 ' CG2' HD11 ' A' ' 85' ' ' LEU . 20.4 tt -171.12 -10.99 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.24 -175.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 73.9 mt -68.97 -11.39 60.67 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.528 0.68 . . . . 0.0 110.858 -177.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.82 -30.55 70.9 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 124.757 1.223 . . . . 0.0 109.987 173.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.428 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 22.8 t70 -78.42 132.5 65.69 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 114.017 1.118 . . . . 0.0 114.017 -171.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.498 ' O ' HG13 ' A' ' 10' ' ' VAL . 15.0 Cg_exo -70.77 -31.37 16.13 Favored 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 123.024 2.483 . . . . 0.0 113.422 177.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -75.17 -38.26 60.94 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.697 0.761 . . . . 0.0 109.021 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.503 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 67.7 t80 -63.93 -38.28 90.52 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.699 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 7' ' ' PRO . 4.3 p -67.29 -33.53 63.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 120.87 0.367 . . . . 0.0 110.305 178.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -58.19 -43.03 87.35 Favored 'General case' 0 C--N 1.342 0.262 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.74 -38.32 84.77 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.038 177.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.503 ' HG2' ' O ' ' A' ' 9' ' ' PHE . 19.8 mmm180 -60.12 -42.22 94.28 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -72.85 -38.03 67.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.023 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -63.42 -41.58 98.72 Favored 'General case' 0 C--O 1.246 0.887 0 C-N-CA 123.364 0.665 . . . . 0.0 109.406 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.516 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 0.4 OUTLIER 72.03 -84.86 0.03 OUTLIER 'General case' 0 C--O 1.204 -1.298 0 C-N-CA 124.919 1.288 . . . . 0.0 111.885 178.627 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -176.15 97.1 0.11 Allowed Glycine 0 N--CA 1.429 -1.771 0 C-N-CA 119.409 -1.376 . . . . 0.0 112.481 -176.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -105.35 26.56 9.26 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.6 m -129.28 167.96 23.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.951 -174.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -75.27 121.58 22.39 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 174.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -54.02 -39.16 65.89 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.314 0.578 . . . . 0.0 111.41 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -75.05 -33.1 61.69 Favored 'General case' 0 CA--C 1.485 -1.535 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.077 -171.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.59 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.9 tp -76.57 -36.64 57.47 Favored 'General case' 0 N--CA 1.419 -2.002 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.265 -177.047 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.424 HG23 ' HH ' ' A' ' 63' ' ' TYR . 61.0 t -65.02 -42.44 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.678 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 56.3 ttp -58.46 -41.2 84.65 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.325 177.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -68.86 -39.88 79.61 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.461 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.59 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.8 mm -57.06 -51.22 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 176.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.5 mt -63.04 -37.89 89.01 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.633 -179.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -66.49 -49.06 67.86 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 123.99 0.916 . . . . 0.0 110.449 179.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.3 -41.05 97.05 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.165 -175.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 38.7 pt -72.86 -35.16 48.61 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.587 0 C-N-CA 120.112 -0.635 . . . . 0.0 109.499 176.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.586 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 36.0 tt0 -60.95 -54.57 43.4 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 123.018 0.527 . . . . 0.0 110.421 -179.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.421 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.5 pp -62.24 -34.76 77.13 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.922 -178.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.421 ' N ' HD12 ' A' ' 33' ' ' LEU . 25.9 t70 -75.36 -48.55 22.5 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.914 -178.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 54.1 tp -55.62 -34.93 65.33 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.662 0.785 . . . . 0.0 112.118 -179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.586 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 37.6 mtp180 -66.6 -11.92 55.57 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 111.884 0.328 . . . . 0.0 111.884 -179.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -133.01 23.18 3.94 Favored Glycine 0 N--CA 1.441 -0.982 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.9 t -129.22 172.32 11.57 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 -178.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -95.11 -42.04 8.79 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.02 126.96 49.67 Favored 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.281 -171.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.519 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.7 tt -68.64 -31.79 52.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.265 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.493 ' O ' HG13 ' A' ' 46' ' ' ILE . 21.1 pttm -62.69 -32.9 74.07 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 119.951 -0.7 . . . . 0.0 110.794 178.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.0 m -69.11 -43.45 74.42 Favored 'General case' 0 N--CA 1.428 -1.526 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.321 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.477 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 25.0 m -60.4 -37.96 82.47 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.438 176.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.519 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.1 mm -55.95 -49.19 76.71 Favored 'Isoleucine or valine' 0 C--N 1.344 0.338 0 C-N-CA 123.397 0.679 . . . . 0.0 110.035 176.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 42' ' ' LYS . 75.6 mt -52.29 -47.47 45.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 C-N-CA 123.528 0.731 . . . . 0.0 112.161 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.477 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 25.9 m-85 -61.8 -53.13 60.19 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-O 121.43 0.633 . . . . 0.0 110.453 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.3 -43.6 95.04 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 CA-C-N 114.638 -1.164 . . . . 0.0 111.662 -173.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -67.31 -34.42 77.34 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.419 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.425 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 37.2 m -77.57 -21.96 51.69 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.283 0.563 . . . . 0.0 111.099 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.4 t -77.85 -49.11 14.91 Favored 'General case' 0 N--CA 1.434 -1.248 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.49 ' O ' HG12 ' A' ' 56' ' ' ILE . 79.9 m-70 -104.99 45.55 0.96 Allowed 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -175.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 50' ' ' SER . 81.1 mt -46.81 -43.75 18.65 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -175.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.431 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 7.9 t70 -53.58 -51.67 62.24 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -174.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -74.0 -32.68 63.51 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.461 -177.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.49 HG12 ' O ' ' A' ' 52' ' ' HIS . 41.8 mm -62.95 -35.65 72.33 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.477 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 177.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -77.66 -43.95 29.65 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.166 -179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 52.9 mtpt -60.96 -46.25 91.48 Favored 'General case' 0 CA--C 1.505 -0.771 0 C-N-CA 122.975 0.51 . . . . 0.0 110.754 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -122.34 60.33 1.0 Allowed 'General case' 0 C--N 1.302 -1.472 0 CA-C-O 121.562 0.696 . . . . 0.0 111.432 -177.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -22.94 66.13 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.762 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -63.09 -49.76 73.19 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 123.503 0.502 . . . . 0.0 109.661 175.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -63.09 -49.6 73.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.874 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.431 ' HA ' HG12 ' A' ' 66' ' ' ILE . 81.2 m-85 -68.49 -33.42 74.12 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -178.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.54 -50.04 72.93 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.164 0.507 . . . . 0.0 109.802 174.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.2 mtm -61.16 -48.88 79.55 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.364 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.538 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 46.4 pt -67.78 -39.89 82.78 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.826 -177.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.533 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.53 -39.81 68.03 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 118.348 0.522 . . . . 0.0 111.587 -178.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -63.39 -55.73 22.06 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.575 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.0 mt -60.63 -40.41 84.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.747 -176.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.574 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 93.0 mt -55.61 -50.32 70.44 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 122.929 0.492 . . . . 0.0 111.636 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 43.2 mt-30 -70.36 -46.79 63.4 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 122.297 1.046 . . . . 0.0 109.858 -176.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -60.91 -44.55 97.02 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 113.51 -1.677 . . . . 0.0 111.43 -175.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.428 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 32.5 m-85 -91.98 -15.28 28.17 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -177.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.574 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.94 -30.26 70.34 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 119.929 -0.708 . . . . 0.0 109.098 175.127 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -79.78 -17.46 53.37 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.099 176.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -97.42 -51.3 4.21 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.028 -176.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.5 pt -118.17 -25.9 2.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -176.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.525 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 120.42 143.83 6.94 Favored Glycine 0 C--N 1.308 -0.978 0 C-N-CA 120.064 -1.065 . . . . 0.0 111.213 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tp -60.68 -42.78 93.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -175.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.76 -41.84 87.53 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.554 0.692 . . . . 0.0 110.417 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.547 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 2.4 m-20 -63.07 -48.4 78.82 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.592 -1.186 . . . . 0.0 109.823 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.525 HG21 ' O ' ' A' ' 78' ' ' GLY . 33.9 t -62.29 -46.82 95.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.586 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -53.62 -46.7 70.54 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.203 0.525 . . . . 0.0 111.345 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -42.01 95.34 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 115.476 -0.784 . . . . 0.0 108.916 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 88.7 mt -65.44 -35.46 80.99 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.32 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 82' ' ' VAL . 49.0 mm -66.22 -45.82 89.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.553 ' O ' ' HG2' ' A' ' 91' ' ' LYS . 93.7 mt -59.53 -42.29 91.95 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.588 178.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 50.9 m -64.14 -33.69 76.36 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.127 0.489 . . . . 0.0 111.047 177.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.468 HG23 ' HD2' ' A' ' 13' ' ' ARG . 91.5 m -68.79 -37.44 79.28 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.779 179.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.516 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 39.6 pt -86.21 -5.61 10.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' A' ' 87' ' ' LEU . 73.6 mmtt -62.15 103.54 0.39 Allowed 'General case' 0 C--O 1.241 0.643 0 CA-C-O 120.896 0.379 . . . . 0.0 110.97 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.2 tt -81.79 121.02 25.9 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 175.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -67.27 116.92 8.58 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.367 0.603 . . . . 0.0 110.667 -176.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -86.23 -16.27 38.22 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.639 -178.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 35.6 m80 -73.57 150.98 41.08 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 171.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -75.37 76.47 2.45 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-O 121.587 0.708 . . . . 0.0 110.832 -176.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -149.26 113.06 5.1 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.902 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -77.11 -38.04 53.0 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 105.021 -2.214 . . . . 0.0 105.021 169.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 19.3 t-80 . . . . . 0 N--CA 1.425 -1.684 0 N-CA-C 105.275 -2.12 . . . . 0.0 105.275 174.614 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.2 mmt . . . . . 0 CA--C 1.5 -0.976 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.3 m -70.0 124.65 24.6 Favored 'General case' 0 N--CA 1.437 -1.099 0 O-C-N 123.229 0.331 . . . . 0.0 111.342 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.1 tp -163.67 -34.48 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 176.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.8 mt -79.94 6.11 12.15 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 121.573 0.702 . . . . 0.0 110.885 178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -91.9 -2.87 56.61 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.155 176.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.506 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 6.2 t70 -105.35 127.65 28.17 Favored Pre-proline 0 C--N 1.312 -1.043 0 C-N-CA 119.395 -0.922 . . . . 0.0 111.643 -173.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.07 -27.31 42.27 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.882 2.388 . . . . 0.0 112.438 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -75.01 -25.27 58.67 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -177.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -70.46 -39.56 74.21 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.357 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.4 p -68.4 -34.48 66.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.213 0.53 . . . . 0.0 109.574 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.68 -42.01 99.4 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 174.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.461 ' HB3' ' HE3' ' A' ' 16' ' ' LYS . 74.5 mt -57.45 -44.51 84.83 Favored 'General case' 0 C--O 1.195 -1.789 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.276 176.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -58.11 -32.84 68.49 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 118.659 0.663 . . . . 0.0 112.566 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -75.58 -32.89 60.53 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.903 0.859 . . . . 0.0 110.117 177.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -95.57 5.1 52.37 Favored 'General case' 0 CA--C 1.563 1.468 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.293 -176.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.577 ' NZ ' ' HB ' ' A' ' 89' ' ' THR . 17.4 mmtp -80.13 170.95 15.73 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 121.007 -1.058 . . . . 0.0 110.379 177.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 93.96 -34.83 4.45 Favored Glycine 0 C--O 1.221 -0.682 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.857 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.8 mtmm -80.73 11.24 3.99 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 124.092 0.957 . . . . 0.0 112.838 -178.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.0 m -134.09 168.31 24.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -177.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.406 ' O ' HG21 ' A' ' 24' ' ' VAL . 14.5 t-20 -94.23 138.94 31.67 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -61.37 -44.07 97.8 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 122.569 0.348 . . . . 0.0 111.761 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 -71.56 -31.22 66.75 Favored 'General case' 0 CA--C 1.492 -1.257 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -173.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.482 ' O ' HG12 ' A' ' 27' ' ' ILE . 30.8 tp -69.69 -47.86 61.7 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.453 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.504 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 94.6 t -63.52 -42.2 95.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -56.8 -43.73 81.25 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -65.54 -43.18 90.72 Favored 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.944 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.5 HD12 ' OE2' ' A' ' 55' ' ' GLU . 46.5 mm -58.74 -50.26 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-O 121.274 0.559 . . . . 0.0 109.811 177.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 82.7 mt -61.72 -36.24 80.37 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.325 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -71.84 -47.69 51.37 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.38 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -59.2 -41.08 87.71 Favored 'General case' 0 C--O 1.248 1.025 0 C-N-CA 124.307 1.043 . . . . 0.0 110.292 -177.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.411 ' CD1' HD12 ' A' ' 70' ' ' LEU . 45.8 pt -73.03 -40.31 58.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 120.596 -0.442 . . . . 0.0 109.996 176.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 36' ' ' ARG . 39.1 tt0 -60.95 -47.64 85.48 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 123.516 0.726 . . . . 0.0 111.051 -178.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.83 -30.1 71.23 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -75.0 -50.56 16.14 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 119.147 -1.021 . . . . 0.0 110.04 174.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 69.2 tp -60.49 -29.38 69.04 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.966 0.906 . . . . 0.0 111.692 -177.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.415 ' HB2' ' O ' ' A' ' 32' ' ' GLU . 3.0 tpt180 -58.86 -28.31 65.99 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 124.425 1.09 . . . . 0.0 109.964 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -130.82 19.98 4.9 Favored Glycine 0 N--CA 1.432 -1.598 0 C-N-CA 120.833 -0.699 . . . . 0.0 113.149 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 75.4 p -119.44 -103.26 0.41 Allowed 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.771 177.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.9 t70 178.23 -52.6 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -177.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.6 ' OD1' ' HG2' ' A' ' 42' ' ' LYS . 28.9 t-20 -101.95 112.99 25.82 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.226 -174.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.549 ' O ' HG12 ' A' ' 45' ' ' ILE . 10.9 tt -64.48 -31.94 55.66 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.102 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.6 ' HG2' ' OD1' ' A' ' 40' ' ' ASN . 64.6 pttt -71.86 -28.23 63.4 Favored 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 119.126 -1.029 . . . . 0.0 110.084 -177.214 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.2 m -73.91 -40.59 63.04 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.248 -0.887 . . . . 0.0 108.871 175.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.421 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 18.4 m -57.52 -40.7 79.32 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 121.021 0.439 . . . . 0.0 110.094 174.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.8 mm -54.51 -47.19 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 123.814 0.846 . . . . 0.0 109.897 175.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 42' ' ' LYS . 63.4 mt -52.93 -50.7 42.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.364 -0.834 . . . . 0.0 112.538 -177.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.421 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 31.0 m-85 -57.91 -49.84 75.38 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 121.164 0.507 . . . . 0.0 110.436 -175.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.4 t -66.78 -47.75 81.96 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 CA-C-N 114.508 -1.224 . . . . 0.0 111.671 -174.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -65.84 -39.01 90.37 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.823 0.344 . . . . 0.0 110.85 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.9 t -69.32 -22.06 63.8 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.306 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.9 t -97.16 -0.92 46.1 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-O 121.346 0.593 . . . . 0.0 109.944 -178.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.556 ' O ' HG12 ' A' ' 56' ' ' ILE . 26.8 m-70 -134.42 32.79 3.33 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.534 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 95.2 mt -47.37 -51.35 19.92 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -172.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.407 ' CG ' ' HZ2' ' A' ' 58' ' ' LYS . 31.1 t70 -62.53 -44.21 96.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.041 0.448 . . . . 0.0 111.104 -175.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.5 ' OE2' HD12 ' A' ' 27' ' ' ILE . 24.4 tt0 -60.76 -49.83 75.9 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 124.534 1.134 . . . . 0.0 110.17 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 52' ' ' HIS . 43.6 mm -55.75 -43.01 72.26 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.147 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.018 176.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 69.2 mtm180 -64.25 -34.46 78.16 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.407 ' HZ2' ' CG ' ' A' ' 54' ' ' ASP . 14.3 mptt -61.35 -51.43 68.84 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 120.863 0.363 . . . . 0.0 110.947 177.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -121.77 60.7 0.96 Allowed 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 121.346 0.593 . . . . 0.0 110.434 -177.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.648 ' HG2' ' OE1' ' A' ' 61' ' ' GLU . 4.3 ptpp? -65.07 -33.86 77.05 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.128 -177.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.648 ' OE1' ' HG2' ' A' ' 60' ' ' LYS . 3.1 mp0 -63.81 -45.87 87.67 Favored 'General case' 0 N--CA 1.414 -2.226 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.424 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -63.83 -52.39 60.35 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.124 179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -68.46 -34.61 76.25 Favored 'General case' 0 N--CA 1.432 -1.347 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.66 -43.77 65.46 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.343 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.3 mtm -67.67 -39.78 84.5 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.665 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.511 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.8 pt -67.2 -41.59 86.99 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.993 0 C-N-CA 118.342 -1.343 . . . . 0.0 110.732 177.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.2 -36.57 68.55 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 121.141 0.496 . . . . 0.0 111.144 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -68.55 -55.29 12.16 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.738 177.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.8 mt -61.53 -38.96 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.837 -178.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.585 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 93.1 mt -56.65 -48.05 78.42 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 123.069 0.548 . . . . 0.0 111.347 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.523 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 69.8 mt-30 -66.21 -46.63 76.6 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -55.51 -52.46 63.62 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.817 1.647 . . . . 0.0 112.386 -176.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.506 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 84.2 m-85 -90.13 -14.83 32.82 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -175.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.585 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.36 -28.32 67.85 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.354 0.597 . . . . 0.0 109.4 174.729 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -73.56 -22.14 60.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.106 176.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -96.3 -51.15 4.5 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.6 pt -119.79 -30.83 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.487 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 136.53 173.66 13.02 Favored Glycine 0 C--O 1.212 -1.24 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -178.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.5 tp -91.91 -40.59 12.45 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.105 0 CA-C-N 118.362 1.081 . . . . 0.0 110.506 -174.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -59.66 -33.97 72.23 Favored 'General case' 0 N--CA 1.421 -1.876 0 C-N-CA 123.975 0.91 . . . . 0.0 110.218 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.517 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 12.2 m120 -69.39 -48.14 62.07 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.396 -1.275 . . . . 0.0 109.366 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 78' ' ' GLY . 44.2 t -66.57 -38.55 81.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.3 -178.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -56.4 -45.61 80.54 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.257 0.551 . . . . 0.0 110.392 177.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -44.92 94.63 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 87.0 mt -59.43 -42.31 91.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.452 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.6 mm -64.08 -38.76 83.27 Favored 'Isoleucine or valine' 0 C--O 1.269 2.114 0 C-N-CA 122.637 0.375 . . . . 0.0 110.685 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.75 -40.5 95.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.562 0.696 . . . . 0.0 110.131 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 49.7 m -62.07 -33.27 74.11 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.322 177.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.577 ' HB ' ' NZ ' ' A' ' 16' ' ' LYS . 1.3 m -69.7 -34.57 74.1 Favored 'General case' 0 CA--C 1.562 1.415 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.478 HG22 ' NZ ' ' A' ' 16' ' ' LYS . 23.8 pt -87.54 -39.37 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -176.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -95.62 116.23 28.56 Favored 'General case' 0 C--N 1.292 -1.929 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 -173.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 85.3 mt 64.36 85.35 0.14 Allowed 'General case' 0 C--O 1.242 0.665 0 O-C-N 124.511 1.132 . . . . 0.0 109.772 -176.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.438 ' C ' ' H ' ' A' ' 95' ' ' HIS . 31.5 tt0 -55.92 146.34 22.42 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.983 -177.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -81.2 21.84 0.7 Allowed 'General case' 0 CA--C 1.548 0.9 0 CA-C-O 122.15 0.976 . . . . 0.0 109.538 -178.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.478 ' HA ' ' OXT' ' A' ' 99' ' ' HIS . 49.1 t-80 -159.06 145.34 16.72 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -151.06 -86.86 0.07 Allowed 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 170.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -157.21 24.33 0.3 Allowed 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.426 1.107 . . . . 0.0 108.173 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -140.24 -43.71 0.42 Allowed 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.278 -178.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.478 ' OXT' ' HA ' ' A' ' 95' ' ' HIS . 9.8 t-160 . . . . . 0 N--CA 1.431 -1.393 0 N-CA-C 106.441 -1.689 . . . . 0.0 106.441 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.445 ' HB2' ' CG ' ' A' ' 5' ' ' GLU . 1.9 mpt? . . . . . 0 CA--C 1.5 -0.965 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.47 ' O ' HG23 ' A' ' 3' ' ' ILE . 50.7 m -138.13 114.88 10.63 Favored 'General case' 0 N--CA 1.424 -1.764 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.47 HG23 ' O ' ' A' ' 2' ' ' SER . 4.0 tp 76.1 -32.86 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 C-N-CA 127.014 2.126 . . . . 0.0 113.086 175.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 99.1 mt -79.27 13.87 1.73 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.027 0.531 . . . . 0.0 111.933 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.445 ' CG ' ' HB2' ' A' ' 1' ' ' MET . 19.2 mt-10 -102.5 -9.28 20.35 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -99.74 126.24 37.77 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.59 -171.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -71.23 -24.59 23.06 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.99 2.46 . . . . 0.0 112.721 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -75.52 -37.83 59.83 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -59.46 -44.51 92.98 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.955 178.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.6 p -65.77 -37.36 79.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.19 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -70.68 -29.17 65.41 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.175 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 64.1 mt -61.11 -39.32 89.53 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.212 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.4 mtm180 -72.05 -27.19 62.53 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.082 -179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -77.25 -24.17 51.16 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.455 0.645 . . . . 0.0 109.736 176.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -84.22 -37.59 21.6 Favored 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 39.2 ttmt 76.55 -33.42 0.21 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 126.742 2.017 . . . . 0.0 112.25 178.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.29 -55.94 0.7 Allowed Glycine 0 N--CA 1.42 -2.406 0 C-N-CA 120.416 -0.897 . . . . 0.0 110.964 177.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt 57.08 27.69 13.75 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.327 1.051 . . . . 0.0 110.921 -178.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.9 m -131.55 168.9 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 C-N-CA 125.169 1.387 . . . . 0.0 110.249 -175.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -76.84 123.88 26.89 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -53.6 -38.37 63.92 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 123.607 0.763 . . . . 0.0 110.824 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -70.97 -31.22 67.71 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.57 -173.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.552 ' O ' HG12 ' A' ' 27' ' ' ILE . 34.8 tp -76.42 -41.71 46.68 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.695 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.454 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 62.1 t -63.11 -44.09 99.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 177.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 62.3 ttp -57.32 -35.13 69.47 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.118 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -74.64 -41.93 59.47 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.999 177.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.62 -49.93 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-O 121.488 0.661 . . . . 0.0 109.314 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 78.6 mt -61.96 -40.5 95.78 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.548 -1.205 . . . . 0.0 110.406 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -64.3 -47.38 79.7 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.781 0.801 . . . . 0.0 110.827 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -62.28 -42.69 99.56 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.992 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 32.8 pt -71.87 -38.38 64.86 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.481 175.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.87 -50.73 72.92 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.069 0.948 . . . . 0.0 111.239 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.412 HD11 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -65.21 -32.41 74.07 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.38 -179.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.412 ' N ' HD11 ' A' ' 33' ' ' LEU . 20.3 t70 -75.73 -48.5 21.61 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.141 0.496 . . . . 0.0 111.08 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.499 ' HG ' ' H ' ' A' ' 37' ' ' GLY . 57.1 tp -62.81 -47.72 82.2 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.29 -178.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 63.55 10.85 5.22 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.051 0.941 . . . . 0.0 112.235 -177.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.499 ' H ' ' HG ' ' A' ' 35' ' ' LEU . . . 76.21 12.82 83.85 Favored Glycine 0 N--CA 1.434 -1.467 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.243 -177.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.4 p -126.61 -47.25 1.56 Allowed 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 -174.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -79.62 -102.66 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 -171.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -141.41 106.6 4.99 Favored 'General case' 0 CA--C 1.498 -1.049 0 O-C-N 122.025 -0.422 . . . . 0.0 110.487 -176.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.455 ' O ' HG12 ' A' ' 45' ' ' ILE . 12.7 tt -70.04 -29.05 38.52 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 CA-C-O 121.073 0.463 . . . . 0.0 109.892 -177.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.465 ' O ' HG13 ' A' ' 46' ' ' ILE . 10.2 ptmm? -59.35 -36.45 75.74 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.195 176.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 19.0 m -79.62 -35.61 39.2 Favored 'General case' 0 N--CA 1.417 -2.09 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.286 -178.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.8 m -59.22 -43.48 92.31 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 41' ' ' ILE . 29.8 mm -55.44 -41.29 62.17 Favored 'Isoleucine or valine' 0 C--N 1.346 0.419 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.008 177.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 42' ' ' LYS . 70.4 mt -57.37 -51.06 74.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.557 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -62.35 -52.44 63.62 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.564 0.697 . . . . 0.0 110.258 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.9 t -62.0 -46.95 95.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 114.585 -1.189 . . . . 0.0 112.084 -174.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -66.46 -36.44 82.78 Favored 'General case' 0 C--O 1.212 -0.888 0 C-N-CA 121.173 -0.211 . . . . 0.0 111.545 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.1 m -72.73 -25.4 61.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.979 0.418 . . . . 0.0 111.444 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.6 t -83.65 -40.39 19.04 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-O 121.167 0.508 . . . . 0.0 110.561 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.461 ' O ' HG12 ' A' ' 56' ' ' ILE . 64.1 m-70 -103.21 35.52 2.53 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.445 -175.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.1 mt -47.14 -43.17 20.62 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -175.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -53.99 -51.12 64.93 Favored 'General case' 0 C--N 1.318 -0.781 0 O-C-N 123.557 0.536 . . . . 0.0 112.226 -175.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -73.9 -34.36 64.36 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.044 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 52' ' ' HIS . 46.3 mm -61.19 -37.44 77.49 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -73.56 -43.15 60.57 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.682 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -58.33 -50.24 74.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.248 0.547 . . . . 0.0 111.565 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -120.02 54.14 1.04 Allowed 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 122.035 0.921 . . . . 0.0 110.39 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -53.47 -37.53 62.76 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 113.764 -1.562 . . . . 0.0 112.932 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -60.98 -46.82 89.2 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 120.954 0.406 . . . . 0.0 110.59 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -63.36 -51.02 67.63 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.056 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.441 ' HA ' HG12 ' A' ' 66' ' ' ILE . 85.9 m-85 -70.4 -28.16 64.86 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -175.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -75.68 -44.34 42.74 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.134 177.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.7 mtm -62.76 -45.77 91.13 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.038 178.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.481 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.0 pt -64.82 -36.9 78.82 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.217 0 C-N-CA 119.354 -0.938 . . . . 0.0 111.276 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.54 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -53.53 -46.63 70.22 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.351 0.407 . . . . 0.0 112.006 -177.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -76.3 -35.61 58.77 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.144 -0.622 . . . . 0.0 112.014 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 82.3 mt -64.05 -45.29 97.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 177.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.573 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.9 mt -52.88 -45.95 67.71 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 123.461 0.704 . . . . 0.0 110.988 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.0 mt-30 -66.29 -48.39 70.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.472 0.653 . . . . 0.0 110.52 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 39.5 ttm180 -59.19 -50.95 72.05 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.245 1.418 . . . . 0.0 111.436 -177.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.415 ' OH ' ' HB2' ' A' ' 5' ' ' GLU . 48.5 m-85 -86.56 -15.44 39.93 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -176.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.573 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.37 -34.8 78.04 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.2 174.419 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -74.88 -39.58 61.42 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.008 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -75.26 -47.06 29.82 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -174.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.8 pt -123.39 -30.72 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 O-C-N 121.721 -0.612 . . . . 0.0 112.569 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.493 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.95 142.5 5.89 Favored Glycine 0 C--N 1.309 -0.929 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.2 tp -61.14 -38.45 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 117.096 0.448 . . . . 0.0 111.876 -174.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -53.47 -45.75 69.68 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.713 0.768 . . . . 0.0 110.475 179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.459 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 42.6 m-80 -65.59 -45.68 82.28 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.189 -1.368 . . . . 0.0 110.195 -178.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 78' ' ' GLY . 15.0 t -65.01 -45.66 93.92 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.12 -176.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -55.56 -43.75 76.18 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.335 0.588 . . . . 0.0 110.844 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -45.49 83.7 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 98.7 mt -62.39 -39.67 93.97 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.669 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.5 mm -62.89 -40.48 88.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-O 120.847 0.356 . . . . 0.0 110.073 177.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 98.6 mt -63.71 -38.62 91.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.867 0.842 . . . . 0.0 110.32 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.7 m -67.07 -34.36 77.5 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.033 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 56.4 m -64.95 -46.21 82.53 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 124.324 1.05 . . . . 0.0 110.805 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.417 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 24.9 pt -75.36 -12.71 14.91 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -177.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -101.94 22.08 13.63 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.171 0.51 . . . . 0.0 109.758 174.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 33.0 tp -146.32 167.34 23.78 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -178.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -145.77 -76.4 0.2 Allowed 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 176.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.419 ' CD2' ' HB2' ' A' ' 96' ' ' HIS . 20.4 t60 -150.77 81.86 1.34 Allowed 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -174.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -84.41 72.21 10.62 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -177.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.419 ' HB2' ' CD2' ' A' ' 94' ' ' HIS . 50.4 t-80 -71.07 -33.87 70.65 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.047 -178.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -77.48 95.66 4.53 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 175.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.8 p-80 -138.91 140.17 38.27 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-O 121.01 0.433 . . . . 0.0 111.038 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 15.1 p80 . . . . . 0 C--N 1.29 -1.996 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.632 -174.491 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.2 mtt . . . . . 0 CA--C 1.51 -0.587 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.2 t -77.85 151.5 33.87 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 121.375 0.607 . . . . 0.0 110.023 -179.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 16.3 tt -142.57 19.58 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 123.414 1.578 . . . . 0.0 107.36 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.1 mt -82.66 4.42 24.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.929 -176.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.41 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 21.8 mt-10 -79.89 -24.88 40.85 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 -178.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.401 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 7.1 t70 -86.18 131.1 47.47 Favored Pre-proline 0 C--O 1.247 0.964 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.351 -170.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.443 ' O ' HG13 ' A' ' 10' ' ' VAL . 2.9 Cg_exo -72.1 -30.36 13.52 Favored 'Trans proline' 0 C--O 1.241 0.638 0 C-N-CA 122.848 2.366 . . . . 0.0 113.108 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -76.2 -28.73 57.35 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -64.43 -41.82 96.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.389 178.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 7' ' ' PRO . 10.3 p -63.44 -34.86 69.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -59.18 -43.85 92.17 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.358 171.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.71 -35.48 78.17 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 122.907 0.483 . . . . 0.0 110.962 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -61.5 -36.78 81.45 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.185 0.594 . . . . 0.0 110.641 177.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -79.76 -38.09 33.95 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.996 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.42 ' CZ ' ' HB2' ' A' ' 18' ' ' LYS . 51.1 t80 -59.56 -49.36 78.08 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.073 -0.967 . . . . 0.0 108.953 177.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.571 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 87.6 tttt 64.73 -93.74 0.04 OUTLIER 'General case' 0 C--O 1.212 -0.912 0 C-N-CA 125.654 1.582 . . . . 0.0 111.378 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -144.03 108.37 0.49 Allowed Glycine 0 N--CA 1.432 -1.609 0 C-N-CA 119.549 -1.31 . . . . 0.0 112.336 -176.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.42 ' HB2' ' CZ ' ' A' ' 15' ' ' PHE . 59.3 mtpt -136.46 19.47 3.13 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 31.0 m -128.13 168.26 21.66 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 CA-C-N 114.442 -1.254 . . . . 0.0 108.835 -174.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.407 ' O ' HG23 ' A' ' 24' ' ' VAL . 79.5 m-20 -84.32 110.54 18.67 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 120.072 -0.651 . . . . 0.0 109.671 173.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.506 ' CE1' ' HD2' ' A' ' 91' ' ' LYS . 52.5 t80 -48.82 -47.94 41.98 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.319 1.048 . . . . 0.0 112.888 -178.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -64.65 -31.88 73.29 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -176.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.621 ' O ' HG12 ' A' ' 27' ' ' ILE . 31.1 tp -76.79 -40.63 47.48 Favored 'General case' 0 N--CA 1.426 -1.648 0 C-N-CA 119.819 -0.752 . . . . 0.0 110.067 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 20' ' ' ASN . 53.9 t -60.55 -42.3 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 177.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -57.2 -44.38 83.58 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.356 176.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -68.24 -38.13 81.53 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.943 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.621 HG12 ' O ' ' A' ' 23' ' ' LEU . 49.6 mm -56.81 -51.71 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.02 -40.98 97.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.493 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -66.02 -47.52 74.17 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.509 0.671 . . . . 0.0 111.35 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -62.02 -39.71 93.2 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.703 -176.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 31.0 pt -73.01 -39.21 57.33 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.234 175.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.99 -52.93 63.31 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.7 0.8 . . . . 0.0 111.406 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -66.6 -28.78 68.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -178.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -76.09 -49.71 16.7 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.633 0.73 . . . . 0.0 109.816 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 63.8 tp -63.15 -24.2 67.78 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.276 -178.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -48.58 -38.24 20.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.478 1.111 . . . . 0.0 111.105 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -173.12 59.08 0.15 Allowed Glycine 0 N--CA 1.435 -1.367 0 C-N-CA 119.992 -1.099 . . . . 0.0 112.334 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 53.9 m -146.95 -80.48 0.15 Allowed 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -126.6 -160.16 0.97 Allowed 'General case' 0 C--O 1.245 0.833 0 C-N-CA 119.557 -0.857 . . . . 0.0 110.379 -172.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -82.86 146.69 28.75 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.488 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.8 tt -58.0 -38.37 66.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 O-C-N 123.144 0.278 . . . . 0.0 111.506 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -66.46 -31.72 72.64 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.834 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.2 m -73.12 -41.61 63.81 Favored 'General case' 0 N--CA 1.426 -1.67 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 177.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.448 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 15.6 m -59.63 -39.71 85.21 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.783 177.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 41' ' ' ILE . 23.8 mm -52.39 -46.74 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 124.054 0.942 . . . . 0.0 110.278 175.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 60.2 mt -57.69 -47.66 85.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.986 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.448 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 19.5 m-85 -59.75 -42.59 93.58 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.812 0.815 . . . . 0.0 110.299 -177.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 44' ' ' SER . 46.5 t -71.85 -49.22 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.75 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.364 -176.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -62.98 -40.39 97.58 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.764 -178.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.5 t -66.78 -31.25 71.76 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 122.58 0.352 . . . . 0.0 111.665 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.7 t -84.68 -27.57 26.96 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.136 0.493 . . . . 0.0 111.008 -178.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.547 ' O ' HG12 ' A' ' 56' ' ' ILE . 83.1 m-70 -117.15 35.36 4.68 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -174.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 81.6 mt -47.13 -40.0 14.65 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 -174.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -56.78 -51.27 69.58 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -174.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -72.99 -32.61 65.29 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.185 0.517 . . . . 0.0 109.648 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 52' ' ' HIS . 44.9 mm -62.7 -45.4 98.93 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.786 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.623 -178.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.3 ptp85 -77.22 -28.06 53.67 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.224 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.49 ' HD2' ' ND2' ' A' ' 59' ' ' ASN . 0.0 OUTLIER -69.33 -32.6 71.81 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -175.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.49 ' ND2' ' HD2' ' A' ' 58' ' ' LYS . 55.8 m-80 -128.47 55.34 1.7 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.357 174.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -63.7 -24.08 67.63 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.522 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -63.86 -57.53 9.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 175.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -59.53 -51.21 70.83 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.692 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.403 ' HA ' HG12 ' A' ' 66' ' ' ILE . 72.6 m-85 -67.59 -26.12 66.11 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -176.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -77.07 -46.05 24.96 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.611 176.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.5 mtm -59.09 -50.59 73.48 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.664 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.561 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.7 pt -63.31 -41.69 93.66 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.698 0 C-N-CA 119.617 -0.833 . . . . 0.0 112.038 -178.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.539 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.85 -39.65 74.65 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.046 0.45 . . . . 0.0 110.91 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.56 -52.49 31.26 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.578 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.8 mt -60.34 -42.91 92.45 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.6 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 98.0 mt -52.66 -46.72 67.29 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 123.277 0.631 . . . . 0.0 111.265 178.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.539 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 63.7 mt-30 -68.57 -43.31 76.86 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.015 0.436 . . . . 0.0 110.565 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -62.07 -47.56 84.12 Favored 'General case' 0 N--CA 1.428 -1.534 0 C-N-CA 123.755 0.822 . . . . 0.0 111.556 -178.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.41 ' OH ' ' HB2' ' A' ' 5' ' ' GLU . 57.6 m-85 -85.75 -15.48 42.01 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 -177.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.54 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.01 -33.3 75.27 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 174.931 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -73.46 -34.71 65.51 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.483 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -85.35 -51.46 6.55 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.161 0.801 . . . . 0.0 113.161 -175.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.0 pt -118.48 -29.11 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -173.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.534 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.95 143.91 6.21 Favored Glycine 0 N--CA 1.438 -1.186 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.0 tp -61.33 -37.16 76.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 122.44 0.296 . . . . 0.0 111.243 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -65.02 -35.5 81.38 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.627 -177.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.617 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.4 t-20 -67.73 -45.53 74.74 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.824 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.1 t -66.77 -38.22 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.626 -177.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.454 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 47.3 t-20 -50.78 -50.0 56.99 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.126 0.97 . . . . 0.0 108.898 177.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -40.84 81.96 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.109 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 81.5 mt -61.16 -42.01 97.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.528 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.6 mm -64.42 -44.47 97.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 177.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 80.9 mt -61.38 -34.71 75.78 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.267 0.556 . . . . 0.0 110.948 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.8 m -66.47 -46.33 76.72 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.235 177.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.6 m -64.27 -35.28 80.32 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.436 0.694 . . . . 0.0 111.864 -175.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.571 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 26.5 pt -82.51 -19.08 10.56 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.506 ' HD2' ' CE1' ' A' ' 21' ' ' PHE . 56.1 mtpt -104.36 -59.95 1.66 Allowed 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.271 -0.572 . . . . 0.0 112.02 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 96.9 mt 63.94 20.99 12.46 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.055 0.942 . . . . 0.0 111.203 -174.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -64.78 -56.71 11.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.618 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -134.02 143.86 48.35 Favored 'General case' 0 CA--C 1.503 -0.865 0 C-N-CA 120.466 -0.494 . . . . 0.0 109.684 176.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -85.96 130.9 34.4 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 123.469 0.481 . . . . 0.0 110.151 178.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -78.93 57.42 2.15 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -175.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -159.07 -60.57 0.07 Allowed 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.766 -0.774 . . . . 0.0 109.946 177.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -77.46 82.9 3.89 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.04 0.924 . . . . 0.0 111.741 179.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 . . . . . 0 C--N 1.291 -1.952 0 N-CA-C 104.98 -2.23 . . . . 0.0 104.98 178.588 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.1 mtt . . . . . 0 C--O 1.239 0.551 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.5 t -136.8 81.65 1.89 Allowed 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 tp -132.79 -19.15 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.634 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 98.3 mt -77.94 13.43 1.4 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.295 0.569 . . . . 0.0 111.914 -178.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -86.39 -5.57 59.14 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.84 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -113.95 131.43 23.14 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 112.727 0.639 . . . . 0.0 112.727 -177.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.495 ' O ' HG13 ' A' ' 10' ' ' VAL . 7.2 Cg_exo -71.85 -24.6 21.0 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.462 2.774 . . . . 0.0 113.866 176.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.34 -38.52 74.87 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -178.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -59.81 -38.84 83.13 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.581 176.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 7' ' ' PRO . 8.6 p -69.49 -33.85 59.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.171 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.12 -36.42 79.67 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 175.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.411 HD23 ' CD1' ' A' ' 62' ' ' PHE . 98.0 mt -63.71 -41.93 98.02 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.139 0.495 . . . . 0.0 110.424 176.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -64.04 -30.65 71.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.7 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -79.62 -25.96 41.3 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.71 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -69.05 -42.95 75.62 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 178.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm 74.26 -174.36 0.14 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.928 1.291 . . . . 0.0 111.81 176.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.97 59.05 4.28 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 116.233 -0.44 . . . . 0.0 114.107 -176.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -82.87 -13.38 56.24 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.794 0.807 . . . . 0.0 109.382 174.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.506 HG11 ' CD2' ' A' ' 62' ' ' PHE . 24.7 m -90.75 164.18 2.17 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.97 -178.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.455 ' O ' HG22 ' A' ' 24' ' ' VAL . 18.3 t-20 -87.86 115.87 25.62 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.111 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.467 ' CE2' ' HD2' ' A' ' 91' ' ' LYS . 60.4 t80 -51.76 -38.44 55.47 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.462 0.476 . . . . 0.0 111.665 -178.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -72.88 -36.06 67.26 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.406 -172.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.61 ' O ' HG12 ' A' ' 27' ' ' ILE . 25.8 tp -76.64 -39.1 53.4 Favored 'General case' 0 N--CA 1.415 -2.196 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.987 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.463 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 72.8 t -57.84 -46.65 87.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 174.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 54.6 ttp -58.13 -40.0 80.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.055 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 -68.91 -41.06 78.73 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.229 175.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.61 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.3 mm -57.02 -51.93 62.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 177.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.7 mt -62.39 -38.09 88.28 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 114.515 -1.221 . . . . 0.0 110.541 -179.099 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -69.09 -46.16 68.45 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.136 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -61.86 -43.29 99.15 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.159 -176.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.401 ' CD1' HD12 ' A' ' 70' ' ' LEU . 39.4 pt -71.5 -38.73 69.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.599 177.103 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.479 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 37.3 tt0 -59.03 -52.97 63.45 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 123.082 0.553 . . . . 0.0 111.363 -179.175 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.419 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.6 pp -58.36 -37.35 75.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 120.823 0.344 . . . . 0.0 111.527 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.419 ' N ' HD12 ' A' ' 33' ' ' LEU . 27.8 t70 -73.78 -45.96 48.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.208 0.528 . . . . 0.0 110.328 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 55.1 tp -66.44 -23.5 66.3 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.513 -177.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 77.3 mtp180 -69.21 -7.74 39.38 Favored 'General case' 0 C--N 1.308 -1.231 0 O-C-N 121.312 -0.867 . . . . 0.0 112.338 177.163 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -126.89 23.28 5.61 Favored Glycine 0 N--CA 1.442 -0.908 0 N-CA-C 111.597 -0.601 . . . . 0.0 111.597 174.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 t -158.81 175.1 14.01 Favored 'General case' 0 C--O 1.216 -0.673 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -175.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -121.91 -11.69 8.5 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 121.905 0.859 . . . . 0.0 108.925 173.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -81.37 67.22 7.23 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.283 -178.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.434 HD12 ' HA ' ' A' ' 71' ' ' GLN . 9.7 tt -61.5 -30.95 49.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.274 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.529 ' O ' HG13 ' A' ' 46' ' ' ILE . 20.5 ptmt -67.94 -33.66 75.1 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 119.464 -0.895 . . . . 0.0 110.372 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.6 m -72.9 -33.69 66.18 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.469 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 14.0 m -62.05 -44.95 95.58 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 173.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.482 ' HB ' ' O ' ' A' ' 42' ' ' LYS . 27.6 mm -52.94 -48.45 51.6 Favored 'Isoleucine or valine' 0 C--N 1.344 0.351 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.468 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 42' ' ' LYS . 72.0 mt -55.38 -49.73 70.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.726 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.469 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 13.1 m-85 -58.43 -45.16 89.03 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 122.256 1.027 . . . . 0.0 110.481 -178.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 44' ' ' SER . 57.8 t -73.12 -49.26 39.66 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.771 0 CA-C-N 114.248 -1.342 . . . . 0.0 111.308 -173.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -63.5 -35.91 82.02 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.522 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.7 p -73.59 -22.18 60.12 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.068 0.461 . . . . 0.0 111.718 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.6 t -90.45 -25.95 20.08 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.651 0.739 . . . . 0.0 110.134 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.485 ' O ' HG12 ' A' ' 56' ' ' ILE . 81.2 m-70 -118.7 36.61 4.35 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 121.911 -0.493 . . . . 0.0 109.894 -175.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.5 mt -48.7 -44.11 37.74 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -175.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -56.61 -45.35 81.49 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 123.27 0.356 . . . . 0.0 111.936 -175.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -67.36 -44.77 78.18 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.621 0.724 . . . . 0.0 109.625 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 52' ' ' HIS . 45.6 mm -59.59 -46.57 92.99 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.862 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.294 -176.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -72.61 -24.56 61.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.898 0.38 . . . . 0.0 111.095 -178.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -72.78 -46.52 52.9 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.553 0.692 . . . . 0.0 109.47 -177.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.485 ' HB2' ' CE2' ' A' ' 63' ' ' TYR . 4.6 m120 -117.37 46.33 1.73 Allowed 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 -177.105 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.66 -34.59 18.84 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.114 1.366 . . . . 0.0 114.56 -173.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -67.09 -48.28 68.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.394 0.616 . . . . 0.0 110.311 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.506 ' CD2' HG11 ' A' ' 19' ' ' VAL . 85.4 t80 -64.03 -51.3 64.85 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.811 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.485 ' CE2' ' HB2' ' A' ' 59' ' ' ASN . 82.1 m-85 -66.22 -26.15 67.25 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -175.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.42 -47.24 17.95 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 119.442 -0.903 . . . . 0.0 111.051 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.3 mtm -65.74 -36.09 82.58 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.073 -178.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.46 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 41.2 pt -67.19 -38.33 80.87 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.669 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.33 175.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.52 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -57.27 -42.02 80.83 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.918 0.39 . . . . 0.0 110.139 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -62.04 -56.47 18.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.013 176.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 99.2 mt -60.97 -40.87 86.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.686 0.795 . . . . 0.0 112.403 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.494 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 88.2 mt -55.1 -49.64 71.21 Favored 'General case' 0 C--O 1.212 -0.906 0 C-N-CA 123.208 0.603 . . . . 0.0 112.015 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 49.4 mt-30 -69.02 -50.25 50.45 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 122.101 0.953 . . . . 0.0 109.361 -178.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -55.88 -47.13 77.94 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.137 -1.847 . . . . 0.0 111.901 -176.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -88.87 -15.93 33.21 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.494 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.79 -32.95 73.88 Favored 'General case' 0 N--CA 1.439 -0.989 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.775 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -69.15 -28.21 66.23 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.427 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -90.81 -52.17 5.0 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.9 pt -119.2 -27.67 2.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.5 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 120.62 144.12 6.98 Favored Glycine 0 C--N 1.305 -1.161 0 C-N-CA 120.411 -0.899 . . . . 0.0 110.872 178.2 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.3 tp -61.56 -38.5 80.36 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 C-N-CA 122.44 0.296 . . . . 0.0 111.739 -174.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -55.84 -44.28 77.83 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 122.541 1.162 . . . . 0.0 109.706 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.511 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 51.0 m-80 -67.64 -44.34 78.18 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 113.557 -1.656 . . . . 0.0 110.982 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.5 HG21 ' O ' ' A' ' 78' ' ' GLY . 17.9 t -67.69 -39.87 82.92 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.175 -177.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -55.76 -45.37 78.09 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.276 0.56 . . . . 0.0 110.779 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -41.75 95.5 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 89.1 mt -62.13 -42.14 98.95 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.423 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 82' ' ' VAL . 51.1 mm -63.96 -39.12 84.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.887 0.375 . . . . 0.0 110.094 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.88 -39.44 94.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.404 0.621 . . . . 0.0 110.109 176.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 27.3 m -66.89 -33.82 76.44 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.103 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 47.3 m -60.76 -42.88 98.34 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.905 0.882 . . . . 0.0 111.12 -178.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 23.7 pt -86.51 -15.04 10.18 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.088 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.467 ' HD2' ' CE2' ' A' ' 21' ' ' PHE . 9.3 mtpm? -89.66 76.34 7.31 Favored 'General case' 0 N--CA 1.437 -1.113 0 C-N-CA 120.026 -0.67 . . . . 0.0 112.286 179.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.56 87.88 5.72 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 104.978 -2.23 . . . . 0.0 104.978 169.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -138.64 161.44 37.11 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-N 115.039 -0.982 . . . . 0.0 108.755 -169.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 58.4 m-70 66.15 44.8 2.49 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 124.223 1.009 . . . . 0.0 109.865 -177.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -66.68 -31.77 72.65 Favored 'General case' 0 CA--C 1.501 -0.907 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 176.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -84.8 102.7 13.25 Favored 'General case' 0 N--CA 1.422 -1.87 0 N-CA-C 103.253 -2.869 . . . . 0.0 103.253 168.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -67.9 85.91 0.23 Allowed 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 122.131 0.967 . . . . 0.0 112.255 -173.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -127.2 117.9 23.23 Favored 'General case' 0 N--CA 1.409 -2.502 0 CA-C-N 113.818 -1.537 . . . . 0.0 107.408 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 6.9 p80 . . . . . 0 C--N 1.285 -2.216 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 178.767 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 mmt . . . . . 0 CA--C 1.521 -0.165 0 CA-C-O 120.932 0.396 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.2 m -97.41 -14.51 21.16 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.543 0.687 . . . . 0.0 110.051 177.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 18.7 tt -86.42 13.82 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.562 1.407 0 CA-C-O 122.159 0.98 . . . . 0.0 111.308 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.4 mt -75.76 -4.06 38.4 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.232 -0.918 . . . . 0.0 110.472 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -74.95 -7.79 54.6 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.634 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.521 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 15.1 t70 -94.43 120.16 65.5 Favored Pre-proline 0 N--CA 1.439 -1.001 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.541 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 26.5 Cg_exo -63.12 -30.6 75.45 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 123.067 2.512 . . . . 0.0 113.23 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.39 -41.75 46.76 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -178.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -57.29 -46.21 83.38 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.684 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.0 p -64.42 -34.57 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.67 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.541 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 64.1 mttp -62.63 -44.66 95.72 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 175.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.7 mt -58.45 -42.11 86.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.804 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -59.67 -37.19 78.08 Favored 'General case' 0 N--CA 1.476 0.838 0 O-C-N 123.444 0.465 . . . . 0.0 111.21 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -79.68 -40.64 28.57 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.817 -179.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -73.86 -54.46 7.94 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.04 -0.982 . . . . 0.0 112.973 -174.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 88.0 tttt 66.77 124.52 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.577 1.151 . . . . 0.0 109.157 -171.438 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.81 -9.26 25.98 Favored Glycine 0 C--O 1.215 -1.052 0 N-CA-C 118.074 1.99 . . . . 0.0 118.074 -168.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 16' ' ' LYS . 42.8 mtpt 65.62 7.36 4.39 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 118.193 0.996 . . . . 0.0 111.805 176.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 6.5 m -109.98 168.97 3.81 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 C-N-CA 124.337 1.055 . . . . 0.0 110.39 -178.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -67.85 133.53 49.33 Favored 'General case' 0 C--N 1.309 -1.194 0 O-C-N 124.109 0.881 . . . . 0.0 109.1 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -57.16 -39.76 75.9 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.417 0.627 . . . . 0.0 110.63 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -72.09 -29.19 63.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.552 -175.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.515 HD22 ' CD ' ' A' ' 55' ' ' GLU . 61.0 tp -70.24 -45.26 66.84 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.676 178.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.86 -40.84 88.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 41.5 ttm -57.31 -41.54 80.09 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.23 174.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -66.85 -43.05 84.65 Favored 'General case' 0 C--O 1.208 -1.126 0 O-C-N 123.217 0.323 . . . . 0.0 110.92 177.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.463 HD12 ' OE2' ' A' ' 55' ' ' GLU . 47.3 mm -56.97 -50.04 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.319 0.58 . . . . 0.0 109.839 178.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.8 mt -63.56 -42.07 98.38 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.893 -1.048 . . . . 0.0 110.534 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -62.96 -46.23 88.73 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 123.719 0.808 . . . . 0.0 110.458 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -63.68 -47.79 79.82 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.77 -177.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.402 ' CD1' HD12 ' A' ' 70' ' ' LEU . 38.2 pt -66.67 -40.4 86.07 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.077 178.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.04 -46.45 89.5 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 123.585 0.754 . . . . 0.0 111.641 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.406 HD11 ' N ' ' A' ' 34' ' ' ASP . 4.3 pp -60.07 -37.32 79.54 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -177.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.406 ' N ' HD11 ' A' ' 33' ' ' LEU . 20.1 t70 -76.06 -51.09 13.01 Favored 'General case' 0 CA--C 1.508 -0.646 0 O-C-N 123.412 0.445 . . . . 0.0 110.306 177.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.435 HD21 ' CD2' ' A' ' 74' ' ' TYR . 57.0 tp -57.84 -31.97 67.16 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.683 1.193 . . . . 0.0 113.322 -175.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -74.62 -12.53 60.47 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 121.185 0.516 . . . . 0.0 110.564 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -106.96 -33.61 3.2 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 110.807 -0.917 . . . . 0.0 110.807 176.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 p -95.07 -151.13 0.32 Allowed 'General case' 0 CA--C 1.558 1.278 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 178.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -142.66 -40.42 0.33 Allowed 'General case' 0 C--O 1.243 0.724 0 O-C-N 121.757 -0.59 . . . . 0.0 111.59 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -81.62 95.15 7.09 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 -178.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.516 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.7 tt -58.86 -30.91 43.85 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.786 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.764 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.499 ' O ' HG13 ' A' ' 46' ' ' ILE . 21.0 ptmt -63.44 -34.45 77.77 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.182 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.1 m -76.65 -33.09 58.32 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.501 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 13.2 m -63.52 -40.38 96.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.516 HG12 ' O ' ' A' ' 41' ' ' ILE . 36.1 mm -54.87 -48.37 74.33 Favored 'Isoleucine or valine' 0 C--N 1.346 0.446 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.199 174.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 42' ' ' LYS . 72.7 mt -53.89 -48.69 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.438 -178.289 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.501 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 18.5 m-85 -58.89 -53.01 63.27 Favored 'General case' 0 C--O 1.244 0.788 0 CA-C-O 121.225 0.536 . . . . 0.0 109.844 -177.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.4 t -62.44 -49.81 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.543 -176.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -65.55 -33.96 77.15 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 39.9 m -75.42 -21.93 57.81 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.918 0.389 . . . . 0.0 111.917 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.9 t -93.53 -8.81 40.31 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.973 0.892 . . . . 0.0 109.429 179.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.549 ' O ' HG12 ' A' ' 56' ' ' ILE . 35.6 m-70 -126.46 30.96 5.46 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.158 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.2 mt -48.85 -56.55 8.4 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -170.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.603 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 17.3 t70 -62.27 -44.08 97.36 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.42 -175.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.528 ' HB3' ' O ' ' A' ' 52' ' ' HIS . 26.7 tt0 -53.81 -51.22 64.2 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 124.819 1.248 . . . . 0.0 110.111 175.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 52' ' ' HIS . 51.7 mm -58.57 -44.25 88.97 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.721 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.241 177.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 -65.12 -33.66 76.54 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 178.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.603 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 66.4 mttm -56.85 -47.52 80.18 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.074 0.464 . . . . 0.0 109.778 178.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -127.67 65.42 1.34 Allowed 'General case' 0 C--N 1.317 -0.848 0 CA-C-O 121.982 0.896 . . . . 0.0 110.429 -178.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -66.09 -33.66 76.3 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 114.534 -1.212 . . . . 0.0 112.605 -176.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -65.03 -47.1 78.61 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.279 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -62.5 -52.14 64.65 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.294 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.455 ' CD2' ' HA ' ' A' ' 56' ' ' ILE . 45.0 m-85 -66.82 -30.54 70.75 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -176.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -78.6 -40.12 35.43 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.975 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.6 mtm -63.63 -43.16 97.65 Favored 'General case' 0 CA--C 1.502 -0.886 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.654 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.498 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 36.8 pt -64.68 -38.54 82.93 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.246 0 C-N-CA 119.39 -0.924 . . . . 0.0 111.369 178.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.55 -34.0 68.7 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 121.205 0.526 . . . . 0.0 111.368 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -69.1 -54.49 14.7 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.2 mt -59.95 -44.1 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.269 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.57 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.2 mt -53.31 -51.76 61.33 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 123.451 0.701 . . . . 0.0 111.588 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -65.41 -43.48 90.43 Favored 'General case' 0 C--O 1.257 1.458 0 CA-C-O 121.377 0.608 . . . . 0.0 110.802 -178.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -60.26 -49.03 79.21 Favored 'General case' 0 N--CA 1.426 -1.647 0 C-N-CA 124.538 1.135 . . . . 0.0 111.767 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.521 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 87.7 m-85 -91.61 -15.1 29.08 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.57 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.07 -32.24 73.58 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.829 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -72.83 -24.26 60.87 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.531 175.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -98.01 -51.79 3.92 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -172.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.3 pt -110.75 -29.52 2.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.254 0 C-N-CA 119.898 -0.721 . . . . 0.0 112.478 -176.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.5 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 123.19 147.53 7.37 Favored Glycine 0 C--N 1.306 -1.106 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.5 tp -63.81 -35.62 73.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.949 0.374 . . . . 0.0 111.637 -176.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.98 -44.52 94.44 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 122.282 1.039 . . . . 0.0 109.966 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.467 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 18.1 m120 -64.47 -45.71 86.2 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.772 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.5 HG21 ' O ' ' A' ' 78' ' ' GLY . 21.4 t -66.72 -38.1 80.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 -52.92 -50.17 64.5 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.416 1.087 . . . . 0.0 109.38 177.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -44.24 81.47 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.208 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.7 mt -61.41 -44.39 97.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.14 -178.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.0 mm -62.96 -37.84 80.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 120.853 0.359 . . . . 0.0 110.343 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.428 ' O ' ' HG2' ' A' ' 91' ' ' LYS . 81.8 mt -62.31 -44.95 95.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.525 0.679 . . . . 0.0 110.399 176.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.3 m -64.31 -33.34 75.6 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.073 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.7 m -58.77 -45.7 89.18 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.668 0.787 . . . . 0.0 111.581 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 33.9 pt -82.29 -9.36 11.75 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 CA-C-O 120.967 0.413 . . . . 0.0 111.869 -178.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 87' ' ' LEU . 32.0 mmmt -85.67 102.13 13.33 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 173.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -76.16 -41.48 49.68 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 46.13 99.92 0.01 OUTLIER 'General case' 0 C--O 1.239 0.502 0 C-N-CA 125.953 1.701 . . . . 0.0 115.141 173.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 37.6 m80 -74.11 164.05 27.1 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.525 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 86.2 t60 81.56 -13.96 0.84 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.621 1.168 . . . . 0.0 112.379 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -89.07 159.28 17.63 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 171.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 43.6 m-70 -79.27 99.86 7.27 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -87.92 -14.06 40.27 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 169.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 . . . . . 0 N--CA 1.43 -1.449 0 C-N-CA 127.206 2.202 . . . . 0.0 105.413 174.209 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.611 0 N-CA-C 111.388 0.144 . . . . 0.0 111.388 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m -89.51 167.42 12.99 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.1 tp -102.21 -25.01 3.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 C-N-CA 119.741 -0.783 . . . . 0.0 110.507 -178.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.5 mt -82.3 13.37 3.59 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.586 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -98.53 2.84 47.92 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 120.779 0.323 . . . . 0.0 110.818 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.539 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 10.2 t70 -111.1 131.92 21.95 Favored Pre-proline 0 C--N 1.315 -0.931 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.694 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.475 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 17.3 Cg_exo -64.34 -31.75 62.2 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.42 2.08 . . . . 0.0 113.094 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.83 -32.62 61.99 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.833 -175.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -69.59 -42.92 73.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.577 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.52 -34.19 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.322 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.7 mttt -60.23 -45.39 93.38 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.394 175.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.7 mt -56.55 -40.84 75.81 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.566 0.541 . . . . 0.0 111.871 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -71.0 -29.77 65.82 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.492 -177.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -79.99 -35.33 37.62 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -61.52 -44.1 97.66 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 125.178 1.391 . . . . 0.0 110.224 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.4 mttm 77.16 154.27 0.15 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.242 1.417 . . . . 0.0 111.774 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -87.87 89.96 1.64 Allowed Glycine 0 N--CA 1.426 -2.024 0 C-N-CA 120.357 -0.925 . . . . 0.0 110.973 178.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.66 -1.52 56.2 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.933 0.397 . . . . 0.0 110.849 177.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.4 m -98.24 163.86 2.5 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 175.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -63.5 130.26 43.62 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 122.632 0.373 . . . . 0.0 110.961 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -56.62 -39.45 73.63 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 123.461 0.704 . . . . 0.0 110.451 177.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.426 ' N ' HD21 ' A' ' 22' ' ' ASN . 0.8 OUTLIER -71.47 -28.82 64.2 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.193 -176.05 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.53 ' O ' HG12 ' A' ' 27' ' ' ILE . 59.3 tp -71.48 -49.43 41.33 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.33 178.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.437 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 47.5 t -63.03 -42.3 96.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.6 ttp -57.19 -39.85 76.18 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.056 177.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -69.82 -41.64 74.72 Favored 'General case' 0 C--O 1.215 -0.729 0 O-C-N 123.292 0.37 . . . . 0.0 111.11 177.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.7 mm -56.87 -47.6 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 177.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 79.5 mt -66.58 -42.49 86.88 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.469 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.05 -43.28 96.01 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 123.27 0.628 . . . . 0.0 110.639 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -61.64 -44.22 97.38 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.833 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.2 pt -72.79 -35.06 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.855 177.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -60.7 -49.11 78.81 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 123.648 0.779 . . . . 0.0 110.719 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 pp -69.41 -28.89 66.55 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.972 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -76.29 -49.55 16.7 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.015 0.436 . . . . 0.0 111.951 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 43.2 tp -75.03 -55.27 5.91 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.756 -176.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 70.37 -79.81 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 125.91 1.684 . . . . 0.0 111.545 -177.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -92.39 -66.42 1.11 Allowed Glycine 0 N--CA 1.433 -1.553 0 C-N-CA 119.984 -1.103 . . . . 0.0 112.635 -176.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.8 t 174.14 145.84 0.06 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.66 0.784 . . . . 0.0 109.571 -174.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.5 t70 179.64 -86.45 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.643 1.177 . . . . 0.0 108.7 177.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -138.55 92.65 2.65 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.456 ' O ' HG12 ' A' ' 45' ' ' ILE . 13.3 tt -72.35 -27.87 27.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.291 -176.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.595 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.2 ptmt -60.74 -36.42 78.85 Favored 'General case' 0 C--O 1.211 -0.921 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.274 177.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.8 m -69.84 -37.81 76.28 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.486 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 34.7 m -64.83 -40.69 95.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 175.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 41' ' ' ILE . 38.6 mm -55.46 -49.1 75.69 Favored 'Isoleucine or valine' 0 C--N 1.345 0.373 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 174.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.595 HG13 ' O ' ' A' ' 42' ' ' LYS . 78.4 mt -53.5 -50.84 46.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.702 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.486 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 15.5 m-85 -57.82 -43.39 85.73 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.79 0.805 . . . . 0.0 111.078 -176.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.0 t -73.95 -46.88 44.88 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.877 -175.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -69.74 -27.43 64.95 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 122.775 0.43 . . . . 0.0 111.86 -178.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.5 p -79.48 -22.33 44.22 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.7 t -95.08 -36.54 11.48 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.781 0.8 . . . . 0.0 109.89 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.602 ' O ' HG12 ' A' ' 56' ' ' ILE . 78.9 m-70 -92.54 42.41 1.1 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.018 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -48.82 -48.02 41.87 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 125.353 1.461 . . . . 0.0 114.403 -175.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -61.3 -45.62 93.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 120.874 0.368 . . . . 0.0 111.417 -174.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.457 ' CG ' HD22 ' A' ' 23' ' ' LEU . 1.7 mp0 -55.4 -53.12 60.2 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 123.879 0.871 . . . . 0.0 110.22 176.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 52' ' ' HIS . 34.3 mm -60.91 -47.04 95.19 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-N 113.727 -1.579 . . . . 0.0 111.289 -176.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -69.95 -28.22 65.39 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -72.59 -49.25 33.57 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.24 0.543 . . . . 0.0 111.168 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -118.93 60.34 0.81 Allowed 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 122.071 0.938 . . . . 0.0 109.742 -176.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -55.35 -37.63 67.74 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 113.466 -1.697 . . . . 0.0 112.487 -176.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.409 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER -78.44 -31.73 48.21 Favored 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -176.307 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -68.04 -51.15 50.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.428 ' HA ' HG12 ' A' ' 66' ' ' ILE . 84.9 m-85 -69.08 -31.25 69.86 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.064 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.44 -51.11 64.81 Favored 'General case' 0 C--O 1.245 0.834 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.104 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 72.8 mtm -65.43 -39.6 92.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.41 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.566 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 36.8 pt -66.93 -43.21 89.47 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 C-N-CA 118.367 -1.333 . . . . 0.0 111.024 177.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.14 -39.7 75.69 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.817 0.341 . . . . 0.0 110.756 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -58.69 -56.2 25.23 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.607 176.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.5 mt -65.88 -39.62 85.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 123.985 0.914 . . . . 0.0 112.946 -176.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.597 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 96.6 mt -53.36 -46.98 69.8 Favored 'General case' 0 C--O 1.217 -0.614 0 C-N-CA 122.615 0.366 . . . . 0.0 111.445 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -72.53 -49.16 34.61 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 122.304 1.049 . . . . 0.0 109.784 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 19.6 ttt180 -53.45 -42.03 66.74 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 127.194 2.197 . . . . 0.0 111.725 -176.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.539 ' OH ' ' HB2' ' A' ' 6' ' ' ASP . 55.6 m-85 -100.48 -14.36 18.3 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -178.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.597 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.71 -28.4 68.4 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.636 -0.826 . . . . 0.0 109.781 178.64 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -74.96 -19.45 60.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.511 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -97.79 -50.31 4.49 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -174.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.8 pt -118.73 -29.81 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.531 ' O ' HG22 ' A' ' 82' ' ' VAL . . . 125.61 146.69 6.78 Favored Glycine 0 CA--C 1.5 -0.852 0 C-N-CA 120.299 -0.953 . . . . 0.0 110.893 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.3 tp -64.61 -38.72 83.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.972 0.386 . . . . 0.0 111.798 -175.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -59.22 -38.96 81.21 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.943 0.878 . . . . 0.0 110.133 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.436 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 1.8 m-20 -69.35 -48.57 60.97 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.354 -1.294 . . . . 0.0 109.774 -179.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 78' ' ' GLY . 21.9 t -62.9 -43.09 98.71 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.294 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.581 -177.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.422 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 95.5 m-20 -56.46 -44.9 80.97 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.094 0.474 . . . . 0.0 110.778 178.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -40.36 90.48 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.2 mt -65.26 -40.26 93.73 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.336 179.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.5 mm -62.81 -43.64 98.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 177.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.545 ' O ' ' HG2' ' A' ' 91' ' ' LYS . 87.7 mt -59.69 -44.52 93.61 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.62 176.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.4 m -62.08 -34.22 75.87 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 121.233 0.539 . . . . 0.0 110.877 178.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 76.7 m -70.82 -31.91 68.79 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 123.177 0.591 . . . . 0.0 111.905 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.5 pt -92.97 -2.41 10.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.383 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 87' ' ' LEU . 29.8 mmmt -73.06 68.15 0.93 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.92 0.867 . . . . 0.0 113.044 176.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -129.41 126.52 38.99 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 104.82 -2.289 . . . . 0.0 104.82 172.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.47 ' C ' ' H ' ' A' ' 95' ' ' HIS . 34.0 tt0 -65.5 145.36 56.2 Favored 'General case' 0 C--N 1.297 -1.681 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.031 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 97' ' ' HIS . 44.5 m170 -78.97 35.64 0.26 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.321 0.581 . . . . 0.0 110.404 178.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.47 ' H ' ' C ' ' A' ' 93' ' ' GLU . 3.7 t60 -68.76 109.86 4.05 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 105.912 -1.885 . . . . 0.0 105.912 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 64.77 89.09 0.1 Allowed 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -166.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 94' ' ' HIS . 8.8 p80 -105.45 123.65 48.24 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -171.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 23.9 t60 -79.12 -15.45 58.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.937 0.875 . . . . 0.0 108.703 176.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 41.5 t-80 . . . . . 0 C--N 1.303 -1.446 0 N-CA-C 104.905 -2.257 . . . . 0.0 104.905 173.988 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 120.271 0.082 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.5 m -77.09 108.05 9.9 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.403 ' CG2' HD11 ' A' ' 85' ' ' LEU . 20.4 tt -142.79 -12.6 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.161 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.785 -177.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.24 -9.53 24.53 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.193 0.521 . . . . 0.0 111.491 178.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -66.86 -25.8 66.59 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 123.938 0.895 . . . . 0.0 109.818 177.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.458 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 13.8 t70 -75.76 128.17 84.15 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.601 -175.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.538 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 38.8 Cg_exo -62.38 -34.69 76.17 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.76 2.307 . . . . 0.0 113.206 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -76.21 -34.5 59.26 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.666 0.746 . . . . 0.0 109.598 -178.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -64.47 -41.36 96.55 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.63 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.27 -33.77 65.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 C-N-CA 120.595 -0.442 . . . . 0.0 109.962 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.3 mttt -61.05 -43.27 99.14 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 174.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.0 mt -56.64 -42.58 79.14 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.014 0.525 . . . . 0.0 111.245 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.1 mmt180 -59.47 -39.37 83.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.155 178.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -80.19 -30.99 38.82 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.262 -179.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -79.9 -46.46 16.76 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 123.837 0.855 . . . . 0.0 112.38 -175.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt 68.84 134.55 0.03 OUTLIER 'General case' 0 C--O 1.248 1.005 0 C-N-CA 124.397 1.079 . . . . 0.0 111.502 -177.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -94.2 114.87 4.88 Favored Glycine 0 N--CA 1.414 -2.812 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 177.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.449 ' N ' ' HD3' ' A' ' 18' ' ' LYS . 3.6 mppt? -91.02 30.5 1.21 Allowed 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 122.547 1.165 . . . . 0.0 109.201 178.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 16.5 m -98.75 158.4 3.52 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.23 0 CA-C-N 113.946 -1.479 . . . . 0.0 109.543 -178.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.413 ' O ' HG23 ' A' ' 24' ' ' VAL . 49.7 t-20 -66.71 125.27 25.3 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -54.1 -37.42 64.27 Favored 'General case' 0 C--N 1.321 -0.658 0 O-C-N 123.955 0.785 . . . . 0.0 111.091 178.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -68.11 -36.62 80.04 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.137 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.632 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.3 tp -76.45 -39.13 54.2 Favored 'General case' 0 N--CA 1.416 -2.148 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.186 -177.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 20' ' ' ASN . 61.8 t -58.17 -48.07 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 176.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 48.4 ttp -58.29 -40.47 82.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.331 177.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -70.65 -36.2 73.28 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.396 178.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.632 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -58.93 -51.74 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 176.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 78.1 mt -60.66 -38.14 83.89 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.613 -179.326 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -71.15 -47.14 59.53 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.925 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.414 ' OE2' HG23 ' A' ' 48' ' ' VAL . 15.4 tt0 -63.46 -42.9 98.63 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.375 -176.563 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 32.5 pt -68.67 -37.63 77.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.696 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.931 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.37 -52.5 65.38 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 123.203 0.601 . . . . 0.0 111.48 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.98 -29.26 69.62 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.208 -177.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -76.21 -46.91 26.05 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.004 0.43 . . . . 0.0 110.476 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 20.7 tp -60.99 -60.51 3.68 Favored 'General case' 0 C--O 1.253 1.243 0 C-N-CA 124.223 1.009 . . . . 0.0 112.451 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 66.22 -51.02 0.42 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.741 1.217 . . . . 0.0 112.171 -173.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 147.78 -26.75 1.47 Allowed Glycine 0 C--N 1.296 -1.656 0 N-CA-C 108.336 -1.906 . . . . 0.0 108.336 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.3 p -75.15 -43.33 53.03 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 114.243 -0.979 . . . . 0.0 112.624 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -91.61 -162.66 0.94 Allowed 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.453 ' HB3' ' OG1' ' A' ' 43' ' ' THR . 28.4 t-20 -107.9 127.54 53.83 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-N 118.807 0.73 . . . . 0.0 109.227 -175.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.5 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.4 tt -63.0 -35.59 72.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 O-C-N 123.481 0.488 . . . . 0.0 111.73 -178.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.471 ' O ' HG13 ' A' ' 46' ' ' ILE . 65.2 pttt -69.28 -28.41 66.27 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.836 -178.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.453 ' OG1' ' HB3' ' A' ' 40' ' ' ASN . 26.0 m -71.33 -43.8 66.33 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.353 -0.84 . . . . 0.0 108.966 177.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.4 m -59.52 -40.61 87.68 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.092 176.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 41' ' ' ILE . 26.7 mm -51.66 -45.66 37.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.948 0.899 . . . . 0.0 110.108 175.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 42' ' ' LYS . 70.2 mt -56.85 -51.8 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.441 -177.244 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -60.57 -43.86 96.83 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.432 0.634 . . . . 0.0 110.871 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.414 HG23 ' OE2' ' A' ' 30' ' ' GLU . 46.6 t -69.15 -45.96 78.79 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.023 -174.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -68.05 -37.94 81.9 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.259 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 75.7 p -70.51 -21.46 62.74 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.119 0.485 . . . . 0.0 112.033 -178.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.3 t -92.86 -48.14 6.69 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.972 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.464 ' O ' HG12 ' A' ' 56' ' ' ILE . 86.2 m-70 -96.15 41.07 1.11 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 -174.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.449 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 85.6 mt -47.66 -41.32 22.04 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.679 1.592 . . . . 0.0 114.386 -175.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -53.56 -52.93 58.16 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.556 0.535 . . . . 0.0 112.431 -172.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -73.56 -34.06 64.97 Favored 'General case' 0 C--O 1.249 1.063 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.263 -176.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.52 ' HA ' ' CD2' ' A' ' 63' ' ' TYR . 40.1 mm -59.4 -43.45 90.37 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.66 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.449 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 50.1 mtp180 -70.84 -28.09 64.34 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -60.71 -55.83 28.57 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-O 121.676 0.75 . . . . 0.0 110.447 174.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.3 m-80 -116.14 60.88 0.72 Allowed 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.514 -174.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -56.94 -36.65 70.49 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.544 -178.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -65.22 -39.47 92.81 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.682 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -64.6 -51.49 62.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.8 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.52 ' CD2' ' HA ' ' A' ' 56' ' ' ILE . 68.7 m-85 -68.72 -34.13 75.11 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -177.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -70.21 -45.49 66.48 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.858 0.361 . . . . 0.0 110.103 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.1 mtm -67.56 -41.74 83.74 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.244 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.487 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.7 pt -65.02 -35.96 76.69 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.013 0 C-N-CA 118.695 -1.202 . . . . 0.0 111.131 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.543 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -55.67 -44.56 77.38 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 123.409 0.443 . . . . 0.0 111.734 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -74.06 -37.96 64.09 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.375 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 90.3 mt -65.4 -42.42 93.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.543 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.6 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.6 mt -54.59 -46.13 73.73 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.728 178.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 64.2 mt-30 -62.34 -52.22 64.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.629 0.728 . . . . 0.0 109.828 179.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -58.9 -52.75 64.38 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.364 1.465 . . . . 0.0 112.403 -174.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.458 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 45.5 m-85 -83.99 -22.54 31.34 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -175.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.6 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.98 -30.79 71.0 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 118.993 -1.083 . . . . 0.0 109.709 176.814 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -73.89 -19.84 60.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.943 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -99.66 -51.28 3.79 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.0 pt -113.95 -29.66 2.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.053 0.454 . . . . 0.0 111.803 -174.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.487 ' O ' HG22 ' A' ' 82' ' ' VAL . . . 122.71 146.97 7.32 Favored Glycine 0 CA--C 1.491 -1.419 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 178.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tp -63.09 -35.91 73.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.938 0.369 . . . . 0.0 111.063 -175.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -55.36 -46.8 76.43 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-O 121.255 0.55 . . . . 0.0 110.729 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.452 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.0 t-20 -63.71 -49.49 72.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.237 -177.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 78' ' ' GLY . 20.6 t -62.59 -45.87 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.712 -175.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -53.83 -43.65 69.62 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.284 0.564 . . . . 0.0 111.26 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -44.46 78.59 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 84.6 mt -62.46 -38.07 88.39 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.637 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.4 mm -61.79 -41.94 92.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.09 -41.44 99.41 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.175 178.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.9 m -61.13 -34.29 74.74 Favored 'General case' 0 CA--C 1.555 1.161 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.985 176.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.452 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 36.5 m -63.4 -39.46 94.56 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 123.205 0.602 . . . . 0.0 111.453 -176.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 27.1 pt -91.35 -8.6 10.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-O 121.259 0.552 . . . . 0.0 111.748 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -98.44 27.74 4.57 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.723 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 89' ' ' THR . 0.7 OUTLIER -74.84 67.5 1.64 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 122.838 1.304 . . . . 0.0 111.142 172.608 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -85.03 123.23 30.33 Favored 'General case' 0 C--N 1.292 -1.892 0 CA-C-N 114.051 -1.431 . . . . 0.0 110.684 -175.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -58.49 120.29 8.55 Favored 'General case' 0 CA--C 1.517 -0.316 0 O-C-N 124.146 0.904 . . . . 0.0 110.605 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -101.14 81.62 2.25 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.423 -175.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 51.2 m80 -155.66 144.76 20.73 Favored 'General case' 0 CA--C 1.487 -1.48 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 172.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -140.35 78.04 1.64 Allowed 'General case' 0 C--N 1.285 -2.222 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -169.78 128.26 0.93 Allowed 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 . . . . . 0 C--N 1.305 -1.35 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 174.966 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.3 mmm . . . . . 0 CA--C 1.498 -1.036 0 CA-C-O 121.39 0.614 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.4 m -122.82 117.71 26.28 Favored 'General case' 0 C--N 1.287 -2.152 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 175.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 3' ' ' ILE . 14.2 tt -83.64 33.36 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.355 0 CA-C-O 123.548 1.642 . . . . 0.0 111.11 -173.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 93.4 mt -88.13 13.34 11.48 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.356 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.408 ' H ' ' C ' ' A' ' 3' ' ' ILE . 30.4 mt-10 -69.61 -22.21 63.52 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.638 1.575 . . . . 0.0 109.406 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.509 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 18.2 t70 -113.61 131.04 23.21 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.088 -0.96 . . . . 0.0 113.03 -174.332 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.97 -29.92 82.64 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.72 2.947 . . . . 0.0 113.95 177.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.98 -45.63 63.72 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -177.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -61.1 -44.83 96.76 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.313 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.2 p -62.62 -34.32 64.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 120.936 0.398 . . . . 0.0 110.65 -179.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.48 ' HE3' ' SD ' ' A' ' 65' ' ' MET . 55.8 mtmt -65.66 -43.26 89.9 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 122.221 -0.299 . . . . 0.0 110.697 173.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 94.9 mt -57.73 -38.63 75.63 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.117 0.484 . . . . 0.0 110.893 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -59.46 -40.52 87.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.426 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -80.2 -31.38 38.74 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.192 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.401 ' CE2' ' HB2' ' A' ' 62' ' ' PHE . 61.8 t80 -64.53 -26.82 68.59 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 125.145 1.378 . . . . 0.0 111.167 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 73.36 -47.92 0.67 Allowed 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.172 1.389 . . . . 0.0 112.209 177.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 132.71 -71.95 0.49 Allowed Glycine 0 N--CA 1.425 -2.054 0 C-N-CA 121.352 -0.451 . . . . 0.0 112.118 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.657 ' HB2' ' NZ ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER 60.11 32.28 20.9 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.533 1.133 . . . . 0.0 109.389 -173.085 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 29.3 m -120.55 168.55 12.82 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 CA-C-N 114.431 -1.259 . . . . 0.0 108.608 -178.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -86.06 128.4 34.86 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -57.08 -39.93 75.93 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 123.041 0.536 . . . . 0.0 111.998 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -72.56 -34.61 67.62 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -174.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.624 ' O ' HG12 ' A' ' 27' ' ' ILE . 38.5 tp -71.75 -41.92 67.86 Favored 'General case' 0 N--CA 1.425 -1.696 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.233 -177.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.434 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 91.0 t -66.18 -41.62 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 120.829 0.347 . . . . 0.0 110.098 178.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 50.7 ttp -61.23 -37.08 81.79 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.891 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -69.48 -40.62 76.95 Favored 'General case' 0 C--O 1.205 -1.239 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.545 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.6 mm -56.66 -47.17 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 94.1 mt -62.22 -44.79 95.77 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.996 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.92 -46.92 73.33 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.304 0.573 . . . . 0.0 110.503 -178.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -62.04 -40.84 97.09 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.102 -175.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.424 ' CD1' HD11 ' A' ' 70' ' ' LEU . 45.2 pt -72.98 -40.71 59.61 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.676 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.045 176.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.14 -49.7 76.17 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 122.98 0.512 . . . . 0.0 111.423 -178.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.47 -31.85 72.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.989 0.423 . . . . 0.0 111.154 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -75.35 -44.47 45.0 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 57.0 tp -50.21 -34.43 22.8 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.636 1.174 . . . . 0.0 112.807 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -69.63 -11.18 60.64 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -135.02 -8.02 1.92 Allowed Glycine 0 C--O 1.243 0.682 0 C-N-CA 120.169 -1.015 . . . . 0.0 113.201 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.6 t -87.55 -174.03 4.61 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 123.643 0.777 . . . . 0.0 109.141 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -94.05 -34.39 13.02 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -151.39 155.57 38.91 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -176.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.518 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.5 tt -67.98 -30.46 48.26 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 O-C-N 123.633 0.583 . . . . 0.0 110.628 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.448 ' O ' HG13 ' A' ' 46' ' ' ILE . 64.8 pttt -66.49 -34.61 78.31 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.668 178.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.2 m -64.25 -44.87 90.43 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 176.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.6 m -57.53 -41.66 81.33 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.643 176.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.518 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.0 mm -55.64 -44.78 78.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 123.476 0.71 . . . . 0.0 110.104 177.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 42' ' ' LYS . 68.3 mt -52.27 -51.05 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.372 0.669 . . . . 0.0 111.875 -178.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -63.72 -52.74 59.17 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.438 0.637 . . . . 0.0 110.716 -176.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.8 t -62.53 -43.4 98.35 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.039 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.402 ' CE2' ' HB3' ' A' ' 63' ' ' TYR . 2.1 m-85 -72.19 -31.51 65.96 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.286 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.423 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 29.2 t -73.78 -31.27 63.21 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.384 0.612 . . . . 0.0 109.377 177.182 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.6 t -73.51 -53.39 10.7 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.424 178.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.51 ' O ' HG12 ' A' ' 56' ' ' ILE . 78.8 m-70 -100.68 42.62 1.1 Allowed 'General case' 0 C--N 1.304 -1.394 0 O-C-N 122.034 -0.416 . . . . 0.0 110.642 -172.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 50' ' ' SER . 82.1 mt -48.61 -38.75 21.72 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.529 1.132 . . . . 0.0 113.022 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -53.24 -50.81 64.01 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -75.2 -34.04 61.46 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.209 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.51 HG12 ' O ' ' A' ' 52' ' ' HIS . 42.5 mm -60.34 -42.46 90.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-O 120.969 0.414 . . . . 0.0 110.39 -178.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.466 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 34.2 ptt180 -71.63 -33.65 69.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.07 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.3 tttm -66.56 -50.41 63.21 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 123.208 0.603 . . . . 0.0 109.615 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -114.71 60.38 0.68 Allowed 'General case' 0 CA--C 1.48 -1.725 0 CA-C-O 122.168 0.985 . . . . 0.0 111.279 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.466 ' HE3' ' O ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -55.59 -37.63 68.33 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 113.627 -1.624 . . . . 0.0 112.267 -177.088 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -70.93 -41.26 71.4 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 120.698 0.285 . . . . 0.0 110.78 -178.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.454 ' O ' HG12 ' A' ' 66' ' ' ILE . 83.3 t80 -62.91 -51.48 66.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.125 -178.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.466 ' HA ' HG12 ' A' ' 66' ' ' ILE . 93.4 m-85 -73.47 -24.69 60.23 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -177.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -72.93 -50.09 25.6 Favored 'General case' 0 C--O 1.265 1.902 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.48 ' SD ' ' HE3' ' A' ' 11' ' ' LYS . 79.2 mtm -65.37 -47.93 74.69 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.421 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.499 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 48.5 pt -63.95 -34.5 68.81 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.525 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.69 -178.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.534 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.01 -45.47 79.08 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 123.125 0.266 . . . . 0.0 111.614 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.71 -34.3 58.16 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 118.67 -1.212 . . . . 0.0 111.789 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 65' ' ' MET . 85.0 mt -60.59 -45.08 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.608 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 87.3 mt -55.65 -45.64 77.61 Favored 'General case' 0 C--O 1.21 -1.021 0 C-N-CA 123.535 0.734 . . . . 0.0 110.89 179.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.534 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.7 mt-30 -68.86 -49.34 59.14 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 121.31 0.576 . . . . 0.0 110.566 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -61.86 -49.17 77.32 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 124.161 0.984 . . . . 0.0 111.817 -177.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.509 ' HH ' ' HB2' ' A' ' 6' ' ' ASP . 63.6 m-85 -82.38 -16.9 47.45 Favored 'General case' 0 N--CA 1.427 -1.581 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -177.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.608 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.46 -29.79 69.33 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 172.651 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -79.63 -44.11 21.57 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.904 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.458 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 65.7 tttm -72.85 -44.82 60.91 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.76 -25.92 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.574 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 122.05 141.36 6.02 Favored Glycine 0 C--N 1.311 -0.824 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 178.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.3 tp -61.06 -37.66 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 117.202 0.501 . . . . 0.0 112.061 -173.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -60.41 -43.73 96.41 Favored 'General case' 0 C--O 1.244 0.796 0 CA-C-O 122.136 0.969 . . . . 0.0 109.667 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.409 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 94.0 m-20 -67.66 -40.39 84.49 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.729 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.574 HG21 ' O ' ' A' ' 78' ' ' GLY . 17.5 t -66.52 -41.42 88.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.408 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.9 OUTLIER -52.43 -49.58 64.27 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 121.218 0.532 . . . . 0.0 110.199 177.559 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -44.9 92.09 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.401 -177.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.7 mt -66.18 -35.96 81.83 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.462 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.8 mm -65.53 -41.64 91.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 175.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 94.8 mt -63.34 -40.1 96.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.98 176.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 94.3 m -59.07 -33.61 71.0 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 123.859 0.864 . . . . 0.0 110.914 176.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.4 m -69.14 -48.29 62.77 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.94 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.2 pt -76.1 -24.21 16.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-O 121.037 0.446 . . . . 0.0 112.061 -178.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.513 ' HA ' ' HE2' ' A' ' 91' ' ' LYS . 9.3 mmpt? -83.13 -6.94 59.67 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 175.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.486 ' CD1' ' H ' ' A' ' 93' ' ' GLU 0.451 1.0 OUTLIER 42.43 -101.96 0.04 OUTLIER 'General case' 0 C--O 1.247 0.944 0 N-CA-C 117.115 2.265 . . . . 0.0 117.115 178.465 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.486 ' H ' ' CD1' ' A' ' 92' ' ' LEU . 71.6 mm-40 -80.84 89.85 5.85 Favored 'General case' 0 N--CA 1.425 -1.716 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -176.078 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -169.53 25.87 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 177.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 22.9 t-80 -132.77 102.3 5.61 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.69 0.757 . . . . 0.0 111.874 -177.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -129.08 143.44 50.86 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 175.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -104.92 -40.96 5.75 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.014 -1.074 . . . . 0.0 111.84 -174.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -152.1 107.52 3.31 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.155 0.502 . . . . 0.0 112.232 177.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 . . . . . 0 C--N 1.305 -1.367 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 175.034 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtm . . . . . 0 C--O 1.25 1.079 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.3 t 66.84 -84.94 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 124.713 1.205 . . . . 0.0 111.922 174.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 18.8 tt -138.43 -12.01 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-O 120.818 0.342 . . . . 0.0 111.862 -175.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.0 mt -74.05 -1.64 20.91 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.459 0.647 . . . . 0.0 111.563 -177.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -84.27 -11.16 56.92 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.765 -178.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.463 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 4.8 t70 -92.67 133.32 29.57 Favored Pre-proline 0 C--N 1.313 -1.016 0 C-N-CA 119.901 -0.72 . . . . 0.0 112.725 -170.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -65.57 -28.92 52.84 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.624 2.216 . . . . 0.0 112.522 175.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -74.84 -39.32 61.67 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 121.765 -0.584 . . . . 0.0 109.425 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -65.51 -44.04 88.22 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.143 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.07 -34.71 70.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 121.195 0.521 . . . . 0.0 110.14 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.418 ' HZ1' ' HB2' ' A' ' 11' ' ' LYS . 10.4 mtmp? -67.83 -36.95 81.26 Favored 'General case' 0 C--O 1.198 -1.64 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.165 175.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.9 mt -59.29 -40.46 86.22 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.778 0.263 . . . . 0.0 111.337 176.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -61.37 -41.18 96.66 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.273 0.559 . . . . 0.0 111.644 177.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -79.71 -27.24 40.67 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.961 -178.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -82.31 -59.28 2.6 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.871 -176.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.1 mttt 68.26 155.31 0.11 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.835 0.854 . . . . 0.0 111.609 -174.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -114.18 144.84 18.4 Favored Glycine 0 N--CA 1.424 -2.148 0 C-N-CA 119.377 -1.392 . . . . 0.0 112.523 -175.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -94.53 32.15 1.64 Allowed 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 122.089 0.947 . . . . 0.0 108.561 176.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.7 m -88.49 164.5 2.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.049 0 CA-C-N 113.631 -1.622 . . . . 0.0 111.059 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -85.76 119.72 26.4 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 171.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -54.62 -35.96 63.99 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 123.486 0.491 . . . . 0.0 111.552 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -70.22 -35.0 73.57 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-O 121.252 0.548 . . . . 0.0 109.964 -176.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.594 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.1 tp -76.83 -42.32 40.75 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.16 -177.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.524 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 62.9 t -61.2 -43.6 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.442 ' O ' ' HB2' ' A' ' 29' ' ' ASP . 58.8 ttp -60.52 -33.68 72.99 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.236 178.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -75.4 -38.86 59.64 Favored 'General case' 0 C--O 1.206 -1.212 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.613 176.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.594 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.2 mm -56.99 -52.39 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 121.331 0.586 . . . . 0.0 110.161 -179.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 3.2 pp -71.4 -30.57 66.25 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.582 -178.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.442 ' HB2' ' O ' ' A' ' 25' ' ' MET . 30.8 t70 -68.38 -44.37 75.3 Favored 'General case' 0 C--N 1.299 -1.587 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.019 176.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.19 -38.19 90.16 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.75 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.6 pt -70.15 -41.43 78.97 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.188 176.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.438 ' OE1' ' HG2' ' A' ' 80' ' ' GLU . 37.2 tt0 -59.13 -54.45 46.82 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.013 0.925 . . . . 0.0 111.383 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.473 HD13 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -63.63 -34.52 78.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -178.271 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.473 ' N ' HD13 ' A' ' 33' ' ' LEU . 18.4 t0 -76.28 -40.73 50.94 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.139 -178.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.9 tp -61.04 -23.6 65.56 Favored 'General case' 0 C--O 1.249 1.059 0 C-N-CA 124.776 1.231 . . . . 0.0 111.792 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -53.11 -24.87 11.33 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.996 0.518 . . . . 0.0 111.338 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.49 -87.16 0.1 Allowed Glycine 0 N--CA 1.434 -1.482 0 O-C-N 123.533 0.521 . . . . 0.0 112.599 179.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 51.8 m -162.17 -5.23 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -175.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -79.24 -163.22 0.47 Allowed 'General case' 0 C--O 1.251 1.144 0 CA-C-N 119.432 1.015 . . . . 0.0 112.616 -174.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.506 ' ND2' ' HE2' ' A' ' 42' ' ' LYS . 29.4 t-20 -113.68 144.48 42.87 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -173.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.551 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.5 tt -57.78 -36.7 56.18 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.506 ' HE2' ' ND2' ' A' ' 40' ' ' ASN . 58.6 pttt -61.75 -33.7 74.52 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.19 0.519 . . . . 0.0 110.445 175.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.4 m -74.55 -41.65 60.21 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.235 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 12.8 m -58.45 -40.77 83.5 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.835 175.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.551 HG12 ' O ' ' A' ' 41' ' ' ILE . 32.8 mm -54.34 -46.92 69.71 Favored 'Isoleucine or valine' 0 C--N 1.349 0.555 0 C-N-CA 123.815 0.846 . . . . 0.0 110.256 176.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 42' ' ' LYS . 71.8 mt -52.13 -51.43 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 123.481 0.712 . . . . 0.0 111.789 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -59.73 -53.26 60.09 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.676 0.75 . . . . 0.0 110.971 -175.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.1 t -66.83 -41.91 88.42 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.665 -174.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -68.86 -38.98 80.1 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.314 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.4 t -69.96 -26.71 64.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.417 0.627 . . . . 0.0 110.292 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.8 t -82.31 -48.21 11.46 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-O 121.341 0.591 . . . . 0.0 110.696 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.478 ' O ' HG12 ' A' ' 56' ' ' ILE . 73.9 m-70 -101.19 40.9 1.23 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.73 -174.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 89.5 mt -47.04 -39.87 13.71 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.332 1.453 . . . . 0.0 113.893 -177.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -54.14 -50.79 66.12 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -175.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.446 ' CG ' ' HH ' ' A' ' 63' ' ' TYR . 4.5 tp10 -73.07 -35.79 66.74 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 120.991 0.424 . . . . 0.0 109.861 -178.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 52' ' ' HIS . 43.6 mm -58.58 -51.16 75.08 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.165 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.915 -179.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -77.47 -16.09 58.95 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -74.99 -48.56 23.57 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -116.83 53.55 0.89 Allowed 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.073 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -57.23 -39.96 76.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.012 -0.995 . . . . 0.0 113.408 -174.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -62.03 -37.27 84.31 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.268 0.556 . . . . 0.0 110.957 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -69.01 -49.3 58.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.897 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.477 ' HA ' HG12 ' A' ' 66' ' ' ILE . 72.9 m-85 -68.31 -33.45 74.34 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.19 -48.12 82.99 Favored 'General case' 0 C--O 1.254 1.339 0 CA-C-O 121.209 0.528 . . . . 0.0 109.882 177.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.406 ' O ' ' HB3' ' A' ' 68' ' ' GLU . 79.2 mtm -68.9 -45.8 69.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.82 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.6 pt -69.23 -37.86 76.79 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.448 0 C-N-CA 119.014 -1.075 . . . . 0.0 112.968 -177.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.12 -38.39 76.41 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.427 0.632 . . . . 0.0 109.815 177.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 65' ' ' MET . 19.3 tp10 -63.51 -56.38 16.48 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.27 176.191 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.6 mt -59.47 -39.08 78.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.208 0.603 . . . . 0.0 112.498 -178.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.8 mt -53.98 -50.95 65.4 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 122.658 0.383 . . . . 0.0 111.771 178.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -70.84 -49.4 46.65 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 122.241 1.02 . . . . 0.0 109.385 -178.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.403 ' HD2' ' OE2' ' A' ' 68' ' ' GLU . 29.0 ttt180 -54.93 -38.95 68.34 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 127.655 2.382 . . . . 0.0 111.797 -177.047 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.463 ' HH ' ' HB2' ' A' ' 6' ' ' ASP 0.257 28.6 m-85 -99.83 -14.69 18.69 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -178.652 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.427 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.26 -26.58 66.64 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 174.374 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -78.13 -17.87 56.36 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.653 176.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -99.93 -51.57 3.67 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.389 0.614 . . . . 0.0 112.307 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.4 pt -117.37 -27.23 2.45 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.072 -173.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.544 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 116.83 148.66 8.95 Favored Glycine 0 N--CA 1.434 -1.46 0 C-N-CA 120.297 -0.954 . . . . 0.0 111.076 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 5.5 tp -59.71 -42.41 88.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -175.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.438 ' HG2' ' OE1' ' A' ' 32' ' ' GLU . 41.6 mt-10 -64.59 -35.85 82.34 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 121.151 0.5 . . . . 0.0 111.56 -176.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -64.51 -47.3 79.4 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.552 174.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.544 HG21 ' O ' ' A' ' 78' ' ' GLY . 21.7 t -63.83 -42.32 95.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.08 -178.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.48 ' HB3' HD12 ' A' ' 28' ' ' LEU . 95.3 m-20 -51.92 -47.93 64.44 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.513 0.725 . . . . 0.0 111.307 177.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -45.02 76.92 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.295 -0.866 . . . . 0.0 108.868 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.414 ' O ' ' HB ' ' A' ' 88' ' ' THR . 95.7 mt -61.98 -39.59 92.72 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.426 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.9 mm -63.56 -40.2 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 120.915 0.388 . . . . 0.0 109.958 177.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 92.6 mt -64.35 -37.09 86.28 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.801 0.81 . . . . 0.0 109.467 177.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.414 ' HB ' ' O ' ' A' ' 85' ' ' LEU . 86.4 m -66.05 -34.31 77.78 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.59 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 m -64.48 -40.9 96.55 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 120.822 0.344 . . . . 0.0 110.508 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.0 pt -92.75 -34.34 5.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -177.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -126.42 38.99 4.02 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 118.978 -1.089 . . . . 0.0 112.488 -174.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 37.2 tp -165.19 79.54 0.33 Allowed 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 170.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -116.95 131.7 56.89 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.02 -173.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -126.81 3.59 6.66 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.025 0.916 . . . . 0.0 108.912 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.2 m80 -145.06 104.36 3.96 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -177.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 22.4 p80 -121.32 102.3 8.19 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -176.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 71.95 -39.28 0.44 Allowed 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.432 1.893 . . . . 0.0 113.465 172.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 63.2 t60 72.43 -55.99 0.66 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.857 1.663 . . . . 0.0 111.308 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 . . . . . 0 C--N 1.284 -2.25 0 N-CA-C 106.223 -1.769 . . . . 0.0 106.223 179.751 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.5 mtt . . . . . 0 CA--C 1.511 -0.552 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.6 p -154.31 -85.55 0.06 Allowed 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 121.041 0.448 . . . . 0.0 111.284 -179.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.483 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 20.3 tt 179.34 -21.56 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 124.39 1.076 . . . . 0.0 108.525 -178.144 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -67.82 -6.98 24.07 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-O 121.805 0.812 . . . . 0.0 110.589 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -72.36 -30.96 65.19 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 125.037 1.335 . . . . 0.0 109.773 178.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.439 ' HB2' ' HH ' ' A' ' 73' ' ' TYR . 13.6 t70 -87.19 127.56 58.74 Favored Pre-proline 0 C--O 1.249 1.057 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.773 -173.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.497 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 39.4 Cg_exo -61.87 -28.03 80.86 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.165 2.576 . . . . 0.0 113.664 -179.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -72.23 -32.21 66.53 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.586 -176.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -66.86 -44.11 81.83 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.349 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.8 p -67.44 -34.21 67.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-O 121.269 0.557 . . . . 0.0 109.859 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.506 ' O ' ' HD1' ' A' ' 15' ' ' PHE . 68.5 mttm -62.37 -42.65 99.58 Favored 'General case' 0 C--O 1.207 -1.17 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.731 174.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.9 mt -58.62 -34.97 71.76 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.586 0.231 . . . . 0.0 111.564 179.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.4 mmm180 -63.86 -32.02 73.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.117 0.484 . . . . 0.0 110.416 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -79.65 -36.97 36.98 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.356 177.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.506 ' HD1' ' O ' ' A' ' 11' ' ' LYS . 24.3 m-85 -62.49 -36.33 82.17 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 173.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt 74.0 -34.51 0.28 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.876 1.671 . . . . 0.0 112.479 175.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.41 -80.46 0.3 Allowed Glycine 0 N--CA 1.423 -2.232 0 C-N-CA 120.438 -0.887 . . . . 0.0 113.598 175.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? 59.71 31.58 20.94 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.148 0.975 . . . . 0.0 108.842 -171.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 m -117.29 169.46 7.71 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 CA-C-N 113.685 -1.598 . . . . 0.0 108.991 -175.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.422 ' O ' HG21 ' A' ' 24' ' ' VAL . 48.7 t-20 -86.91 113.14 22.44 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 106.533 -1.654 . . . . 0.0 106.533 173.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -53.09 -36.88 61.18 Favored 'General case' 0 C--N 1.314 -0.958 0 O-C-N 123.657 0.598 . . . . 0.0 111.166 179.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -74.49 -35.17 63.23 Favored 'General case' 0 CA--C 1.487 -1.478 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.646 -172.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.61 ' O ' HG12 ' A' ' 27' ' ' ILE . 25.0 tp -76.64 -39.08 53.44 Favored 'General case' 0 N--CA 1.418 -2.051 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.162 -178.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.422 HG21 ' O ' ' A' ' 20' ' ' ASN . 61.2 t -62.44 -40.91 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.1 ttp -59.65 -43.18 94.0 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.722 176.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -67.2 -38.28 85.06 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.911 177.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.61 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.75 -52.08 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 176.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.5 mt -62.02 -41.42 98.07 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.961 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -66.93 -47.29 72.14 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-O 121.436 0.636 . . . . 0.0 110.472 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -64.16 -40.79 96.88 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.907 -176.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.1 pt -70.09 -40.05 77.9 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.933 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.808 176.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.63 -50.21 74.68 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.076 0.95 . . . . 0.0 111.407 -178.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.416 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.3 pp -62.59 -34.09 76.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.184 -178.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.416 ' N ' HD12 ' A' ' 33' ' ' LEU . 29.4 t70 -76.75 -50.26 14.01 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.728 176.071 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.0 tp -50.21 -38.85 42.17 Favored 'General case' 0 C--O 1.247 0.964 0 C-N-CA 125.258 1.423 . . . . 0.0 113.05 -176.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -48.61 -37.32 17.83 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 124.509 1.131 . . . . 0.0 111.377 -177.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -127.92 29.08 4.25 Favored Glycine 0 N--CA 1.439 -1.1 0 N-CA-C 111.54 -0.624 . . . . 0.0 111.54 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' ASP . 6.8 t -120.97 -29.9 4.5 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 -178.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.7 t70 69.8 -51.22 0.63 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 125.704 1.601 . . . . 0.0 113.397 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -84.51 93.5 8.35 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-O 121.523 0.678 . . . . 0.0 110.757 177.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.521 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.8 tt -60.16 -24.05 29.27 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.231 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.328 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.408 ' O ' HG13 ' A' ' 46' ' ' ILE . 40.4 mtmt -56.68 -46.96 80.85 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.524 0.729 . . . . 0.0 109.764 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.6 m -71.65 -36.62 70.75 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 114.667 -1.151 . . . . 0.0 109.754 -179.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.5 m -61.4 -39.68 91.59 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.917 176.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 41' ' ' ILE . 35.7 mm -56.9 -48.75 80.9 Favored 'Isoleucine or valine' 0 C--N 1.351 0.637 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 42' ' ' LYS . 68.1 mt -52.93 -48.72 51.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 115.333 -0.848 . . . . 0.0 112.473 -177.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -60.96 -53.36 58.16 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.769 0.795 . . . . 0.0 110.312 -176.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.04 -46.04 94.96 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.634 -174.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -66.49 -37.7 85.65 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.32 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.9 t -71.81 -26.93 62.6 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-O 120.983 0.421 . . . . 0.0 110.775 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.2 t -81.79 -44.73 16.58 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.376 0.608 . . . . 0.0 109.97 178.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.482 ' O ' HG12 ' A' ' 56' ' ' ILE . 82.7 m-70 -102.14 38.97 1.55 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.349 -175.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 77.8 mt -47.64 -36.79 11.5 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 -177.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.528 ' O ' ' HD3' ' A' ' 58' ' ' LYS . 26.1 t70 -54.43 -51.55 64.58 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -176.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.406 ' CG ' ' HH ' ' A' ' 63' ' ' TYR . 11.6 tp10 -73.55 -29.72 62.61 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.65 -177.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 52' ' ' HIS . 37.8 mm -64.19 -45.74 95.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.054 179.336 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -74.3 -32.71 62.98 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.537 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.528 ' HD3' ' O ' ' A' ' 54' ' ' ASP . 2.1 mptm? -63.8 -43.44 96.27 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 120.769 0.319 . . . . 0.0 110.87 177.145 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -123.92 60.99 1.1 Allowed 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.864 0.84 . . . . 0.0 111.076 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -64.06 -25.88 68.31 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.156 -176.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -69.41 -52.16 29.5 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -59.41 -50.66 73.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.778 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.473 ' HA ' HG12 ' A' ' 66' ' ' ILE . 74.2 m-85 -67.05 -32.29 73.38 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -67.74 -44.94 76.38 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.17 0.51 . . . . 0.0 110.297 177.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 88.2 mtp -67.55 -45.8 74.61 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.694 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.518 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 48.0 pt -66.64 -36.36 77.06 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.566 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.681 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.78 -40.7 80.43 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.112 0.415 . . . . 0.0 110.424 178.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -62.71 -51.38 67.39 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.268 177.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 82.0 mt -63.64 -41.29 92.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.956 -178.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 86.5 mt -58.51 -48.71 79.92 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.85 0.46 . . . . 0.0 111.554 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -64.43 -48.7 74.33 Favored 'General case' 0 C--O 1.251 1.17 0 CA-C-O 122.192 0.996 . . . . 0.0 109.815 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -60.0 -45.7 91.88 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 113.833 -1.531 . . . . 0.0 110.905 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.493 ' CE2' ' HD3' ' A' ' 76' ' ' LYS 0.252 31.5 m-85 -91.81 -21.28 20.75 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -174.921 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -67.5 -31.19 71.15 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 118.37 -1.332 . . . . 0.0 108.543 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -74.26 -38.16 63.53 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.177 0.513 . . . . 0.0 110.141 176.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.493 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 87.1 tttt -75.66 -51.02 13.72 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.711 -175.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.5 pt -122.27 -30.7 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.533 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 127.58 143.8 5.8 Favored Glycine 0 C--N 1.315 -0.602 0 C-N-CA 120.347 -0.93 . . . . 0.0 111.997 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tp -60.87 -40.55 85.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -175.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -59.58 -39.6 84.66 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.678 0.752 . . . . 0.0 110.225 -178.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.486 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.3 m-20 -66.24 -50.26 64.38 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.291 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 78' ' ' GLY . 25.3 t -63.88 -38.34 82.1 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.885 -176.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 -52.94 -50.11 64.68 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.024 0.929 . . . . 0.0 109.715 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -39.47 80.6 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.009 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 91.7 mt -66.22 -38.4 87.86 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -178.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.7 mm -66.11 -39.44 84.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.06 -39.25 93.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.325 176.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 86.0 m -58.87 -34.03 71.15 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.426 0.69 . . . . 0.0 110.193 176.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 65.1 m -65.18 -45.94 82.83 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.825 -178.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.1 pt -84.99 -9.39 11.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.288 0.566 . . . . 0.0 112.095 -177.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -88.16 130.7 34.97 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.8 mt -69.15 -54.27 15.78 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 177.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 62.4 77.5 0.33 Allowed 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.858 -1.519 . . . . 0.0 112.201 178.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -124.59 126.52 45.92 Favored 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 173.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -79.36 150.02 31.52 Favored 'General case' 0 C--N 1.287 -2.148 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -176.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -81.07 91.82 6.15 Favored 'General case' 0 N--CA 1.432 -1.365 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 179.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 31.7 t-80 -60.41 124.45 20.37 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -178.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -144.1 139.45 28.89 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -175.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 . . . . . 0 C--N 1.3 -1.557 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 174.754 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.506 -0.749 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.9 m -79.64 105.51 10.99 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 121.176 0.513 . . . . 0.0 110.026 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 16.9 pt -64.04 88.4 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.453 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.26 12.98 27.08 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 116.011 -0.541 . . . . 0.0 112.177 -175.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -69.04 -39.46 79.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.708 0.765 . . . . 0.0 109.392 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -83.49 132.14 50.51 Favored Pre-proline 0 C--N 1.305 -1.333 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.324 -171.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.473 ' O ' HG11 ' A' ' 10' ' ' VAL . 9.1 Cg_exo -72.16 -28.73 15.31 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.042 2.494 . . . . 0.0 113.19 178.298 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -76.23 -31.33 58.31 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 122.038 0.923 . . . . 0.0 109.052 -177.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -59.4 -43.06 93.05 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.512 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.473 HG11 ' O ' ' A' ' 7' ' ' PRO . 7.5 p -68.05 -33.8 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 C-N-CA 120.171 -0.611 . . . . 0.0 110.19 178.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.27 -38.09 79.24 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.868 0.365 . . . . 0.0 110.08 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.67 -38.72 90.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.689 176.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -61.9 -38.57 88.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.576 177.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -75.61 -28.19 58.76 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.915 178.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -68.69 -45.18 72.33 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.521 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt 73.61 169.67 0.31 Allowed 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.471 1.108 . . . . 0.0 110.725 177.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.91 72.78 0.68 Allowed Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 114.058 0.383 . . . . 0.0 114.058 -179.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -85.25 -12.04 53.44 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.936 0.874 . . . . 0.0 109.581 174.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.407 ' CG2' HG21 ' A' ' 24' ' ' VAL . 27.2 m -92.93 163.42 2.24 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.296 -176.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.462 ' O ' HG22 ' A' ' 24' ' ' VAL . 48.9 m-80 -72.95 107.09 5.14 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -51.91 -48.29 64.25 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -68.56 -29.45 68.0 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-O 121.155 0.502 . . . . 0.0 110.341 -175.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.549 ' O ' HG12 ' A' ' 27' ' ' ILE . 32.7 tp -77.34 -41.83 38.97 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.934 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 20' ' ' ASN . 60.8 t -61.81 -43.96 98.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.4 ttp -56.37 -36.64 69.05 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.682 177.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -75.62 -38.44 58.98 Favored 'General case' 0 C--O 1.211 -0.942 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.221 177.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.8 mm -57.0 -50.62 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.452 ' HB3' ' CG ' ' A' ' 83' ' ' ASN . 86.3 mt -61.61 -42.92 99.57 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.325 -1.307 . . . . 0.0 110.273 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -62.05 -48.29 80.89 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.65 178.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -62.53 -39.89 95.02 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.516 -175.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 38.7 pt -73.54 -37.9 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.807 176.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.438 ' HG2' ' NH2' ' A' ' 36' ' ' ARG . 32.2 tt0 -59.54 -52.7 64.44 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.943 0.897 . . . . 0.0 110.844 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.405 HD13 ' N ' ' A' ' 34' ' ' ASP . 4.4 pp -68.12 -28.6 67.47 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.086 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.405 ' N ' HD13 ' A' ' 33' ' ' LEU . 26.9 t70 -70.74 -44.02 67.65 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.011 0.434 . . . . 0.0 110.357 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.0 tt -70.24 -58.23 4.0 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 176.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.438 ' NH2' ' HG2' ' A' ' 32' ' ' GLU . 4.1 tpm_? 59.78 -71.75 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.58 1.952 . . . . 0.0 110.603 -177.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -161.37 -0.42 0.06 OUTLIER Glycine 0 N--CA 1.441 -0.974 0 C-N-CA 121.125 -0.56 . . . . 0.0 113.403 176.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.4 m -125.62 7.81 7.59 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 118.344 1.072 . . . . 0.0 113.384 -173.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -135.04 -166.19 1.79 Allowed 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 118.328 -1.349 . . . . 0.0 110.702 -176.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 -110.66 138.69 46.73 Favored 'General case' 0 CA--C 1.498 -1.022 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 -174.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.501 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.0 tt -65.56 -38.41 82.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.472 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.531 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.5 ptmt -64.48 -32.64 74.36 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.356 -179.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.6 m -67.31 -45.77 75.51 Favored 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.7 m -61.24 -40.64 94.8 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.608 177.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 41' ' ' ILE . 30.1 mm -53.67 -44.3 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.904 0.881 . . . . 0.0 109.948 176.087 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 42' ' ' LYS . 77.2 mt -54.75 -52.46 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.87 -177.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.38 -46.07 90.3 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-O 121.35 0.595 . . . . 0.0 111.349 -176.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.54 -46.21 71.14 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.581 -172.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -65.18 -38.81 91.71 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.232 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 82.9 p -73.81 -21.77 60.03 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.379 0.609 . . . . 0.0 111.692 -177.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.7 t -93.58 -20.33 20.32 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-O 121.1 0.476 . . . . 0.0 110.99 -178.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.511 ' O ' HG12 ' A' ' 56' ' ' ILE . 62.5 m-70 -123.8 39.27 4.0 Favored 'General case' 0 C--N 1.317 -0.805 0 O-C-N 121.804 -0.56 . . . . 0.0 109.738 -176.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 93.8 mt -49.32 -36.79 22.19 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -174.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -56.59 -51.51 68.34 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -176.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -73.14 -36.91 66.75 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.511 HG12 ' O ' ' A' ' 52' ' ' HIS . 42.4 mm -62.36 -49.3 84.48 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.648 -177.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -77.18 -26.58 53.07 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.254 0.55 . . . . 0.0 111.398 -175.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -71.41 -43.49 66.67 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.561 0.696 . . . . 0.0 109.681 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -116.32 46.54 1.57 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 114.909 -1.041 . . . . 0.0 108.479 -177.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -59.97 -32.64 71.01 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.561 -174.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -64.14 -43.36 95.44 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -66.07 -51.57 56.9 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.999 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.435 ' HA ' HG12 ' A' ' 66' ' ' ILE . 68.3 m-85 -67.82 -28.95 68.01 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -74.05 -44.47 54.11 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.467 177.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.8 mtm -65.07 -45.85 83.6 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.664 179.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.7 pt -63.38 -41.96 94.6 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.028 0 C-N-CA 119.519 -0.872 . . . . 0.0 111.912 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.516 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.88 -36.69 65.39 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.193 0.52 . . . . 0.0 111.433 -178.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.51 -54.9 10.37 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.602 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 78.9 mt -60.57 -40.73 85.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.146 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 97.1 mt -55.22 -46.89 75.95 Favored 'General case' 0 C--O 1.213 -0.854 0 C-N-CA 123.129 0.571 . . . . 0.0 111.436 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.516 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 63.2 mt-30 -69.33 -41.37 76.75 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.314 0.578 . . . . 0.0 110.15 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -59.97 -47.04 87.44 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.214 1.006 . . . . 0.0 110.308 -178.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -87.14 -15.51 38.18 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.485 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.81 -29.65 69.64 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 176.369 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -78.76 -28.11 44.76 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.404 176.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -90.18 -51.31 5.51 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -174.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.3 pt -121.47 -19.07 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -176.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.574 ' O ' HG22 ' A' ' 82' ' ' VAL . . . 109.0 140.6 9.08 Favored Glycine 0 C--N 1.305 -1.188 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 178.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.2 tp -57.26 -40.47 73.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -174.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -57.69 -41.77 82.33 Favored 'General case' 0 C--O 1.251 1.142 0 CA-C-O 122.252 1.025 . . . . 0.0 109.993 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.52 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 49.0 m-80 -70.51 -43.53 69.45 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 113.971 -1.468 . . . . 0.0 111.379 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.574 HG22 ' O ' ' A' ' 78' ' ' GLY . 12.6 t -63.51 -46.21 95.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 O-C-N 123.231 0.332 . . . . 0.0 110.293 -177.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.452 ' CG ' ' HB3' ' A' ' 28' ' ' LEU . 95.1 m-20 -52.31 -47.06 66.17 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.818 0.699 . . . . 0.0 110.83 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -60.84 -41.33 95.61 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.378 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 65.7 mt -74.34 -31.24 62.36 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.368 -177.166 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.7 mm -63.2 -37.49 79.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 84.9 mt -63.31 -39.52 94.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.549 176.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 17.3 m -66.39 -33.67 76.23 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.556 0.693 . . . . 0.0 110.056 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 78.6 m -64.72 -48.62 73.98 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.102 -178.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 36.6 pt -80.0 -45.26 22.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.44 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -107.76 69.7 0.75 Allowed 'General case' 0 N--CA 1.407 -2.597 0 CA-C-O 122.205 1.002 . . . . 0.0 109.976 -178.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.88 -32.63 65.53 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 105.269 -2.122 . . . . 0.0 105.269 173.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 67.04 96.02 0.06 Allowed 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 112.858 -1.973 . . . . 0.0 111.925 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -121.71 83.75 2.14 Favored 'General case' 0 C--N 1.285 -2.201 0 N-CA-C 103.384 -2.821 . . . . 0.0 103.384 175.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -48.12 118.54 2.44 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -167.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 32.2 t60 -74.95 120.47 20.53 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 176.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 33.8 p-80 -73.39 120.02 18.43 Favored 'General case' 0 C--N 1.315 -0.925 0 O-C-N 123.401 0.438 . . . . 0.0 111.815 -177.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 80.0 t60 68.48 103.09 0.05 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.173 1.389 . . . . 0.0 112.699 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 . . . . . 0 C--N 1.305 -1.363 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 177.278 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 CA--C 1.507 -0.693 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 m -87.12 -176.29 5.64 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 19.7 pt -74.83 76.73 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.998 0.904 . . . . 0.0 112.01 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.5 mt -80.79 -5.05 56.68 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.594 -177.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 1.9 mp0 -62.45 -24.69 67.58 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 124.281 1.032 . . . . 0.0 110.538 175.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -93.0 125.12 56.19 Favored Pre-proline 0 N--CA 1.435 -1.221 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.157 -175.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.489 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 26.8 Cg_exo -63.02 -34.67 69.65 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.652 2.235 . . . . 0.0 113.018 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.438 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 5.6 mm-40 -77.64 -30.13 52.05 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.309 0.576 . . . . 0.0 111.528 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -66.35 -38.71 88.23 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.762 176.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.439 HG13 ' O ' ' A' ' 7' ' ' PRO . 9.3 p -68.6 -33.43 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.817 177.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 7' ' ' PRO . 40.1 mmtm -55.04 -36.03 65.09 Favored 'General case' 0 C--N 1.361 1.104 0 CA-C-O 121.054 0.454 . . . . 0.0 110.038 173.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.34 -38.41 81.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.068 179.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -65.28 -32.89 74.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.569 0.699 . . . . 0.0 109.708 176.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -79.83 -23.93 41.68 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.079 177.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.484 ' CE1' ' HB2' ' A' ' 62' ' ' PHE . 47.9 t80 -79.14 -41.37 28.71 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 74.01 -174.3 0.14 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.863 1.265 . . . . 0.0 112.224 177.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -86.19 83.79 1.6 Allowed Glycine 0 N--CA 1.432 -1.6 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.804 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -97.47 13.98 28.01 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.717 0.77 . . . . 0.0 109.603 175.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 15.7 m -124.14 164.55 22.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-N 114.258 -1.337 . . . . 0.0 109.304 -174.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -78.78 118.64 21.03 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 173.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -55.37 -35.51 65.35 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 123.643 0.777 . . . . 0.0 111.657 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -74.24 -31.52 62.62 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.12 -174.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.599 ' O ' HG12 ' A' ' 27' ' ' ILE . 31.4 tp -76.48 -41.95 45.3 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.434 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.3 t -61.54 -42.17 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 176.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 38.1 ttm -55.61 -44.65 77.24 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 175.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -67.12 -40.84 86.9 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.133 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.599 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.2 mm -56.74 -52.03 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.05 -40.88 99.03 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.683 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -65.22 -49.02 71.3 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.418 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -60.95 -42.5 98.36 Favored 'General case' 0 C--O 1.246 0.891 0 C-N-CA 124.643 1.177 . . . . 0.0 110.471 -176.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 41.2 pt -72.69 -38.99 59.77 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.96 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.542 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -61.94 -48.72 79.12 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 123.523 0.729 . . . . 0.0 112.022 -176.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.89 -27.0 64.44 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.996 0.427 . . . . 0.0 111.711 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -75.78 -43.4 46.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.286 0.565 . . . . 0.0 109.6 177.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.505 ' CD1' ' HA ' ' A' ' 38' ' ' SER . 58.6 tp -66.56 -59.94 3.18 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.885 -179.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 43.04 -83.5 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 127.198 2.199 . . . . 0.0 114.136 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.81 -25.83 64.33 Favored Glycine 0 C--N 1.346 1.113 0 N-CA-C 111.479 -0.648 . . . . 0.0 111.479 178.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.505 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 22.6 m 71.55 89.36 0.1 Allowed 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 172.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -122.61 -60.1 1.56 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.726 173.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -126.81 88.76 2.87 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.927 0.87 . . . . 0.0 111.056 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.479 ' O ' HG12 ' A' ' 45' ' ' ILE . 6.7 tt -69.9 -28.5 36.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.065 -178.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.524 ' O ' HG13 ' A' ' 46' ' ' ILE . 60.4 pttt -56.49 -38.62 72.0 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-O 120.712 0.291 . . . . 0.0 111.142 176.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.0 m -69.55 -42.05 75.09 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.684 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.422 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 22.8 m -62.15 -38.19 88.06 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.496 176.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 41' ' ' ILE . 33.5 mm -56.55 -48.96 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.53 0.732 . . . . 0.0 110.055 176.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 42' ' ' LYS . 77.1 mt -52.89 -47.58 52.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.537 -177.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.422 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 23.9 m-85 -61.07 -53.36 58.1 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.661 0.744 . . . . 0.0 109.939 -175.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -64.77 -44.77 96.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-N 114.295 -1.321 . . . . 0.0 111.481 -174.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -63.41 -39.28 94.06 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.265 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.411 ' HA ' ' CD2' ' A' ' 53' ' ' LEU . 21.9 t -73.52 -21.82 60.28 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 120.677 0.275 . . . . 0.0 111.165 -179.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.1 t -94.1 -3.96 50.17 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.433 0.635 . . . . 0.0 110.333 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.53 ' O ' HG12 ' A' ' 56' ' ' ILE . 91.6 m-70 -140.48 37.47 1.86 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.411 ' CD2' ' HA ' ' A' ' 50' ' ' SER . 84.0 mt -47.62 -45.18 27.42 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -172.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -60.1 -48.94 79.62 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -172.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -67.38 -33.95 76.28 Favored 'General case' 0 C--O 1.245 0.819 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 52' ' ' HIS . 39.3 mm -63.94 -42.14 94.81 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.25 0 CA-C-N 115.19 -0.913 . . . . 0.0 108.969 178.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.493 ' NE ' ' HA ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -65.15 -50.05 67.51 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 123.351 0.661 . . . . 0.0 111.06 -177.386 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -57.75 -33.78 68.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.461 -178.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -127.3 46.52 2.51 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -175.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -53.45 -36.6 61.77 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.774 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -71.32 -42.04 69.09 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.484 ' HB2' ' CE1' ' A' ' 15' ' ' PHE . 85.8 t80 -62.18 -49.6 75.14 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.895 178.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.445 ' HA ' HG12 ' A' ' 66' ' ' ILE . 61.5 m-85 -67.7 -32.89 73.85 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -178.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -69.2 -47.41 64.91 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.142 -0.623 . . . . 0.0 109.966 174.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.8 mtm -59.18 -46.54 88.13 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.92 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.515 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 37.9 pt -66.71 -41.03 87.44 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.974 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.231 178.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.18 -41.63 93.3 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.102 0.477 . . . . 0.0 110.191 179.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -58.71 -55.99 27.94 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.002 177.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.5 mt -61.8 -40.62 87.6 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.838 0 C-N-CA 124.173 0.989 . . . . 0.0 112.301 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 89.7 mt -55.8 -46.02 78.12 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.556 0.343 . . . . 0.0 111.321 177.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.466 ' HG2' HG22 ' A' ' 41' ' ' ILE . 44.7 mt-30 -69.99 -51.67 30.59 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.934 0.873 . . . . 0.0 109.792 179.295 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.8 ttt85 -54.84 -43.82 73.39 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 125.709 1.604 . . . . 0.0 111.506 -179.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -95.92 -14.87 22.77 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 115.601 1.704 . . . . 0.0 115.601 -176.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.503 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -64.84 -31.45 72.69 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 174.058 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 71' ' ' GLN . 91.3 mttt -70.47 -46.25 64.13 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.05 177.203 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -76.66 -50.53 13.49 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -173.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.7 pt -121.23 -29.64 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -174.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.52 ' O ' HG21 ' A' ' 82' ' ' VAL . . . 124.33 145.13 6.6 Favored Glycine 0 C--N 1.317 -0.488 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.8 tp -62.69 -39.26 84.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -175.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -62.83 -36.22 82.49 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-O 121.29 0.567 . . . . 0.0 111.808 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.566 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 16.3 m120 -65.54 -48.26 73.06 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.632 178.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.52 HG21 ' O ' ' A' ' 78' ' ' GLY . 19.5 t -64.42 -44.98 97.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.415 -177.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -50.82 -49.94 57.61 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.618 1.167 . . . . 0.0 110.137 179.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -43.31 79.48 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.604 -178.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 81.3 mt -64.85 -35.4 80.99 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.484 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.9 mm -64.97 -43.06 96.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.3 mt -62.0 -42.12 98.8 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.797 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.1 m -62.58 -32.16 73.1 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 123.911 0.885 . . . . 0.0 110.78 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.6 m -69.57 -43.95 71.82 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.279 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.7 pt -85.03 -41.6 15.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.518 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -98.87 115.04 27.95 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.14 79.06 2.96 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.898 0.856 . . . . 0.0 111.361 -179.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.487 ' CD ' ' HA ' ' A' ' 96' ' ' HIS . 8.2 tp10 -114.9 152.43 32.29 Favored 'General case' 0 N--CA 1.422 -1.842 0 CA-C-N 114.149 -1.387 . . . . 0.0 108.912 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -154.41 109.38 3.08 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -178.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 70.22 7.1 6.08 Favored 'General case' 0 N--CA 1.501 2.085 0 C-N-CA 124.246 1.018 . . . . 0.0 111.667 178.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.487 ' HA ' ' CD ' ' A' ' 93' ' ' GLU . 52.2 t-80 67.37 113.55 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.405 1.482 . . . . 0.0 111.513 -178.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -177.63 -25.63 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.222 -179.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -73.33 108.0 5.95 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.182 0.515 . . . . 0.0 112.115 -172.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 . . . . . 0 C--N 1.306 -1.319 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 177.849 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.3 t70 . . . . . 0 C--O 1.247 0.933 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.09 -23.69 62.37 Favored 'Trans proline' 0 CA--C 1.548 1.218 0 C-N-CA 123.804 3.002 . . . . 0.0 115.274 175.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.441 ' OE1' ' HG2' ' A' ' 65' ' ' MET . 32.8 mm-40 -65.14 -34.57 78.72 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.382 0.992 . . . . 0.0 109.917 179.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -67.36 -42.78 82.9 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.753 -177.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.487 ' O ' ' HG3' ' A' ' 14' ' ' GLN . 11.5 p -65.02 -34.59 71.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.123 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -65.69 -38.03 88.12 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.914 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.53 -44.58 93.15 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.503 0.668 . . . . 0.0 109.614 174.072 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -39.09 90.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.672 178.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.487 ' HG3' ' O ' ' A' ' 10' ' ' VAL . 96.0 mt-30 . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 122.73 0.412 . . . . 0.0 111.516 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.454 HG21 HG21 ' A' ' 24' ' ' VAL . 34.3 m . . . . . 0 N--CA 1.446 -0.64 0 CA-C-O 120.728 0.299 . . . . 0.0 110.773 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -76.69 113.25 14.12 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -58.31 -34.8 70.97 Favored 'General case' 0 C--N 1.308 -1.239 0 O-C-N 123.557 0.536 . . . . 0.0 110.607 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -74.94 -37.8 61.9 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.809 -173.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.554 ' O ' HG12 ' A' ' 27' ' ' ILE . 19.3 tp -77.44 -40.81 42.09 Favored 'General case' 0 N--CA 1.423 -1.817 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.747 -177.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.454 HG21 HG21 ' A' ' 19' ' ' VAL . 86.1 t -65.13 -39.1 84.44 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 59.9 ttp -57.86 -37.11 73.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.711 176.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -75.86 -40.13 55.27 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.431 177.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.554 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.4 mm -56.99 -51.75 64.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.449 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.05 -41.54 98.23 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-N 115.047 -0.978 . . . . 0.0 110.247 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -63.31 -45.12 92.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.412 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -62.9 -44.96 94.68 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.847 -175.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.515 ' CD1' HD13 ' A' ' 70' ' ' LEU . 46.0 pt -70.31 -37.01 69.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 119.875 -0.73 . . . . 0.0 109.74 176.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.19 -53.4 55.8 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 123.017 0.527 . . . . 0.0 111.223 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.47 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.1 pp -59.45 -33.69 71.59 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.47 ' N ' HD12 ' A' ' 33' ' ' LEU . 14.9 t70 -71.04 -47.89 55.94 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.146 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.3 tp . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 123.429 0.692 . . . . 0.0 112.266 -179.413 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.528 ' O ' HG12 ' A' ' 45' ' ' ILE . 14.4 tt . . . . . 0 N--CA 1.448 -0.546 0 CA-C-O 120.357 0.122 . . . . 0.0 110.892 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.522 ' HG2' ' OE1' ' A' ' 71' ' ' GLN . 42.7 mtmt -59.36 -48.67 80.75 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 177.089 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.1 m -65.21 -38.74 91.4 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.589 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.8 m -58.81 -41.09 85.96 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 120.863 0.363 . . . . 0.0 110.405 175.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.5 mm -58.77 -46.31 90.84 Favored 'Isoleucine or valine' 0 C--N 1.343 0.314 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 176.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 42' ' ' LYS . 67.6 mt -51.76 -49.61 35.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.208 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -61.14 -53.72 53.5 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.408 0.623 . . . . 0.0 110.71 -176.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 51.7 t -66.79 -42.82 89.82 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.891 -172.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -70.95 -37.63 72.82 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.44 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.533 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 36.2 t -73.47 -31.41 63.76 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.567 0.699 . . . . 0.0 109.798 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.3 t -73.54 -43.83 59.0 Favored 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.52 ' O ' HG12 ' A' ' 56' ' ' ILE . 68.9 m-70 -103.34 37.42 2.0 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 -176.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 50' ' ' SER . 80.0 mt -47.11 -41.66 17.7 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -57.46 -46.65 83.4 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.554 ' HA ' ' OE1' ' A' ' 55' ' ' GLU . 2.2 tp10 -74.58 -34.31 62.86 Favored 'General case' 0 N--CA 1.432 -1.325 0 C-N-CA 119.626 -0.83 . . . . 0.0 111.312 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 52' ' ' HIS . 47.1 mm -61.26 -45.28 98.92 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.174 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -71.76 -22.97 61.53 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.79 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.446 ' NZ ' ' HB2' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -68.53 -52.72 28.95 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.641 ' HB2' ' CE2' ' A' ' 63' ' ' TYR . 16.9 m120 -112.53 52.66 0.77 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.8 pttp -60.7 -31.55 70.82 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -66.44 -47.53 72.86 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 121.457 0.646 . . . . 0.0 109.396 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -63.12 -51.5 66.27 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 114.412 -1.267 . . . . 0.0 110.714 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.641 ' CE2' ' HB2' ' A' ' 59' ' ' ASN . 79.0 m-85 -68.99 -26.44 65.02 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -176.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -71.23 -50.72 30.0 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.146 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.441 ' HG2' ' OE1' ' A' ' 8' ' ' GLU . 73.6 mtm -66.0 -43.27 88.2 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.54 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.555 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 46.2 pt -65.93 -41.71 90.44 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.634 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.195 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.26 -39.0 71.9 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 117.893 0.315 . . . . 0.0 110.909 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -64.33 -56.6 13.33 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 177.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 95.2 mt -56.63 -44.33 80.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.446 1.099 . . . . 0.0 112.514 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.561 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 82.5 mt -54.57 -50.45 67.95 Favored 'General case' 0 C--O 1.212 -0.876 0 C-N-CA 123.531 0.732 . . . . 0.0 111.826 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.522 ' OE1' ' HG2' ' A' ' 42' ' ' LYS . 46.3 mt-30 -70.16 -45.67 66.27 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 121.984 0.897 . . . . 0.0 109.917 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 46.4 ttt85 -57.91 -45.41 86.54 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 126.62 1.968 . . . . 0.0 111.319 -176.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -94.48 -16.54 23.26 Favored 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.561 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.23 -33.91 77.12 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.054 178.601 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -68.12 -25.61 65.38 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.384 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -99.38 -47.61 5.09 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.9 pt -115.88 -20.79 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -177.376 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 111.15 142.43 9.01 Favored Glycine 0 CA--C 1.501 -0.795 0 N-CA-C 110.999 -0.841 . . . . 0.0 110.999 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.416 HG13 ' ND2' ' A' ' 83' ' ' ASN . 10.2 tp -62.45 -37.43 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 117.203 0.502 . . . . 0.0 111.559 -174.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -53.19 -48.09 68.34 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.858 0.837 . . . . 0.0 109.455 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.436 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 85.4 m-20 -68.0 -42.97 79.91 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 113.787 -1.551 . . . . 0.0 112.204 -178.594 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 78' ' ' GLY . 16.8 t -65.49 -45.8 91.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.3 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.416 ' ND2' HG13 ' A' ' 79' ' ' ILE . 94.0 m-20 -56.64 -42.81 79.52 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.435 0.636 . . . . 0.0 111.075 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -45.7 86.84 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.9 mt -63.09 -36.28 83.06 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.632 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.6 mm -64.44 -41.08 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.7 mt -62.41 -38.74 90.84 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-O 121.363 0.601 . . . . 0.0 110.558 176.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.4 m -64.91 -33.44 76.02 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.473 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 29.5 m -72.1 -31.7 66.3 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.488 0.715 . . . . 0.0 111.479 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.6 pt . . . . . 0 C--N 1.316 -0.858 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.621 -178.829 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.401 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 14.3 t70 . . . . . 0 C--O 1.243 0.745 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.441 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 13.9 Cg_exo -70.82 -31.53 15.65 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.665 2.243 . . . . 0.0 113.088 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.67 -35.95 57.61 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -61.32 -42.72 99.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.434 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.73 -34.26 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 CA-C-O 121.055 0.455 . . . . 0.0 109.988 178.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 63.5 mttp -63.08 -37.02 85.54 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 174.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.5 mt -63.31 -37.33 86.82 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.115 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.465 HH11 ' HA ' ' A' ' 89' ' ' THR . 24.9 tpt180 -67.5 -35.25 78.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.362 0.601 . . . . 0.0 109.76 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.084 178.474 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 30.1 m . . . . . 0 N--CA 1.44 -0.927 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -81.16 119.63 23.83 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 174.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CE1' HD22 ' A' ' 87' ' ' LEU . 86.2 t80 -53.25 -47.89 68.68 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.683 0.615 . . . . 0.0 111.692 -179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -59.15 -36.01 74.51 Favored 'General case' 0 CA--C 1.497 -1.09 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.173 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.599 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.2 tp -76.51 -42.62 42.68 Favored 'General case' 0 N--CA 1.419 -2.006 0 C-N-CA 119.441 -0.904 . . . . 0.0 111.248 -178.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.603 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 65.0 t -59.22 -44.71 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 118.205 0.457 . . . . 0.0 109.874 177.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 52.1 ttp -58.76 -38.03 77.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.991 177.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -72.69 -38.59 67.52 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.123 176.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.599 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.1 mm -57.25 -49.61 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 66.8 mt -63.96 -35.23 79.99 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.743 -1.117 . . . . 0.0 110.496 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.73 -44.64 63.77 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 124.139 0.976 . . . . 0.0 110.092 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.568 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 17.3 tt0 -69.7 -39.5 76.88 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.759 -177.251 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.432 HG21 HD13 ' A' ' 45' ' ' ILE . 41.7 pt -68.34 -37.05 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 119.832 -0.747 . . . . 0.0 109.185 176.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -58.73 -46.28 87.75 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.589 0.555 . . . . 0.0 111.086 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 30' ' ' GLU . 4.4 pp -63.88 -32.85 74.52 Favored 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -177.163 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.53 -48.74 18.41 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.364 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.42 HD13 ' HB ' ' A' ' 41' ' ' ILE . 51.8 tp . . . . . 0 CA--C 1.517 -0.309 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.748 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.552 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.8 tt . . . . . 0 C--O 1.224 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 111.333 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -63.21 -34.36 77.48 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.925 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.9 m -79.24 -33.86 43.22 Favored 'General case' 0 N--CA 1.419 -2.007 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.403 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 15.3 m -59.59 -41.26 89.89 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.571 176.195 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 41' ' ' ILE . 43.1 mm -53.76 -48.87 60.57 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.853 176.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 69.6 mt -53.5 -49.12 56.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.228 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.403 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 20.0 m-85 -63.63 -53.01 58.15 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.124 0.487 . . . . 0.0 110.417 -176.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.3 t -60.29 -46.03 95.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.449 -174.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -65.7 -37.54 86.74 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.06 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.0 m -72.85 -22.16 60.83 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.116 0.484 . . . . 0.0 111.092 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.1 t -90.09 -9.99 46.38 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.686 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.463 ' O ' HG12 ' A' ' 56' ' ' ILE . 87.2 m-70 -138.46 36.33 2.26 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 -178.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 80.9 mt -47.64 -38.62 15.15 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -174.107 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -53.79 -50.26 66.48 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.256 0.622 . . . . 0.0 112.275 -175.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.458 ' OE2' ' HD3' ' A' ' 58' ' ' LYS . 9.2 tp10 -73.69 -35.41 65.16 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.286 0.565 . . . . 0.0 109.654 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.5 mm -60.12 -50.0 81.9 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.301 -176.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 13.6 ptt180 -77.6 -24.73 49.6 Favored 'General case' 0 C--N 1.312 -1.041 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.533 -178.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.458 ' HD3' ' OE2' ' A' ' 55' ' ' GLU . 62.7 tttt -60.1 -43.28 95.66 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 123.204 0.601 . . . . 0.0 109.457 177.085 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -126.32 57.24 1.41 Allowed 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.898 178.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -60.77 -28.54 68.81 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.341 -175.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -61.52 -53.25 58.87 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.39 -50.6 73.33 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.08 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.507 ' HA ' HG12 ' A' ' 66' ' ' ILE . 71.2 m-85 -68.94 -30.4 68.84 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -176.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -75.03 -37.97 61.61 Favored 'General case' 0 C--O 1.248 1.0 0 C-N-CA 119.506 -0.877 . . . . 0.0 109.101 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.6 mtm -69.49 -48.08 61.8 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.142 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.515 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.6 pt -64.11 -38.84 83.49 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.713 0 C-N-CA 119.404 -0.919 . . . . 0.0 111.573 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.531 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.28 -39.74 67.21 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.884 0.373 . . . . 0.0 110.978 178.714 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.1 -55.69 11.57 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.377 178.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.4 mt -58.12 -41.3 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.805 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.623 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 94.5 mt -56.44 -47.93 78.08 Favored 'General case' 0 C--O 1.213 -0.837 0 C-N-CA 122.633 0.373 . . . . 0.0 111.11 179.159 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.531 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.0 mt-30 -65.08 -50.01 67.81 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.726 0.774 . . . . 0.0 109.714 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -57.9 -52.95 63.39 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-N 114.009 -1.45 . . . . 0.0 112.076 -177.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -83.41 -19.88 35.18 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.623 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.36 -34.41 77.24 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.509 -0.876 . . . . 0.0 109.708 175.714 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HG3' ' CE2' ' A' ' 74' ' ' TYR . 55.2 mttp -81.62 -16.76 50.46 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 174.267 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -86.84 -51.33 6.13 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.564 177.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.8 pt -121.23 -30.5 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.535 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 128.65 138.83 4.61 Favored Glycine 0 C--N 1.314 -0.676 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.237 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.5 tp -58.39 -39.34 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 122.968 0.507 . . . . 0.0 112.112 -174.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -57.9 -43.99 86.5 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.581 0.705 . . . . 0.0 110.609 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.444 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 40.4 m-80 -67.26 -46.83 72.52 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.34 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 78' ' ' GLY . 23.5 t -61.96 -47.69 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.129 -176.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.4 ' CG ' ' HB3' ' A' ' 28' ' ' LEU . 96.4 m-20 -56.86 -42.06 79.06 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 123.58 0.55 . . . . 0.0 111.339 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -47.7 79.48 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 179.092 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 88.3 mt -62.74 -29.6 70.8 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.8 mm -64.82 -42.28 94.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.401 HD22 ' CE1' ' A' ' 21' ' ' PHE . 85.4 mt -64.01 -38.67 91.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.936 178.116 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.1 m -61.53 -33.92 74.64 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.146 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.465 ' HA ' HH11 ' A' ' 13' ' ' ARG . 23.0 m -73.61 -40.17 64.03 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 120.592 0.235 . . . . 0.0 111.425 -178.227 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 42.3 pt . . . . . 0 C--N 1.319 -0.739 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.504 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.445 ' OD2' ' HD2' ' A' ' 72' ' ' ARG . 12.1 t70 . . . . . 0 C--O 1.245 0.838 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -68.19 -30.66 30.87 Favored 'Trans proline' 0 C--O 1.24 0.593 0 C-N-CA 122.707 2.271 . . . . 0.0 113.466 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -76.11 -38.17 57.19 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -59.29 -43.57 92.57 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.151 -1.386 . . . . 0.0 111.366 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.6 p -65.38 -34.96 73.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.606 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.428 ' HE3' ' SD ' ' A' ' 65' ' ' MET . 56.6 mtmt -66.8 -36.45 82.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.744 176.233 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.8 -39.54 94.57 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -57.95 -37.79 74.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.318 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 . . . . . 0 C--N 1.315 -0.931 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.779 -179.152 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.4 HG21 HG21 ' A' ' 24' ' ' VAL . 27.6 m . . . . . 0 C--O 1.252 1.223 0 CA-C-O 120.87 0.367 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -91.68 129.93 37.57 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -51.99 -41.41 62.16 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 124.034 0.934 . . . . 0.0 111.195 177.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -67.7 -37.46 82.32 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.532 -175.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.525 ' O ' HG12 ' A' ' 27' ' ' ILE . 15.9 tp -77.19 -35.93 55.38 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.119 -176.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 88.6 t -68.88 -42.57 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.644 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 56.1 ttp -60.91 -33.61 73.4 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.931 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -70.63 -42.93 70.24 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 123.085 0.24 . . . . 0.0 110.747 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.83 -49.07 80.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.6 mt -63.76 -40.09 95.87 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.713 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -67.41 -47.39 70.39 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.148 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -62.01 -38.96 90.6 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.704 -176.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.472 ' CD1' HD13 ' A' ' 70' ' ' LEU . 35.0 pt -73.06 -38.25 55.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.705 176.01 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -58.22 -52.85 63.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 124.124 0.97 . . . . 0.0 111.029 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -63.52 -30.07 71.25 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.179 -178.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.7 -49.51 18.09 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.391 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.4 tp . . . . . 0 C--N 1.317 -0.838 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.356 -175.618 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.519 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.5 tt . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.487 ' O ' HG13 ' A' ' 46' ' ' ILE . 63.7 pttt -61.21 -36.03 78.82 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.159 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.4 m -74.01 -35.29 64.39 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.783 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.418 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 16.7 m -63.17 -39.63 95.2 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 175.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.519 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.7 mm -57.07 -46.36 84.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.698 176.015 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 42' ' ' LYS . 69.7 mt -53.22 -47.01 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.871 -178.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.418 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 14.4 m-85 -62.35 -52.15 64.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.555 0.693 . . . . 0.0 110.233 -177.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.0 t -66.19 -42.64 91.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.904 -173.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -67.94 -34.58 76.86 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.215 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.9 m -76.36 -24.24 54.17 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.323 0.582 . . . . 0.0 111.058 178.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.3 t -79.67 -29.31 40.82 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.037 0.446 . . . . 0.0 110.488 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.482 ' O ' HG12 ' A' ' 56' ' ' ILE . 67.4 m-70 -120.76 37.64 4.24 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -175.266 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 87.5 mt -47.02 -51.7 16.69 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 -175.345 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.592 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 3.8 p30 -59.68 -33.02 71.04 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -73.89 -46.3 45.41 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 121.193 0.52 . . . . 0.0 110.041 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 52' ' ' HIS . 47.3 mm -56.27 -40.96 68.91 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.15 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.627 179.053 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 82.8 mtp180 -63.38 -38.73 92.3 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 177.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.592 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 50.5 mttp -63.15 -48.37 78.74 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.861 0.838 . . . . 0.0 110.532 -176.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -123.43 51.72 1.46 Allowed 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.918 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -59.7 -19.62 50.98 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.955 -1.021 . . . . 0.0 111.986 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.401 ' H ' ' HG3' ' A' ' 61' ' ' GLU . 18.8 mt-10 -61.01 -57.81 11.05 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.374 1.083 . . . . 0.0 108.094 174.204 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -65.87 -51.25 60.38 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.194 -1.821 . . . . 0.0 109.969 -176.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.472 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.7 m-85 -66.99 -25.95 66.57 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -175.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -83.68 -39.43 20.21 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 118.728 -1.189 . . . . 0.0 109.896 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.468 ' O ' HG13 ' A' ' 69' ' ' ILE . 73.3 mtm -64.11 -44.27 92.77 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.476 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.6 pt -62.74 -38.59 82.1 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.302 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.938 178.195 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.415 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -52.68 -45.5 66.84 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.399 0.437 . . . . 0.0 111.797 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -74.5 -36.33 63.22 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 119.922 -0.711 . . . . 0.0 112.139 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 65' ' ' MET . 80.4 mt -63.99 -46.23 94.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-O 120.627 0.251 . . . . 0.0 110.347 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.544 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 79.6 mt -54.07 -45.33 71.69 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 123.461 0.704 . . . . 0.0 110.987 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.506 ' HG2' HG23 ' A' ' 41' ' ' ILE . 48.5 mt-30 -66.65 -49.38 66.38 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.574 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.445 ' HD2' ' OD2' ' A' ' 6' ' ' ASP . 41.4 ttm180 -61.31 -45.22 95.33 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 124.48 1.112 . . . . 0.0 111.74 -177.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -88.93 -18.09 28.19 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -176.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.544 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.49 -29.4 68.82 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 173.094 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -71.9 -31.58 66.55 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.871 175.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -86.44 -52.08 5.81 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -177.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.1 pt -121.25 -27.22 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -172.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.602 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 121.85 146.66 7.4 Favored Glycine 0 CA--C 1.496 -1.124 0 C-N-CA 119.513 -1.327 . . . . 0.0 111.804 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.1 tp -61.8 -40.14 85.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -56.16 -46.35 79.34 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-O 121.825 0.821 . . . . 0.0 110.137 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.428 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 91.4 m-20 -65.03 -44.16 90.01 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 114.051 -1.431 . . . . 0.0 111.623 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.9 t -65.45 -42.79 94.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.467 -177.097 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -57.33 -44.97 84.71 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.264 0.554 . . . . 0.0 110.655 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.75 -43.06 94.56 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 86.7 mt -65.95 -37.34 85.78 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.1 mm -63.87 -41.06 91.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 176.049 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.2 mt -62.98 -39.45 94.76 Favored 'General case' 0 C--O 1.21 -1.01 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.515 175.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 50.0 m -63.82 -33.31 75.4 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.65 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 41.2 m -70.49 -37.71 74.24 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.336 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.5 pt . . . . . 0 C--N 1.317 -0.833 0 C-N-CA 119.884 -0.726 . . . . 0.0 111.597 179.482 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.452 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.8 t70 . . . . . 0 N--CA 1.44 -0.97 0 N-CA-C 110.652 -0.129 . . . . 0.0 110.652 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 7.9 Cg_exo -69.84 -29.12 23.97 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.547 2.164 . . . . 0.0 113.131 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.471 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 20.0 mm-40 -75.38 -31.34 60.43 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -178.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -62.73 -40.75 98.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.902 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -71.28 -34.35 53.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.05 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -61.75 -36.07 79.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.037 173.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 95.5 mt -60.69 -35.84 77.29 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.602 176.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 mmt85 -65.04 -29.36 70.25 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.163 0.506 . . . . 0.0 110.318 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.515 179.435 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.6 m . . . . . 0 C--O 1.253 1.252 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -74.72 121.81 22.28 Favored 'General case' 0 CA--C 1.499 -0.995 0 C-N-CA 119.881 -0.728 . . . . 0.0 109.522 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -55.48 -41.54 73.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -56.68 -42.13 78.52 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.79 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.601 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.6 tp -75.64 -43.1 49.51 Favored 'General case' 0 N--CA 1.417 -2.119 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.658 -175.431 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.0 t -63.82 -38.97 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.2 ttp -59.81 -35.04 73.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.989 176.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -75.83 -41.7 51.85 Favored 'General case' 0 C--O 1.197 -1.667 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.449 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.601 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.5 mm -55.97 -51.2 63.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 121.456 0.646 . . . . 0.0 109.73 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 76.2 mt -64.69 -34.14 77.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.878 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -72.45 -44.87 61.76 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 122.024 0.916 . . . . 0.0 109.979 -179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -65.62 -37.84 87.73 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.893 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.403 HG21 HD13 ' A' ' 45' ' ' ILE . 33.7 pt -72.07 -37.87 61.6 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.852 176.042 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -61.5 -52.53 64.13 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 124.165 0.986 . . . . 0.0 110.908 -178.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.19 -30.9 71.95 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 116.322 -0.399 . . . . 0.0 112.06 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -75.43 -46.54 32.12 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.971 0.415 . . . . 0.0 110.231 178.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.497 HD21 ' CE1' ' A' ' 74' ' ' TYR . 58.7 tp . . . . . 0 C--O 1.243 0.758 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.889 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.582 ' O ' HG12 ' A' ' 45' ' ' ILE . 14.8 tt . . . . . 0 C--O 1.214 -0.788 0 CA-C-O 120.622 0.249 . . . . 0.0 110.454 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.492 ' O ' HG13 ' A' ' 46' ' ' ILE . 49.7 mtpt -55.31 -50.09 70.49 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-O 121.688 0.756 . . . . 0.0 110.008 174.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.0 m -59.05 -47.12 86.39 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 113.707 -1.588 . . . . 0.0 110.279 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 23.1 m -58.34 -39.55 79.77 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 123.771 0.669 . . . . 0.0 111.077 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.3 mm -58.2 -42.54 83.66 Favored 'Isoleucine or valine' 0 C--N 1.344 0.326 0 C-N-CA 123.145 0.578 . . . . 0.0 109.812 176.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 42' ' ' LYS . 63.9 mt -59.36 -47.45 90.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.59 -175.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -61.79 -50.79 70.92 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 121.671 0.748 . . . . 0.0 109.462 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.52 -47.22 93.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.573 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -64.99 -39.57 93.66 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.837 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.9 m -70.17 -27.57 64.64 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.135 0.493 . . . . 0.0 111.457 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -82.34 -32.11 29.52 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.306 0.574 . . . . 0.0 110.42 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.548 ' O ' HG12 ' A' ' 56' ' ' ILE . 90.0 m-70 -114.97 35.52 4.28 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.447 -174.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.6 mt -47.35 -39.0 14.01 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.65 1.18 . . . . 0.0 113.734 -177.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.516 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 12.3 t70 -54.17 -50.85 66.07 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -73.79 -38.08 64.75 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.624 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.548 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.8 mm -56.5 -52.14 56.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.668 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.949 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.06 -36.8 82.84 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -176.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 33.4 mtmm -71.78 -24.79 61.81 Favored 'General case' 0 CA--C 1.51 -0.572 0 C-N-CA 119.921 -0.712 . . . . 0.0 111.277 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -130.24 49.71 2.26 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -178.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.464 ' H ' ' HD3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -57.54 -31.07 65.73 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.58 -1.191 . . . . 0.0 112.773 -177.782 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.67 -50.23 67.84 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -59.84 -50.77 72.48 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.501 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.486 ' HA ' HG12 ' A' ' 66' ' ' ILE . 69.6 m-85 -69.7 -25.6 63.95 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -177.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -75.73 -44.63 40.91 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 176.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.1 mtm -61.13 -50.83 71.61 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.33 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.597 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.6 pt -64.43 -38.73 83.34 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.746 0 C-N-CA 119.47 -0.892 . . . . 0.0 111.801 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.457 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -59.31 -41.02 88.04 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 117.927 0.331 . . . . 0.0 110.642 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.28 -55.32 29.47 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 89.8 mt -58.03 -42.4 82.71 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 CA-C-N 115.212 -0.903 . . . . 0.0 111.929 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.4 mt -54.55 -47.87 72.69 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 122.812 0.445 . . . . 0.0 111.284 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 64.5 mt-30 -69.73 -47.95 61.24 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.74 0.781 . . . . 0.0 109.557 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -59.47 -43.06 93.31 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 113.989 -1.459 . . . . 0.0 110.782 -176.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.404 ' CE2' ' HD2' ' A' ' 76' ' ' LYS . 40.0 m-85 -93.68 -15.5 25.22 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -177.279 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.497 ' CE1' HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -67.75 -29.71 69.0 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 174.291 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -77.61 -28.33 51.49 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.75 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.404 ' HD2' ' CE2' ' A' ' 73' ' ' TYR . 41.1 ttmt -87.1 -51.64 5.88 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.256 -0.577 . . . . 0.0 111.486 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.3 pt -119.52 -26.71 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -173.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.535 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 117.04 148.17 8.77 Favored Glycine 0 C--N 1.307 -1.057 0 C-N-CA 120.298 -0.953 . . . . 0.0 110.996 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.8 tp -64.87 -37.87 81.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 117.029 0.414 . . . . 0.0 111.999 -174.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -55.92 -42.84 76.7 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 122.125 0.965 . . . . 0.0 110.148 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.484 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 48.6 m-80 -67.05 -50.06 63.15 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.145 -1.388 . . . . 0.0 111.324 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.3 t -61.67 -39.55 83.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -177.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -51.05 -50.39 58.74 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.868 1.267 . . . . 0.0 110.129 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.11 -40.58 71.4 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.062 -177.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.7 mt -64.9 -34.8 79.25 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.125 -178.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.8 mm -68.38 -41.96 83.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.534 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.5 mt -62.11 -40.73 96.88 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.137 0.494 . . . . 0.0 110.889 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 48.9 m -63.96 -33.38 75.6 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.786 177.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.4 m -74.19 -48.26 30.24 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.989 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.4 pt . . . . . 0 C--N 1.326 -0.443 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -176.154 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 15.0 t70 . . . . . 0 N--CA 1.448 -0.562 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.518 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 17.3 Cg_exo -69.76 -28.26 25.48 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.947 2.432 . . . . 0.0 113.9 177.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -75.16 -33.27 61.48 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -60.17 -44.57 94.92 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.484 -1.234 . . . . 0.0 110.552 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -66.78 -34.09 67.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.235 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.2 mttt -62.77 -37.2 85.7 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.217 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.38 -38.17 88.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.151 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.6 mtp180 -72.4 -25.43 61.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.31 0.576 . . . . 0.0 110.339 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 . . . . . 0 CA--C 1.547 0.828 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.212 174.679 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 29.7 m . . . . . 0 N--CA 1.432 -1.347 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -74.92 121.85 22.54 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.316 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -53.43 -50.62 64.83 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.681 0.613 . . . . 0.0 111.658 -178.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -64.61 -29.54 70.55 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.359 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.617 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.2 tp -75.93 -39.6 55.85 Favored 'General case' 0 N--CA 1.425 -1.703 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.054 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 62.8 t -63.36 -43.21 98.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 175.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 60.7 ttp -57.94 -39.34 77.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.667 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.736 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 58.9 tt0 -67.63 -45.42 75.44 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.736 176.016 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.617 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.6 mm -55.93 -44.8 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 CA-C-O 121.403 0.621 . . . . 0.0 110.047 -179.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 68.5 mt -68.65 -33.87 74.74 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.7 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -71.63 -43.6 65.87 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.197 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.736 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.7 mm-40 -53.66 -53.99 44.19 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.664 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.461 HG21 HD13 ' A' ' 45' ' ' ILE . 31.7 pt -67.59 -34.28 67.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.37 -177.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -63.23 -51.46 66.17 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.317 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.423 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.4 pp -72.19 -30.29 64.81 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.462 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.423 ' N ' HD12 ' A' ' 33' ' ' LEU . 15.6 t70 -75.11 -45.43 41.18 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.245 -178.137 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.2 tt . . . . . 0 N--CA 1.444 -0.734 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -176.981 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.464 ' O ' HG12 ' A' ' 45' ' ' ILE . 13.9 tt . . . . . 0 N--CA 1.434 -1.236 0 N-CA-C 111.425 0.158 . . . . 0.0 111.425 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.559 ' O ' HG13 ' A' ' 46' ' ' ILE . 11.2 ptmm? -65.52 -32.33 73.87 Favored 'General case' 0 CA--C 1.509 -0.624 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.535 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.4 m -66.3 -44.61 82.99 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.065 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.42 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 48.4 m -63.68 -38.36 90.83 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.339 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 41' ' ' ILE . 25.7 mm -54.68 -43.57 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.55 0.74 . . . . 0.0 110.077 175.306 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 42' ' ' LYS . 74.6 mt -54.6 -50.26 60.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.597 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.42 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 20.2 m-85 -62.88 -53.1 59.34 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.511 0.672 . . . . 0.0 110.321 -177.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 44' ' ' SER . 60.2 t -58.78 -44.94 91.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.667 -176.05 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -71.21 -27.37 63.45 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.9 m -80.95 -25.48 37.36 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.372 0.606 . . . . 0.0 110.372 176.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.1 t -78.07 -52.94 7.98 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.489 177.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.566 ' O ' HG12 ' A' ' 56' ' ' ILE . 86.0 m-70 -98.46 48.53 0.99 Allowed 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.316 -172.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 98.2 mt -48.59 -48.04 39.34 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -175.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 3.1 t70 -54.11 -52.04 62.26 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -174.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -72.59 -32.18 65.78 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.759 -0.776 . . . . 0.0 110.031 -176.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.566 HG12 ' O ' ' A' ' 52' ' ' HIS . 44.7 mm -63.57 -49.74 81.18 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.033 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.101 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.3 ptt-85 -69.76 -29.81 67.24 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -175.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 54' ' ' ASP . 32.5 mmtp -70.98 -34.05 71.03 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.012 0.434 . . . . 0.0 110.661 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -131.36 53.91 1.95 Allowed 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -59.65 -35.04 73.63 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.208 -176.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -64.38 -40.47 95.89 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 120.955 0.407 . . . . 0.0 110.925 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -65.61 -50.13 66.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.382 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.557 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.3 m-85 -68.88 -34.26 75.14 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -177.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.61 -45.09 76.45 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.274 177.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.6 mtm -65.69 -44.0 87.54 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.998 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.596 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 45.0 pt -66.04 -39.08 83.54 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.824 0 C-N-CA 118.588 -1.245 . . . . 0.0 111.173 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.576 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.05 -40.67 73.87 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 117.99 0.359 . . . . 0.0 110.839 178.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.89 -54.15 35.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.749 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 98.1 mt -58.27 -41.47 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.289 -179.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 96.9 mt -55.97 -48.73 75.28 Favored 'General case' 0 C--O 1.216 -0.694 0 C-N-CA 122.989 0.516 . . . . 0.0 111.506 178.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 57.3 mt-30 -68.37 -45.82 71.76 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.483 0.658 . . . . 0.0 109.78 -178.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 45.3 ttm180 -57.81 -49.34 76.98 Favored 'General case' 0 N--CA 1.424 -1.76 0 C-N-CA 124.71 1.204 . . . . 0.0 111.831 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.41 ' CE2' ' HD3' ' A' ' 76' ' ' LYS . 66.1 m-85 -87.86 -15.06 37.8 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 -176.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.538 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.14 -32.37 73.44 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 174.753 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.43 ' NZ ' ' HB3' ' A' ' 75' ' ' LYS . 7.2 mtpm? -81.25 -18.02 47.44 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.144 176.551 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.41 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 64.7 tttm -94.48 -47.42 6.56 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.163 -176.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.1 pt -126.55 -30.09 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.583 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 123.77 142.89 6.13 Favored Glycine 0 CA--C 1.499 -0.908 0 C-N-CA 120.238 -0.982 . . . . 0.0 112.043 177.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.3 tp -62.03 -33.64 59.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 117.018 0.409 . . . . 0.0 111.372 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.45 ' H ' ' CD ' ' A' ' 80' ' ' GLU . 2.3 mp0 -53.59 -49.47 67.7 Favored 'General case' 0 C--O 1.248 0.979 0 CA-C-O 122.376 1.084 . . . . 0.0 109.156 177.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -68.47 -46.98 68.27 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 113.795 -1.548 . . . . 0.0 110.756 -177.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.3 t -62.99 -38.24 81.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.737 -177.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -52.92 -50.34 64.16 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.673 0.749 . . . . 0.0 109.429 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -39.33 73.71 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.234 -178.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.444 ' O ' ' HB ' ' A' ' 88' ' ' THR . 87.0 mt -68.12 -32.77 73.29 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -178.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 82' ' ' VAL . 43.7 mm -67.12 -37.69 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 CA-C-O 121.777 0.799 . . . . 0.0 108.983 175.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.36 -38.68 88.16 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.135 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 85' ' ' LEU . 90.5 m -61.3 -34.47 75.27 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.973 0.909 . . . . 0.0 110.562 175.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 28.7 m -57.32 -49.97 74.43 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.955 0.902 . . . . 0.0 110.47 -177.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.5 pt . . . . . 0 C--N 1.318 -0.787 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.985 -176.3 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.486 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 14.3 t70 . . . . . 0 N--CA 1.441 -0.923 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.498 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 5.5 Cg_exo -71.58 -25.62 20.76 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.59 2.193 . . . . 0.0 113.426 -178.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -76.84 -40.13 48.83 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -59.49 -41.54 90.07 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.085 178.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 7' ' ' PRO . 7.8 p -66.09 -34.55 70.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-O 121.347 0.594 . . . . 0.0 110.043 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 64.4 mttp -65.04 -35.48 81.29 Favored 'General case' 0 C--O 1.217 -0.655 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 176.292 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.69 -42.47 98.97 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.537 ' HG2' HG23 ' A' ' 89' ' ' THR . 38.0 mtm180 -66.79 -30.2 70.34 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 121.724 0.774 . . . . 0.0 110.027 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 . . . . . 0 C--N 1.311 -1.065 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.621 177.679 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 9.2 m . . . . . 0 N--CA 1.435 -1.196 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -75.79 125.38 28.96 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -56.04 -36.12 67.66 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 123.521 0.513 . . . . 0.0 110.916 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -73.49 -31.55 63.79 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.045 -177.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.609 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.5 tp -76.61 -39.69 51.68 Favored 'General case' 0 N--CA 1.42 -1.927 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.217 -177.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.502 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 60.3 t -64.26 -44.4 97.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 176.013 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 14.9 tmm? -58.85 -32.4 69.4 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.465 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.685 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 63.8 tt0 -74.49 -42.13 59.5 Favored 'General case' 0 C--O 1.192 -1.933 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.483 176.269 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.609 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.2 mm -56.24 -44.51 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 CA-C-O 121.672 0.749 . . . . 0.0 109.255 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 69.9 mt -67.33 -31.34 71.55 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.668 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -72.4 -48.61 40.05 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.014 0.926 . . . . 0.0 110.115 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.685 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.2 mm-40 -53.79 -53.85 46.6 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.414 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.6 pt -66.77 -38.53 81.7 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.546 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.224 -177.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -58.71 -49.21 78.42 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.269 0.628 . . . . 0.0 111.494 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -71.38 -32.66 68.74 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -75.52 -36.99 60.38 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.8 0.81 . . . . 0.0 109.653 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.413 HD21 ' CD1' ' A' ' 74' ' ' TYR . 46.0 tp . . . . . 0 C--N 1.316 -0.89 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.265 177.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.549 ' O ' HG12 ' A' ' 45' ' ' ILE . 12.0 tt . . . . . 0 C--O 1.227 -0.118 0 CA-C-O 120.558 0.218 . . . . 0.0 110.812 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.5 pttp -61.86 -33.6 74.47 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.324 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.5 m -72.2 -43.1 65.0 Favored 'General case' 0 C--O 1.25 1.119 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.5 m -58.58 -41.92 86.83 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.125 178.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 41' ' ' ILE . 37.0 mm -52.55 -46.69 48.76 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.388 177.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 42' ' ' LYS . 64.7 mt -56.05 -50.52 69.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.448 -176.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -58.18 -53.01 63.11 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.895 0.855 . . . . 0.0 109.9 -176.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.414 HG22 ' HB3' ' A' ' 30' ' ' GLU . 40.9 t -62.06 -47.56 92.58 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.712 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.718 -176.017 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -68.17 -35.93 78.81 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.665 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.1 t -77.4 -24.92 50.41 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.311 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.6 t -86.8 -19.47 28.98 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.16 0.505 . . . . 0.0 111.048 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.487 ' O ' HG12 ' A' ' 56' ' ' ILE . 76.7 m-70 -124.46 36.85 4.53 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 -177.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.496 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 82.9 mt -47.21 -41.8 18.94 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -174.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -53.66 -50.07 66.59 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -175.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.567 ' OE1' ' HD3' ' A' ' 58' ' ' LYS . 3.7 tp10 -72.99 -36.04 66.97 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.4 mm -63.21 -50.62 78.34 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.141 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.566 -177.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 6.9 ptm180 -70.49 -25.83 63.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.921 0.391 . . . . 0.0 111.762 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.567 ' HD3' ' OE1' ' A' ' 55' ' ' GLU . 78.7 tttt -65.33 -42.96 92.38 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 123.604 0.761 . . . . 0.0 109.984 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -127.22 58.79 1.44 Allowed 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 177.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.457 ' HG3' ' OE2' ' A' ' 61' ' ' GLU . 14.1 ptmm? -60.32 -32.32 71.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.828 -175.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.457 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 3.4 mp0 -65.57 -41.87 92.42 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.873 0.368 . . . . 0.0 110.213 177.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -64.01 -51.74 62.83 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.692 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.512 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.9 m-85 -67.01 -34.08 76.96 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -177.562 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -66.22 -45.36 80.96 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.585 177.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.8 mtm -66.22 -44.5 83.65 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.872 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.514 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 45.3 pt -67.37 -40.53 84.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.682 0 C-N-CA 118.939 -1.104 . . . . 0.0 112.348 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.92 -35.35 68.92 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 118.482 0.583 . . . . 0.0 110.876 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -67.09 -54.93 16.74 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.083 177.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.4 mt -62.7 -39.55 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.235 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 96.9 mt -54.55 -49.2 70.87 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.009 0.524 . . . . 0.0 111.433 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.507 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 55.1 mt-30 -65.17 -45.4 85.07 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.677 0.751 . . . . 0.0 109.646 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -57.57 -42.72 83.65 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 125.805 1.642 . . . . 0.0 112.07 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -97.21 -15.83 20.68 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -178.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.414 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.24 -34.42 77.41 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 118.881 0.764 . . . . 0.0 109.567 177.634 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -79.08 -17.68 54.74 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.533 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -99.83 -51.37 3.74 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.285 -172.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.3 pt -119.31 -20.71 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.573 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 117.32 140.25 6.58 Favored Glycine 0 C--N 1.308 -0.988 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.6 tp -64.72 -37.89 81.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.908 0.354 . . . . 0.0 111.922 -173.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.72 -45.28 82.0 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 122.021 0.915 . . . . 0.0 109.722 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.462 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 79.8 m-20 -61.55 -48.62 80.16 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 113.953 -1.476 . . . . 0.0 111.112 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.6 t -62.34 -44.77 99.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 O-C-N 123.59 0.556 . . . . 0.0 110.441 -177.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -55.1 -47.2 75.28 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.157 0.504 . . . . 0.0 111.973 -178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -40.24 86.69 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 99.0 mt -65.01 -36.92 85.93 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.665 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.3 mm -63.73 -40.25 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 121.136 0.493 . . . . 0.0 109.917 176.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 92.2 mt -65.2 -37.1 86.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.92 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 58.3 m -67.16 -33.62 75.81 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.81 0.814 . . . . 0.0 109.898 176.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.537 HG23 ' HG2' ' A' ' 13' ' ' ARG . 87.6 m -66.59 -44.54 81.88 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.927 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 41.6 pt . . . . . 0 C--N 1.323 -0.578 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -176.13 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.416 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.9 t70 . . . . . 0 N--CA 1.441 -0.887 0 N-CA-C 111.491 0.182 . . . . 0.0 111.491 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 4.0 Cg_exo -72.04 -28.67 15.76 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.608 2.206 . . . . 0.0 112.813 -178.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.415 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 18.0 mm-40 -75.03 -35.69 61.93 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -61.03 -47.47 86.26 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.238 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.5 p -63.37 -34.67 68.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.472 0.653 . . . . 0.0 110.908 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -71.01 -31.82 68.44 Favored 'General case' 0 C--O 1.198 -1.61 0 O-C-N 121.951 -0.468 . . . . 0.0 112.245 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 94.0 mt -62.5 -36.79 83.67 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.277 0.56 . . . . 0.0 110.509 176.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -62.03 -38.82 90.14 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.697 177.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 . . . . . 0 C--N 1.313 -1.004 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.336 179.445 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.4 m . . . . . 0 C--O 1.256 1.43 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.428 ' O ' HG23 ' A' ' 24' ' ' VAL . 45.7 t-20 -81.33 117.87 22.17 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 174.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -58.31 -32.52 68.54 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 123.321 0.388 . . . . 0.0 111.09 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -66.74 -41.73 87.36 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.03 -174.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.586 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.1 tp -77.02 -38.7 52.43 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.234 -176.701 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 20' ' ' ASN . 56.6 t -59.86 -41.88 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 CA-C-O 121.088 0.471 . . . . 0.0 110.094 178.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 15.9 tmm? -57.92 -40.9 81.54 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.071 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -74.76 -36.26 62.58 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.005 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.5 mm -56.61 -47.12 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 81.0 mt -65.1 -41.16 95.23 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.332 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -64.56 -47.3 79.27 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.755 0.788 . . . . 0.0 110.655 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -59.57 -45.37 92.04 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.322 -177.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.416 ' CD1' HD13 ' A' ' 70' ' ' LEU . 35.4 pt -71.71 -39.67 69.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.376 178.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -54.69 -51.6 65.02 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.501 1.12 . . . . 0.0 111.347 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.38 -28.86 67.48 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -76.03 -49.94 16.19 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.746 0.784 . . . . 0.0 110.225 177.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.1 tp . . . . . 0 C--N 1.314 -0.971 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.581 -177.654 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.515 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.5 tt . . . . . 0 N--CA 1.473 0.679 0 CA-C-O 121.29 0.567 . . . . 0.0 110.358 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.53 ' O ' HG13 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.18 -28.19 68.95 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.967 177.019 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.4 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 11.9 m -79.01 -37.58 38.8 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.46 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 16.1 m -59.96 -40.71 89.97 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 41' ' ' ILE . 44.2 mm -55.64 -49.72 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.245 175.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 42' ' ' LYS . 78.1 mt -53.59 -49.02 58.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.369 -177.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.46 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 22.9 m-85 -60.03 -52.83 63.72 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.734 0.778 . . . . 0.0 110.141 -177.053 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.6 t -63.83 -43.76 97.96 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.796 -174.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -68.88 -34.38 75.34 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.358 -179.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.6 m -75.99 -21.51 56.85 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.194 0.521 . . . . 0.0 110.978 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 37.5 t -86.09 -41.12 15.04 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.009 0.433 . . . . 0.0 110.701 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.515 ' O ' HG12 ' A' ' 56' ' ' ILE . 84.1 m-70 -107.22 43.31 1.19 Allowed 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -176.134 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 81.0 mt -47.01 -41.93 17.28 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -175.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.669 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 34.0 t70 -58.93 -50.39 74.22 Favored 'General case' 0 C--O 1.209 -1.039 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -172.023 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -72.0 -28.41 63.38 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.998 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.7 mm -64.92 -45.04 95.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 0.5 OUTLIER -73.67 -25.2 60.14 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.428 178.513 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.669 ' HG2' ' O ' ' A' ' 54' ' ' ASP . 74.2 mmtt -65.37 -51.39 60.79 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 176.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -123.34 65.62 1.0 Allowed 'General case' 0 CA--C 1.496 -1.121 0 CA-C-O 121.433 0.635 . . . . 0.0 111.655 -178.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.432 ' HD3' ' H ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -66.93 -17.3 64.84 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.174 179.552 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.3 mp0 -64.71 -58.19 6.96 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 173.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -60.08 -49.7 76.6 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.122 -1.399 . . . . 0.0 111.014 -176.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.458 ' HA ' HG12 ' A' ' 66' ' ' ILE . 75.1 m-85 -67.68 -30.26 69.74 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -176.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -73.87 -41.47 62.14 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 119.452 -0.899 . . . . 0.0 109.825 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 84.8 mtp -63.72 -49.24 73.86 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.162 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.9 pt -66.2 -38.6 82.29 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.316 0 C-N-CA 119.729 -0.789 . . . . 0.0 111.741 -179.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.515 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -55.62 -39.7 71.15 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.616 0.246 . . . . 0.0 111.147 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -67.85 -51.7 45.28 Favored 'General case' 0 C--O 1.251 1.155 0 CA-C-O 121.598 0.713 . . . . 0.0 109.694 178.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.3 mt -57.84 -45.01 87.36 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.317 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.567 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 85.4 mt -55.22 -46.37 75.95 Favored 'General case' 0 C--O 1.212 -0.874 0 C-N-CA 123.173 0.589 . . . . 0.0 110.97 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 75.5 mt-30 -61.53 -52.12 65.76 Favored 'General case' 0 C--O 1.256 1.418 0 CA-C-O 121.372 0.606 . . . . 0.0 110.363 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -57.7 -54.74 43.43 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.631 -176.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -82.65 -16.36 48.56 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -173.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.567 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -63.79 -39.06 93.33 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 176.16 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -81.32 -37.05 28.97 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.422 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -72.21 -50.63 26.07 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.991 -176.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.8 pt -118.69 -29.99 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -178.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.583 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 129.67 136.02 4.0 Favored Glycine 0 C--N 1.31 -0.878 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.458 ' HB ' ' HB2' ' A' ' 74' ' ' TYR . 9.0 tp -60.01 -38.78 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 CA-C-N 117.298 0.549 . . . . 0.0 111.978 -174.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.94 -45.99 82.38 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.274 0.559 . . . . 0.0 110.197 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.45 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 94.4 m-20 -62.65 -45.92 90.61 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.962 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.5 t -63.41 -47.78 90.22 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.576 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -55.12 -45.54 75.55 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.346 0.593 . . . . 0.0 110.881 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.29 -44.48 87.83 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 115.359 -0.837 . . . . 0.0 108.866 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.2 mt -64.9 -36.24 83.72 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 82' ' ' VAL . 45.3 mm -63.09 -44.7 99.65 Favored 'Isoleucine or valine' 0 C--O 1.244 0.769 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.28 -41.56 97.16 Favored 'General case' 0 C--O 1.214 -0.794 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.303 177.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.2 m -60.37 -38.86 85.2 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.226 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.6 m -71.79 -39.6 69.8 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.281 -176.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 41.2 pt . . . . . 0 C--N 1.321 -0.662 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.982 179.809 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.481 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 22.8 t70 . . . . . 0 C--O 1.242 0.662 0 N-CA-C 114.017 1.118 . . . . 0.0 114.017 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.49 ' O ' HG12 ' A' ' 10' ' ' VAL . 15.0 Cg_exo -70.77 -31.37 16.13 Favored 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 123.024 2.483 . . . . 0.0 113.422 177.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -75.17 -38.26 60.94 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.697 0.761 . . . . 0.0 109.021 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 67.7 t80 -63.93 -38.28 90.52 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.699 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.49 HG12 ' O ' ' A' ' 7' ' ' PRO . 4.3 p -67.29 -33.53 63.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 120.87 0.367 . . . . 0.0 110.305 178.357 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -58.19 -43.03 87.35 Favored 'General case' 0 C--N 1.342 0.262 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.74 -38.32 84.77 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.038 177.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.685 ' HD2' HG23 ' A' ' 89' ' ' THR . 19.8 mmm180 -60.12 -42.22 94.28 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.023 179.592 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.241 0.612 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 24' ' ' VAL . 55.6 t-20 -75.27 121.58 22.39 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -54.02 -39.16 65.89 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.314 0.578 . . . . 0.0 111.41 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -75.05 -33.1 61.69 Favored 'General case' 0 CA--C 1.485 -1.535 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.077 -171.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.608 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.9 tp -76.57 -36.64 57.47 Favored 'General case' 0 N--CA 1.419 -2.002 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.265 -177.047 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.421 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 61.0 t -65.02 -42.44 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.678 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 56.3 ttp -58.46 -41.2 84.65 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.325 177.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -68.86 -39.88 79.61 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.461 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.608 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.8 mm -57.06 -51.22 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 176.772 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.5 mt -63.04 -37.89 89.01 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.633 -179.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -66.49 -49.06 67.86 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 123.99 0.916 . . . . 0.0 110.449 179.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.3 -41.05 97.05 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.165 -175.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.401 ' CD1' HD13 ' A' ' 70' ' ' LEU . 38.7 pt -72.86 -35.16 48.61 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.587 0 C-N-CA 120.112 -0.635 . . . . 0.0 109.499 176.442 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -60.95 -54.57 43.4 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 123.018 0.527 . . . . 0.0 110.421 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.428 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.5 pp -62.24 -34.76 77.13 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.922 -178.009 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.428 ' N ' HD12 ' A' ' 33' ' ' LEU . 25.9 t70 -75.36 -48.55 22.5 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.914 -178.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 54.1 tp . . . . . 0 N--CA 1.466 0.354 0 C-N-CA 123.662 0.785 . . . . 0.0 112.118 -179.186 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.532 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.7 tt . . . . . 0 C--O 1.222 -0.354 0 N-CA-C 111.265 0.098 . . . . 0.0 111.265 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.498 ' O ' HG13 ' A' ' 46' ' ' ILE . 21.1 pttm -62.69 -32.9 74.07 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 119.951 -0.7 . . . . 0.0 110.794 178.006 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.0 m -69.11 -43.45 74.42 Favored 'General case' 0 N--CA 1.428 -1.526 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.321 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.488 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 25.0 m -60.4 -37.96 82.47 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.438 176.33 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.1 mm -55.95 -49.19 76.71 Favored 'Isoleucine or valine' 0 C--N 1.344 0.338 0 C-N-CA 123.397 0.679 . . . . 0.0 110.035 176.04 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 42' ' ' LYS . 75.6 mt -52.29 -47.47 45.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 C-N-CA 123.528 0.731 . . . . 0.0 112.161 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.488 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 25.9 m-85 -61.8 -53.13 60.19 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-O 121.43 0.633 . . . . 0.0 110.453 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.3 -43.6 95.04 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 CA-C-N 114.638 -1.164 . . . . 0.0 111.662 -173.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -67.31 -34.42 77.34 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.419 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 37.2 m -77.57 -21.96 51.69 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.283 0.563 . . . . 0.0 111.099 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.4 t -77.85 -49.11 14.91 Favored 'General case' 0 N--CA 1.434 -1.248 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.501 ' O ' HG12 ' A' ' 56' ' ' ILE . 79.9 m-70 -104.99 45.55 0.96 Allowed 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -175.261 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 50' ' ' SER . 81.1 mt -46.81 -43.75 18.65 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -175.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.419 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 7.9 t70 -53.58 -51.67 62.24 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -174.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -74.0 -32.68 63.51 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.461 -177.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 52' ' ' HIS . 41.8 mm -62.95 -35.65 72.33 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.477 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 177.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -77.66 -43.95 29.65 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.166 -179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 52.9 mtpt -60.96 -46.25 91.48 Favored 'General case' 0 CA--C 1.505 -0.771 0 C-N-CA 122.975 0.51 . . . . 0.0 110.754 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -122.34 60.33 1.0 Allowed 'General case' 0 C--N 1.302 -1.472 0 CA-C-O 121.562 0.696 . . . . 0.0 111.432 -177.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -22.94 66.13 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.762 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -63.09 -49.76 73.19 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 123.503 0.502 . . . . 0.0 109.661 175.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -63.09 -49.6 73.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.874 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.484 ' HA ' HG12 ' A' ' 66' ' ' ILE . 81.2 m-85 -68.49 -33.42 74.12 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -178.122 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.54 -50.04 72.93 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.164 0.507 . . . . 0.0 109.802 174.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.2 mtm -61.16 -48.88 79.55 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.364 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.556 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 46.4 pt -67.78 -39.89 82.78 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.826 -177.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.541 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.53 -39.81 68.03 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 118.348 0.522 . . . . 0.0 111.587 -178.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -63.39 -55.73 22.06 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.575 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.0 mt -60.63 -40.41 84.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.747 -176.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.584 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 93.0 mt -55.61 -50.32 70.44 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 122.929 0.492 . . . . 0.0 111.636 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.541 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 43.2 mt-30 -70.36 -46.79 63.4 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 122.297 1.046 . . . . 0.0 109.858 -176.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 72' ' ' ARG . 33.0 ttt180 -60.91 -44.55 97.02 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 113.51 -1.677 . . . . 0.0 111.43 -175.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -91.98 -15.28 28.17 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.584 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.94 -30.26 70.34 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 119.929 -0.708 . . . . 0.0 109.098 175.127 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -79.78 -17.46 53.37 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.099 176.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -97.42 -51.3 4.21 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.028 -176.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.5 pt -118.17 -25.9 2.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -176.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.534 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 120.42 143.83 6.94 Favored Glycine 0 C--N 1.308 -0.978 0 C-N-CA 120.064 -1.065 . . . . 0.0 111.213 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tp -60.68 -42.78 93.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -175.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.76 -41.84 87.53 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.554 0.692 . . . . 0.0 110.417 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.557 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 2.4 m-20 -63.07 -48.4 78.82 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.592 -1.186 . . . . 0.0 109.823 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 78' ' ' GLY . 33.9 t -62.29 -46.82 95.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.586 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -53.62 -46.7 70.54 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.203 0.525 . . . . 0.0 111.345 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -42.01 95.34 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 115.476 -0.784 . . . . 0.0 108.916 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 88.7 mt -65.44 -35.46 80.99 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.32 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 82' ' ' VAL . 49.0 mm -66.22 -45.82 89.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.53 -42.29 91.95 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.588 178.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 50.9 m -64.14 -33.69 76.36 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.127 0.489 . . . . 0.0 111.047 177.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.685 HG23 ' HD2' ' A' ' 13' ' ' ARG . 91.5 m -68.79 -37.44 79.28 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.779 179.133 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.6 pt . . . . . 0 C--N 1.329 -0.315 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.712 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.415 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 6.2 t70 . . . . . 0 N--CA 1.44 -0.952 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 16.6 Cg_exo -67.07 -27.31 42.27 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.882 2.388 . . . . 0.0 112.438 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.465 ' HB2' HD11 ' A' ' 69' ' ' ILE . 3.8 mm-40 -75.01 -25.27 58.67 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -177.081 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -70.46 -39.56 74.21 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.357 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.412 HG12 ' O ' ' A' ' 7' ' ' PRO . 9.4 p -68.4 -34.48 66.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.213 0.53 . . . . 0.0 109.574 178.074 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.68 -42.01 99.4 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 174.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.45 -44.51 84.83 Favored 'General case' 0 C--O 1.195 -1.789 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.276 176.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -58.11 -32.84 68.49 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 118.659 0.663 . . . . 0.0 112.566 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 . . . . . 0 C--N 1.301 -1.512 0 CA-C-O 121.903 0.859 . . . . 0.0 110.117 177.71 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.0 m . . . . . 0 C--O 1.245 0.833 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.418 ' O ' HG23 ' A' ' 24' ' ' VAL . 14.5 t-20 -94.23 138.94 31.67 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.451 ' HA ' HD12 ' A' ' 90' ' ' ILE . 76.0 t80 -61.37 -44.07 97.8 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 122.569 0.348 . . . . 0.0 111.761 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 -71.56 -31.22 66.75 Favored 'General case' 0 CA--C 1.492 -1.257 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -173.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.495 ' O ' HG12 ' A' ' 27' ' ' ILE . 30.8 tp -69.69 -47.86 61.7 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.453 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.509 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 94.6 t -63.52 -42.2 95.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -56.8 -43.73 81.25 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -65.54 -43.18 90.72 Favored 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.944 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.5 mm -58.74 -50.26 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-O 121.274 0.559 . . . . 0.0 109.811 177.216 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 82.7 mt -61.72 -36.24 80.37 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.325 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -71.84 -47.69 51.37 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.38 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -59.2 -41.08 87.71 Favored 'General case' 0 C--O 1.248 1.025 0 C-N-CA 124.307 1.043 . . . . 0.0 110.292 -177.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.423 ' CD1' HD13 ' A' ' 70' ' ' LEU . 45.8 pt -73.03 -40.31 58.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 120.596 -0.442 . . . . 0.0 109.996 176.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -60.95 -47.64 85.48 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 123.516 0.726 . . . . 0.0 111.051 -178.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.83 -30.1 71.23 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -75.0 -50.56 16.14 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 119.147 -1.021 . . . . 0.0 110.04 174.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 69.2 tp . . . . . 0 C--O 1.241 0.63 0 C-N-CA 123.966 0.906 . . . . 0.0 111.692 -177.515 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.559 ' O ' HG12 ' A' ' 45' ' ' ILE . 10.9 tt . . . . . 0 N--CA 1.444 -0.742 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.453 ' O ' HG13 ' A' ' 46' ' ' ILE . 64.6 pttt -71.86 -28.23 63.4 Favored 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 119.126 -1.029 . . . . 0.0 110.084 -177.214 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.2 m -73.91 -40.59 63.04 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.248 -0.887 . . . . 0.0 108.871 175.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.429 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 18.4 m -57.52 -40.7 79.32 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 121.021 0.439 . . . . 0.0 110.094 174.062 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.559 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.8 mm -54.51 -47.19 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 123.814 0.846 . . . . 0.0 109.897 175.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 42' ' ' LYS . 63.4 mt -52.93 -50.7 42.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.364 -0.834 . . . . 0.0 112.538 -177.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.429 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 31.0 m-85 -57.91 -49.84 75.38 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 121.164 0.507 . . . . 0.0 110.436 -175.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.4 t -66.78 -47.75 81.96 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 CA-C-N 114.508 -1.224 . . . . 0.0 111.671 -174.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -65.84 -39.01 90.37 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.823 0.344 . . . . 0.0 110.85 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.9 t -69.32 -22.06 63.8 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.306 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.9 t -97.16 -0.92 46.1 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-O 121.346 0.593 . . . . 0.0 109.944 -178.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.573 ' O ' HG12 ' A' ' 56' ' ' ILE . 26.8 m-70 -134.42 32.79 3.33 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 95.2 mt -47.37 -51.35 19.92 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -172.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -62.53 -44.21 96.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.041 0.448 . . . . 0.0 111.104 -175.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.489 ' OE2' HD11 ' A' ' 27' ' ' ILE . 24.4 tt0 -60.76 -49.83 75.9 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 124.534 1.134 . . . . 0.0 110.17 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.573 HG12 ' O ' ' A' ' 52' ' ' HIS . 43.6 mm -55.75 -43.01 72.26 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.147 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.018 176.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 69.2 mtm180 -64.25 -34.46 78.16 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -61.35 -51.43 68.84 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 120.863 0.363 . . . . 0.0 110.947 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.424 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 48.7 m-80 -121.77 60.7 0.96 Allowed 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 121.346 0.593 . . . . 0.0 110.434 -177.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.653 ' HG2' ' OE1' ' A' ' 61' ' ' GLU . 4.3 ptpp? -65.07 -33.86 77.05 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.128 -177.146 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.653 ' OE1' ' HG2' ' A' ' 60' ' ' LYS . 3.1 mp0 -63.81 -45.87 87.67 Favored 'General case' 0 N--CA 1.414 -2.226 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.424 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.424 ' HB3' ' HB3' ' A' ' 59' ' ' ASN . 78.0 t80 -63.83 -52.39 60.35 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.124 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.442 ' HA ' HG12 ' A' ' 66' ' ' ILE . 51.3 m-85 -68.46 -34.61 76.25 Favored 'General case' 0 N--CA 1.432 -1.347 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -175.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.66 -43.77 65.46 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.343 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.3 mtm -67.67 -39.78 84.5 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.665 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.527 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.8 pt -67.2 -41.59 86.99 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.993 0 C-N-CA 118.342 -1.343 . . . . 0.0 110.732 177.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.526 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.2 -36.57 68.55 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 121.141 0.496 . . . . 0.0 111.144 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -68.55 -55.29 12.16 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.738 177.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.465 HD11 ' HB2' ' A' ' 8' ' ' GLU . 86.8 mt -61.53 -38.96 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.837 -178.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.597 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 93.1 mt -56.65 -48.05 78.42 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 123.069 0.548 . . . . 0.0 111.347 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 69.8 mt-30 -66.21 -46.63 76.6 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -55.51 -52.46 63.62 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.817 1.647 . . . . 0.0 112.386 -176.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -90.13 -14.83 32.82 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -175.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.597 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.36 -28.32 67.85 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.354 0.597 . . . . 0.0 109.4 174.729 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -73.56 -22.14 60.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.106 176.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -96.3 -51.15 4.5 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.6 pt -119.79 -30.83 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.495 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 136.53 173.66 13.02 Favored Glycine 0 C--O 1.212 -1.24 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -178.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.5 tp -91.91 -40.59 12.45 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.105 0 CA-C-N 118.362 1.081 . . . . 0.0 110.506 -174.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -59.66 -33.97 72.23 Favored 'General case' 0 N--CA 1.421 -1.876 0 C-N-CA 123.975 0.91 . . . . 0.0 110.218 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.527 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 12.2 m120 -69.39 -48.14 62.07 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.396 -1.275 . . . . 0.0 109.366 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 78' ' ' GLY . 44.2 t -66.57 -38.55 81.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.3 -178.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -56.4 -45.61 80.54 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.257 0.551 . . . . 0.0 110.392 177.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -44.92 94.63 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.031 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 87.0 mt -59.43 -42.31 91.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.452 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.6 mm -64.08 -38.76 83.27 Favored 'Isoleucine or valine' 0 C--O 1.269 2.114 0 C-N-CA 122.637 0.375 . . . . 0.0 110.685 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.75 -40.5 95.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.562 0.696 . . . . 0.0 110.131 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 49.7 m -62.07 -33.27 74.11 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.322 177.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -69.7 -34.57 74.1 Favored 'General case' 0 CA--C 1.562 1.415 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.451 HD12 ' HA ' ' A' ' 21' ' ' PHE . 23.8 pt . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -176.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 13.1 t70 . . . . . 0 N--CA 1.436 -1.165 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 6.2 Cg_exo -71.23 -24.59 23.06 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.99 2.46 . . . . 0.0 112.721 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.458 ' HB2' HD11 ' A' ' 69' ' ' ILE . 6.0 mm-40 -75.52 -37.83 59.83 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -59.46 -44.51 92.98 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.955 178.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.6 p -65.77 -37.36 79.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.19 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -70.68 -29.17 65.41 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.175 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 64.1 mt -61.11 -39.32 89.53 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.212 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.576 ' HG2' HG23 ' A' ' 89' ' ' THR . 59.4 mtm180 -72.05 -27.19 62.53 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.082 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 . . . . . 0 C--N 1.318 -0.767 0 CA-C-O 121.455 0.645 . . . . 0.0 109.736 176.758 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.9 m . . . . . 0 N--CA 1.446 -0.662 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -76.84 123.88 26.89 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -53.6 -38.37 63.92 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 123.607 0.763 . . . . 0.0 110.824 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -70.97 -31.22 67.71 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.57 -173.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.566 ' O ' HG12 ' A' ' 27' ' ' ILE . 34.8 tp -76.42 -41.71 46.68 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.695 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.454 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 62.1 t -63.11 -44.09 99.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 177.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 62.3 ttp -57.32 -35.13 69.47 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.118 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -74.64 -41.93 59.47 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.999 177.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.566 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.62 -49.93 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-O 121.488 0.661 . . . . 0.0 109.314 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 78.6 mt -61.96 -40.5 95.78 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.548 -1.205 . . . . 0.0 110.406 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -64.3 -47.38 79.7 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.781 0.801 . . . . 0.0 110.827 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -62.28 -42.69 99.56 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.992 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.404 HG21 HD13 ' A' ' 45' ' ' ILE . 32.8 pt -71.87 -38.38 64.86 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.481 175.395 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.87 -50.73 72.92 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.069 0.948 . . . . 0.0 111.239 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -65.21 -32.41 74.07 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.38 -179.013 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.42 ' N ' HD12 ' A' ' 33' ' ' LEU . 20.3 t70 -75.73 -48.5 21.61 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.141 0.496 . . . . 0.0 111.08 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.545 HD22 ' HB ' ' A' ' 41' ' ' ILE . 57.1 tp . . . . . 0 C--N 1.317 -0.816 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.29 -178.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.545 ' HB ' HD22 ' A' ' 35' ' ' LEU . 12.7 tt . . . . . 0 C--O 1.217 -0.647 0 CA-C-O 121.073 0.463 . . . . 0.0 109.892 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.473 ' O ' HG13 ' A' ' 46' ' ' ILE . 10.2 ptmm? -59.35 -36.45 75.74 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.195 176.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 19.0 m -79.62 -35.61 39.2 Favored 'General case' 0 N--CA 1.417 -2.09 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.286 -178.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.8 m -59.22 -43.48 92.31 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 41' ' ' ILE . 29.8 mm -55.44 -41.29 62.17 Favored 'Isoleucine or valine' 0 C--N 1.346 0.419 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.008 177.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 42' ' ' LYS . 70.4 mt -57.37 -51.06 74.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.557 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -62.35 -52.44 63.62 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.564 0.697 . . . . 0.0 110.258 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.9 t -62.0 -46.95 95.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 114.585 -1.189 . . . . 0.0 112.084 -174.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -66.46 -36.44 82.78 Favored 'General case' 0 C--O 1.212 -0.888 0 C-N-CA 121.173 -0.211 . . . . 0.0 111.545 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.1 m -72.73 -25.4 61.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.979 0.418 . . . . 0.0 111.444 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.6 t -83.65 -40.39 19.04 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-O 121.167 0.508 . . . . 0.0 110.561 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.474 ' O ' HG12 ' A' ' 56' ' ' ILE . 64.1 m-70 -103.21 35.52 2.53 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.445 -175.112 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.1 mt -47.14 -43.17 20.62 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -175.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -53.99 -51.12 64.93 Favored 'General case' 0 C--N 1.318 -0.781 0 O-C-N 123.557 0.536 . . . . 0.0 112.226 -175.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 58' ' ' LYS . 12.8 tp10 -73.9 -34.36 64.36 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.044 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.474 HG12 ' O ' ' A' ' 52' ' ' HIS . 46.3 mm -61.19 -37.44 77.49 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -73.56 -43.15 60.57 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.682 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 55' ' ' GLU . 53.6 mtpt -58.33 -50.24 74.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.248 0.547 . . . . 0.0 111.565 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -120.02 54.14 1.04 Allowed 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 122.035 0.921 . . . . 0.0 110.39 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -53.47 -37.53 62.76 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 113.764 -1.562 . . . . 0.0 112.932 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -60.98 -46.82 89.2 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 120.954 0.406 . . . . 0.0 110.59 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -63.36 -51.02 67.63 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.056 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.508 ' HA ' HG12 ' A' ' 66' ' ' ILE . 85.9 m-85 -70.4 -28.16 64.86 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -175.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -75.68 -44.34 42.74 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.134 177.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.7 mtm -62.76 -45.77 91.13 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.038 178.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.508 HG12 ' HA ' ' A' ' 63' ' ' TYR . 44.0 pt -64.82 -36.9 78.82 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.217 0 C-N-CA 119.354 -0.938 . . . . 0.0 111.276 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.545 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -53.53 -46.63 70.22 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.351 0.407 . . . . 0.0 112.006 -177.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -76.3 -35.61 58.77 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.144 -0.622 . . . . 0.0 112.014 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.458 HD11 ' HB2' ' A' ' 8' ' ' GLU . 82.3 mt -64.05 -45.29 97.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 177.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.582 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.9 mt -52.88 -45.95 67.71 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 123.461 0.704 . . . . 0.0 110.988 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.545 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.0 mt-30 -66.29 -48.39 70.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.472 0.653 . . . . 0.0 110.52 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 39.5 ttm180 -59.19 -50.95 72.05 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.245 1.418 . . . . 0.0 111.436 -177.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -86.56 -15.44 39.93 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -176.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.582 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.37 -34.8 78.04 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.2 174.419 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -74.88 -39.58 61.42 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.008 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -75.26 -47.06 29.82 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -174.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.8 pt -123.39 -30.72 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 O-C-N 121.721 -0.612 . . . . 0.0 112.569 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.504 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.95 142.5 5.89 Favored Glycine 0 C--N 1.309 -0.929 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.409 ' HB ' ' HB2' ' A' ' 74' ' ' TYR . 8.2 tp -61.14 -38.45 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 117.096 0.448 . . . . 0.0 111.876 -174.038 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -53.47 -45.75 69.68 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.713 0.768 . . . . 0.0 110.475 179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.469 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 42.6 m-80 -65.59 -45.68 82.28 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.189 -1.368 . . . . 0.0 110.195 -178.14 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 78' ' ' GLY . 15.0 t -65.01 -45.66 93.92 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.12 -176.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -55.56 -43.75 76.18 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.335 0.588 . . . . 0.0 110.844 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -45.49 83.7 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 98.7 mt -62.39 -39.67 93.97 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.669 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.473 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.5 mm -62.89 -40.48 88.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-O 120.847 0.356 . . . . 0.0 110.073 177.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 98.6 mt -63.71 -38.62 91.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.867 0.842 . . . . 0.0 110.32 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.7 m -67.07 -34.36 77.5 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.033 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.576 HG23 ' HG2' ' A' ' 13' ' ' ARG . 56.4 m -64.95 -46.21 82.53 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 124.324 1.05 . . . . 0.0 110.805 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.9 pt . . . . . 0 C--O 1.239 0.506 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -177.481 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.449 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 7.1 t70 . . . . . 0 C--O 1.247 0.964 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 2.9 Cg_exo -72.1 -30.36 13.52 Favored 'Trans proline' 0 C--O 1.241 0.638 0 C-N-CA 122.848 2.366 . . . . 0.0 113.108 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -76.2 -28.73 57.35 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -64.43 -41.82 96.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.389 178.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 7' ' ' PRO . 10.3 p -63.44 -34.86 69.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -59.18 -43.85 92.17 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.358 171.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.71 -35.48 78.17 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 122.907 0.483 . . . . 0.0 110.962 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -61.5 -36.78 81.45 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.185 0.594 . . . . 0.0 110.641 177.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 . . . . . 0 C--N 1.313 -1.02 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.996 179.153 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.402 HG21 HG21 ' A' ' 24' ' ' VAL . 31.0 m . . . . . 0 N--CA 1.448 -0.526 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.417 ' O ' HG23 ' A' ' 24' ' ' VAL . 79.5 m-20 -84.32 110.54 18.67 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 120.072 -0.651 . . . . 0.0 109.671 173.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.411 ' CE1' HD22 ' A' ' 87' ' ' LEU . 52.5 t80 -48.82 -47.94 41.98 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.319 1.048 . . . . 0.0 112.888 -178.095 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -64.65 -31.88 73.29 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -176.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.628 ' O ' HG12 ' A' ' 27' ' ' ILE . 31.1 tp -76.79 -40.63 47.48 Favored 'General case' 0 N--CA 1.426 -1.648 0 C-N-CA 119.819 -0.752 . . . . 0.0 110.067 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 20' ' ' ASN . 53.9 t -60.55 -42.3 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 177.28 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -57.2 -44.38 83.58 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.356 176.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -68.24 -38.13 81.53 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.943 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.628 HG12 ' O ' ' A' ' 23' ' ' LEU . 49.6 mm -56.81 -51.71 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.229 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.02 -40.98 97.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.493 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -66.02 -47.52 74.17 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.509 0.671 . . . . 0.0 111.35 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -62.02 -39.71 93.2 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.703 -176.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.473 HG23 HG21 ' A' ' 48' ' ' VAL . 31.0 pt -73.01 -39.21 57.33 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.234 175.497 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.99 -52.93 63.31 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.7 0.8 . . . . 0.0 111.406 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -66.6 -28.78 68.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -178.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -76.09 -49.71 16.7 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.633 0.73 . . . . 0.0 109.816 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 63.8 tp . . . . . 0 C--N 1.318 -0.766 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.276 -178.871 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.509 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.8 tt . . . . . 0 N--CA 1.451 -0.378 0 N-CA-C 111.506 0.187 . . . . 0.0 111.506 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -66.46 -31.72 72.64 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.834 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.2 m -73.12 -41.61 63.81 Favored 'General case' 0 N--CA 1.426 -1.67 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 177.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.458 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 15.6 m -59.63 -39.71 85.21 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.783 177.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 41' ' ' ILE . 23.8 mm -52.39 -46.74 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 124.054 0.942 . . . . 0.0 110.278 175.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 60.2 mt -57.69 -47.66 85.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.986 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.458 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 19.5 m-85 -59.75 -42.59 93.58 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.812 0.815 . . . . 0.0 110.299 -177.093 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.473 HG21 HG23 ' A' ' 31' ' ' ILE . 46.5 t -71.85 -49.22 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.75 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.364 -176.165 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.417 ' HA ' HG13 ' A' ' 56' ' ' ILE . 4.1 m-30 -62.98 -40.39 97.58 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.764 -178.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.5 t -66.78 -31.25 71.76 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 122.58 0.352 . . . . 0.0 111.665 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.7 t -84.68 -27.57 26.96 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.136 0.493 . . . . 0.0 111.008 -178.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.56 ' O ' HG12 ' A' ' 56' ' ' ILE . 83.1 m-70 -117.15 35.36 4.68 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -174.568 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 81.6 mt -47.13 -40.0 14.65 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 -174.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -56.78 -51.27 69.58 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -174.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -72.99 -32.61 65.29 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.185 0.517 . . . . 0.0 109.648 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.56 HG12 ' O ' ' A' ' 52' ' ' HIS . 44.9 mm -62.7 -45.4 98.93 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.786 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.623 -178.562 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.3 ptp85 -77.22 -28.06 53.67 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.224 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.33 -32.6 71.81 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -175.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -128.47 55.34 1.7 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.357 174.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -63.7 -24.08 67.63 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.522 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -63.86 -57.53 9.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 175.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -59.53 -51.21 70.83 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.692 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.455 ' HA ' HG12 ' A' ' 66' ' ' ILE . 72.6 m-85 -67.59 -26.12 66.11 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -176.46 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -77.07 -46.05 24.96 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.611 176.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.5 mtm -59.09 -50.59 73.48 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.664 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.7 pt -63.31 -41.69 93.66 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.698 0 C-N-CA 119.617 -0.833 . . . . 0.0 112.038 -178.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.54 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.85 -39.65 74.65 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.046 0.45 . . . . 0.0 110.91 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.56 -52.49 31.26 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.578 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.8 mt -60.34 -42.91 92.45 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.6 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 98.0 mt -52.66 -46.72 67.29 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 123.277 0.631 . . . . 0.0 111.265 178.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 63.7 mt-30 -68.57 -43.31 76.86 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.015 0.436 . . . . 0.0 110.565 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -62.07 -47.56 84.12 Favored 'General case' 0 N--CA 1.428 -1.534 0 C-N-CA 123.755 0.822 . . . . 0.0 111.556 -178.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -85.75 -15.48 42.01 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 -177.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.551 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.01 -33.3 75.27 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 174.931 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -73.46 -34.71 65.51 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.483 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -85.35 -51.46 6.55 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.161 0.801 . . . . 0.0 113.161 -175.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.0 pt -118.48 -29.11 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -173.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.543 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.95 143.91 6.21 Favored Glycine 0 N--CA 1.438 -1.186 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.232 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.0 tp -61.33 -37.16 76.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 122.44 0.296 . . . . 0.0 111.243 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -65.02 -35.5 81.38 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.627 -177.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.627 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.4 t-20 -67.73 -45.53 74.74 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.824 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.1 t -66.77 -38.22 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.626 -177.642 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.462 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 47.3 t-20 -50.78 -50.0 56.99 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.126 0.97 . . . . 0.0 108.898 177.652 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -40.84 81.96 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.109 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 81.5 mt -61.16 -42.01 97.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.528 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.6 mm -64.42 -44.47 97.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 177.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 80.9 mt -61.38 -34.71 75.78 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.267 0.556 . . . . 0.0 110.948 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.8 m -66.47 -46.33 76.72 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.235 177.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.6 m -64.27 -35.28 80.32 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.436 0.694 . . . . 0.0 111.864 -175.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.5 pt . . . . . 0 C--O 1.242 0.694 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -179.23 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.433 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 18.2 t70 . . . . . 0 C--O 1.244 0.801 0 N-CA-C 112.727 0.639 . . . . 0.0 112.727 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.485 ' O ' HG12 ' A' ' 10' ' ' VAL . 7.2 Cg_exo -71.85 -24.6 21.0 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.462 2.774 . . . . 0.0 113.866 176.634 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.34 -38.52 74.87 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -178.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -59.81 -38.84 83.13 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.581 176.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 7' ' ' PRO . 8.6 p -69.49 -33.85 59.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.171 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.12 -36.42 79.67 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 175.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.421 HD21 ' HB2' ' A' ' 65' ' ' MET . 98.0 mt -63.71 -41.93 98.02 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.139 0.495 . . . . 0.0 110.424 176.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -64.04 -30.65 71.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.7 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.71 178.112 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.518 HG11 ' CD2' ' A' ' 62' ' ' PHE . 24.7 m . . . . . 0 C--O 1.25 1.124 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.465 ' O ' HG23 ' A' ' 24' ' ' VAL . 18.3 t-20 -87.86 115.87 25.62 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.111 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -51.76 -38.44 55.47 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.462 0.476 . . . . 0.0 111.665 -178.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -72.88 -36.06 67.26 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.406 -172.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.618 ' O ' HG12 ' A' ' 27' ' ' ILE . 25.8 tp -76.64 -39.1 53.4 Favored 'General case' 0 N--CA 1.415 -2.196 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.987 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.469 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 72.8 t -57.84 -46.65 87.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 174.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 54.6 ttp -58.13 -40.0 80.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.055 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 -68.91 -41.06 78.73 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.229 175.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.618 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.3 mm -57.02 -51.93 62.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 177.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.7 mt -62.39 -38.09 88.28 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 114.515 -1.221 . . . . 0.0 110.541 -179.099 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -69.09 -46.16 68.45 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.136 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -61.86 -43.29 99.15 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.159 -176.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.416 ' CD1' HD13 ' A' ' 70' ' ' LEU . 39.4 pt -71.5 -38.73 69.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.599 177.103 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -59.03 -52.97 63.45 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 123.082 0.553 . . . . 0.0 111.363 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.426 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.6 pp -58.36 -37.35 75.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 120.823 0.344 . . . . 0.0 111.527 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.426 ' N ' HD12 ' A' ' 33' ' ' LEU . 27.8 t70 -73.78 -45.96 48.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.208 0.528 . . . . 0.0 110.328 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 C--N 1.315 -0.927 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.513 -177.346 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.513 HD13 ' HA ' ' A' ' 71' ' ' GLN . 9.7 tt . . . . . 0 N--CA 1.447 -0.599 0 CA-C-O 120.455 0.169 . . . . 0.0 111.274 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.536 ' O ' HG13 ' A' ' 46' ' ' ILE . 20.5 ptmt -67.94 -33.66 75.1 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 119.464 -0.895 . . . . 0.0 110.372 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.6 m -72.9 -33.69 66.18 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.463 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 14.0 m -62.05 -44.95 95.58 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 173.729 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.495 ' HB ' ' O ' ' A' ' 42' ' ' LYS . 27.6 mm -52.94 -48.45 51.6 Favored 'Isoleucine or valine' 0 C--N 1.344 0.351 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.468 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 42' ' ' LYS . 72.0 mt -55.38 -49.73 70.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.726 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.463 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 13.1 m-85 -58.43 -45.16 89.03 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 122.256 1.027 . . . . 0.0 110.481 -178.104 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 44' ' ' SER . 57.8 t -73.12 -49.26 39.66 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.771 0 CA-C-N 114.248 -1.342 . . . . 0.0 111.308 -173.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -63.5 -35.91 82.02 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.522 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.7 p -73.59 -22.18 60.12 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.068 0.461 . . . . 0.0 111.718 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.6 t -90.45 -25.95 20.08 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.651 0.739 . . . . 0.0 110.134 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.5 ' O ' HG12 ' A' ' 56' ' ' ILE . 81.2 m-70 -118.7 36.61 4.35 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 121.911 -0.493 . . . . 0.0 109.894 -175.178 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.5 mt -48.7 -44.11 37.74 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -175.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -56.61 -45.35 81.49 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 123.27 0.356 . . . . 0.0 111.936 -175.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -67.36 -44.77 78.18 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.621 0.724 . . . . 0.0 109.625 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 52' ' ' HIS . 45.6 mm -59.59 -46.57 92.99 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.862 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.294 -176.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -72.61 -24.56 61.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.898 0.38 . . . . 0.0 111.095 -178.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -72.78 -46.52 52.9 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.553 0.692 . . . . 0.0 109.47 -177.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.497 ' HB2' ' CE2' ' A' ' 63' ' ' TYR . 4.6 m120 -117.37 46.33 1.73 Allowed 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 -177.105 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.66 -34.59 18.84 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.114 1.366 . . . . 0.0 114.56 -173.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -67.09 -48.28 68.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.394 0.616 . . . . 0.0 110.311 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.518 ' CD2' HG11 ' A' ' 19' ' ' VAL . 85.4 t80 -64.03 -51.3 64.85 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.811 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.509 ' HA ' HG12 ' A' ' 66' ' ' ILE . 82.1 m-85 -66.22 -26.15 67.25 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -175.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.42 -47.24 17.95 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 119.442 -0.903 . . . . 0.0 111.051 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.421 ' HB2' HD21 ' A' ' 12' ' ' LEU . 76.3 mtm -65.74 -36.09 82.58 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.073 -178.053 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.509 HG12 ' HA ' ' A' ' 63' ' ' TYR . 41.2 pt -67.19 -38.33 80.87 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.669 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.33 175.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -57.27 -42.02 80.83 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.918 0.39 . . . . 0.0 110.139 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -62.04 -56.47 18.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.013 176.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 99.2 mt -60.97 -40.87 86.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.686 0.795 . . . . 0.0 112.403 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.505 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 88.2 mt -55.1 -49.64 71.21 Favored 'General case' 0 C--O 1.212 -0.906 0 C-N-CA 123.208 0.603 . . . . 0.0 112.015 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.523 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 49.4 mt-30 -69.02 -50.25 50.45 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 122.101 0.953 . . . . 0.0 109.361 -178.067 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -55.88 -47.13 77.94 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.137 -1.847 . . . . 0.0 111.901 -176.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -88.87 -15.93 33.21 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.505 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.79 -32.95 73.88 Favored 'General case' 0 N--CA 1.439 -0.989 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.775 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -69.15 -28.21 66.23 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.427 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -90.81 -52.17 5.0 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.9 pt -119.2 -27.67 2.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.51 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 120.62 144.12 6.98 Favored Glycine 0 C--N 1.305 -1.161 0 C-N-CA 120.411 -0.899 . . . . 0.0 110.872 178.2 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.3 tp -61.56 -38.5 80.36 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 C-N-CA 122.44 0.296 . . . . 0.0 111.739 -174.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -55.84 -44.28 77.83 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 122.541 1.162 . . . . 0.0 109.706 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.52 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 51.0 m-80 -67.64 -44.34 78.18 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 113.557 -1.656 . . . . 0.0 110.982 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.9 t -67.69 -39.87 82.92 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.175 -177.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -55.76 -45.37 78.09 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.276 0.56 . . . . 0.0 110.779 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -41.75 95.5 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 89.1 mt -62.13 -42.14 98.95 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.423 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 82' ' ' VAL . 51.1 mm -63.96 -39.12 84.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.887 0.375 . . . . 0.0 110.094 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.88 -39.44 94.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.404 0.621 . . . . 0.0 110.109 176.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 27.3 m -66.89 -33.82 76.44 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.103 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 47.3 m -60.76 -42.88 98.34 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.905 0.882 . . . . 0.0 111.12 -178.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 23.7 pt . . . . . 0 C--N 1.311 -1.088 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.398 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.1 t70 . . . . . 0 N--CA 1.439 -1.001 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.538 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 26.5 Cg_exo -63.12 -30.6 75.45 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 123.067 2.512 . . . . 0.0 113.23 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.39 -41.75 46.76 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -178.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -57.29 -46.21 83.38 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.684 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.0 p -64.42 -34.57 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.67 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 64.1 mttp -62.63 -44.66 95.72 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 175.746 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.7 mt -58.45 -42.11 86.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.804 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -59.67 -37.19 78.08 Favored 'General case' 0 N--CA 1.476 0.838 0 O-C-N 123.444 0.465 . . . . 0.0 111.21 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 . . . . . 0 C--N 1.314 -0.976 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.817 -179.297 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 6.5 m . . . . . 0 CA--C 1.503 -0.844 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -67.85 133.53 49.33 Favored 'General case' 0 C--N 1.309 -1.194 0 O-C-N 124.109 0.881 . . . . 0.0 109.1 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -57.16 -39.76 75.9 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.417 0.627 . . . . 0.0 110.63 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -72.09 -29.19 63.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.552 -175.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.52 HD21 ' CD ' ' A' ' 55' ' ' GLU . 61.0 tp -70.24 -45.26 66.84 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.676 178.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.86 -40.84 88.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.407 ' HA ' HD21 ' A' ' 87' ' ' LEU . 41.5 ttm -57.31 -41.54 80.09 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.23 174.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -66.85 -43.05 84.65 Favored 'General case' 0 C--O 1.208 -1.126 0 O-C-N 123.217 0.323 . . . . 0.0 110.92 177.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.463 HD11 ' OE2' ' A' ' 55' ' ' GLU . 47.3 mm -56.97 -50.04 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.319 0.58 . . . . 0.0 109.839 178.504 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.8 mt -63.56 -42.07 98.38 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.893 -1.048 . . . . 0.0 110.534 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -62.96 -46.23 88.73 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 123.719 0.808 . . . . 0.0 110.458 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -63.68 -47.79 79.82 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.77 -177.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.418 ' CD1' HD13 ' A' ' 70' ' ' LEU . 38.2 pt -66.67 -40.4 86.07 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.077 178.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.04 -46.45 89.5 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 123.585 0.754 . . . . 0.0 111.641 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.413 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.3 pp -60.07 -37.32 79.54 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -177.484 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.413 ' N ' HD12 ' A' ' 33' ' ' LEU . 20.1 t70 -76.06 -51.09 13.01 Favored 'General case' 0 CA--C 1.508 -0.646 0 O-C-N 123.412 0.445 . . . . 0.0 110.306 177.317 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.445 HD21 ' CD2' ' A' ' 74' ' ' TYR . 57.0 tp . . . . . 0 N--CA 1.473 0.695 0 C-N-CA 124.683 1.193 . . . . 0.0 113.322 -175.218 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.528 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.7 tt . . . . . 0 C--O 1.214 -0.786 0 CA-C-O 120.725 0.297 . . . . 0.0 110.764 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.501 ' O ' HG13 ' A' ' 46' ' ' ILE . 21.0 ptmt -63.44 -34.45 77.77 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.182 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.1 m -76.65 -33.09 58.32 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.498 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 13.2 m -63.52 -40.38 96.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.298 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 41' ' ' ILE . 36.1 mm -54.87 -48.37 74.33 Favored 'Isoleucine or valine' 0 C--N 1.346 0.446 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.199 174.398 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 42' ' ' LYS . 72.7 mt -53.89 -48.69 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.438 -178.289 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.498 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 18.5 m-85 -58.89 -53.01 63.27 Favored 'General case' 0 C--O 1.244 0.788 0 CA-C-O 121.225 0.536 . . . . 0.0 109.844 -177.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.4 t -62.44 -49.81 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.543 -176.374 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -65.55 -33.96 77.15 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 39.9 m -75.42 -21.93 57.81 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.918 0.389 . . . . 0.0 111.917 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.9 t -93.53 -8.81 40.31 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.973 0.892 . . . . 0.0 109.429 179.022 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.562 ' O ' HG12 ' A' ' 56' ' ' ILE . 35.6 m-70 -126.46 30.96 5.46 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.158 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.2 mt -48.85 -56.55 8.4 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -170.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.623 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 17.3 t70 -62.27 -44.08 97.36 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.42 -175.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.535 ' HB3' ' O ' ' A' ' 52' ' ' HIS . 26.7 tt0 -53.81 -51.22 64.2 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 124.819 1.248 . . . . 0.0 110.111 175.265 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 52' ' ' HIS . 51.7 mm -58.57 -44.25 88.97 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.721 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.241 177.469 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 -65.12 -33.66 76.54 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 178.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.623 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 66.4 mttm -56.85 -47.52 80.18 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.074 0.464 . . . . 0.0 109.778 178.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -127.67 65.42 1.34 Allowed 'General case' 0 C--N 1.317 -0.848 0 CA-C-O 121.982 0.896 . . . . 0.0 110.429 -178.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -66.09 -33.66 76.3 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 114.534 -1.212 . . . . 0.0 112.605 -176.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -65.03 -47.1 78.61 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.279 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -62.5 -52.14 64.65 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.294 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 56' ' ' ILE . 45.0 m-85 -66.82 -30.54 70.75 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -176.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -78.6 -40.12 35.43 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.975 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.6 mtm -63.63 -43.16 97.65 Favored 'General case' 0 CA--C 1.502 -0.886 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.654 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 36.8 pt -64.68 -38.54 82.93 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.246 0 C-N-CA 119.39 -0.924 . . . . 0.0 111.369 178.362 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.55 -34.0 68.7 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 121.205 0.526 . . . . 0.0 111.368 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -69.1 -54.49 14.7 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.149 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.2 mt -59.95 -44.1 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.269 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.578 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.2 mt -53.31 -51.76 61.33 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 123.451 0.701 . . . . 0.0 111.588 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.494 ' HG2' HG23 ' A' ' 41' ' ' ILE . 46.4 mt-30 -65.41 -43.48 90.43 Favored 'General case' 0 C--O 1.257 1.458 0 CA-C-O 121.377 0.608 . . . . 0.0 110.802 -178.556 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -60.26 -49.03 79.21 Favored 'General case' 0 N--CA 1.426 -1.647 0 C-N-CA 124.538 1.135 . . . . 0.0 111.767 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -91.61 -15.1 29.08 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.578 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.07 -32.24 73.58 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.829 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -72.83 -24.26 60.87 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.531 175.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -98.01 -51.79 3.92 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -172.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.3 pt -110.75 -29.52 2.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.254 0 C-N-CA 119.898 -0.721 . . . . 0.0 112.478 -176.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.512 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 123.19 147.53 7.37 Favored Glycine 0 C--N 1.306 -1.106 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.5 tp -63.81 -35.62 73.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.949 0.374 . . . . 0.0 111.637 -176.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.98 -44.52 94.44 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 122.282 1.039 . . . . 0.0 109.966 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.476 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 18.1 m120 -64.47 -45.71 86.2 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.772 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.4 t -66.72 -38.1 80.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.404 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 43.1 t-20 -52.92 -50.17 64.5 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.416 1.087 . . . . 0.0 109.38 177.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -44.24 81.47 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.208 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.7 mt -61.41 -44.39 97.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.14 -178.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.0 mm -62.96 -37.84 80.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 120.853 0.359 . . . . 0.0 110.343 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.407 HD21 ' HA ' ' A' ' 25' ' ' MET . 81.8 mt -62.31 -44.95 95.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.525 0.679 . . . . 0.0 110.399 176.449 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.3 m -64.31 -33.34 75.6 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.073 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.7 m -58.77 -45.7 89.18 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.668 0.787 . . . . 0.0 111.581 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 33.9 pt . . . . . 0 C--O 1.242 0.673 0 CA-C-O 120.967 0.413 . . . . 0.0 111.869 -178.086 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.545 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 10.2 t70 . . . . . 0 C--O 1.246 0.884 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.47 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 17.3 Cg_exo -64.34 -31.75 62.2 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.42 2.08 . . . . 0.0 113.094 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.83 -32.62 61.99 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.833 -175.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -69.59 -42.92 73.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.577 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.52 -34.19 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.322 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.7 mttt -60.23 -45.39 93.38 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.394 175.611 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.7 mt -56.55 -40.84 75.81 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.566 0.541 . . . . 0.0 111.871 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -71.0 -29.77 65.82 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.492 -177.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 . . . . . 0 C--N 1.313 -0.998 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.327 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.4 m . . . . . 0 N--CA 1.441 -0.922 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -63.5 130.26 43.62 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 122.632 0.373 . . . . 0.0 110.961 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -56.62 -39.45 73.63 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 123.461 0.704 . . . . 0.0 110.451 177.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -71.47 -28.82 64.2 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.193 -176.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.544 ' O ' HG12 ' A' ' 27' ' ' ILE . 59.3 tp -71.48 -49.43 41.33 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.33 178.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.445 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 47.5 t -63.03 -42.3 96.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.6 ttp -57.19 -39.85 76.18 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.056 177.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -69.82 -41.64 74.72 Favored 'General case' 0 C--O 1.215 -0.729 0 O-C-N 123.292 0.37 . . . . 0.0 111.11 177.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.7 mm -56.87 -47.6 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 177.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 79.5 mt -66.58 -42.49 86.88 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.469 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.05 -43.28 96.01 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 123.27 0.628 . . . . 0.0 110.639 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -61.64 -44.22 97.38 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.833 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.2 pt -72.79 -35.06 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.855 177.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -60.7 -49.11 78.81 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 123.648 0.779 . . . . 0.0 110.719 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 pp -69.41 -28.89 66.55 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.972 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -76.29 -49.55 16.7 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.015 0.436 . . . . 0.0 111.951 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 43.2 tp . . . . . 0 C--N 1.314 -0.961 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.756 -176.274 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.551 HG23 ' HG2' ' A' ' 71' ' ' GLN . 13.3 tt . . . . . 0 N--CA 1.441 -0.903 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.588 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.2 ptmt -60.74 -36.42 78.85 Favored 'General case' 0 C--O 1.211 -0.921 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.274 177.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.8 m -69.84 -37.81 76.28 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.095 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.483 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 34.7 m -64.83 -40.69 95.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 175.424 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 41' ' ' ILE . 38.6 mm -55.46 -49.1 75.69 Favored 'Isoleucine or valine' 0 C--N 1.345 0.373 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 174.64 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.588 HG13 ' O ' ' A' ' 42' ' ' LYS . 78.4 mt -53.5 -50.84 46.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.702 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.483 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 15.5 m-85 -57.82 -43.39 85.73 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.79 0.805 . . . . 0.0 111.078 -176.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.0 t -73.95 -46.88 44.88 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.877 -175.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -69.74 -27.43 64.95 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 122.775 0.43 . . . . 0.0 111.86 -178.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.5 p -79.48 -22.33 44.22 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.7 t -95.08 -36.54 11.48 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.781 0.8 . . . . 0.0 109.89 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.614 ' O ' HG12 ' A' ' 56' ' ' ILE . 78.9 m-70 -92.54 42.41 1.1 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.018 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -48.82 -48.02 41.87 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 125.353 1.461 . . . . 0.0 114.403 -175.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -61.3 -45.62 93.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 120.874 0.368 . . . . 0.0 111.417 -174.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.487 ' CG ' HD21 ' A' ' 23' ' ' LEU . 1.7 mp0 -55.4 -53.12 60.2 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 123.879 0.871 . . . . 0.0 110.22 176.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 52' ' ' HIS . 34.3 mm -60.91 -47.04 95.19 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-N 113.727 -1.579 . . . . 0.0 111.289 -176.104 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -69.95 -28.22 65.39 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -72.59 -49.25 33.57 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.24 0.543 . . . . 0.0 111.168 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -118.93 60.34 0.81 Allowed 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 122.071 0.938 . . . . 0.0 109.742 -176.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -55.35 -37.63 67.74 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 113.466 -1.697 . . . . 0.0 112.487 -176.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.481 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER -78.44 -31.73 48.21 Favored 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -176.307 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -68.04 -51.15 50.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.479 ' HA ' HG12 ' A' ' 66' ' ' ILE . 84.9 m-85 -69.08 -31.25 69.86 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.064 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.44 -51.11 64.81 Favored 'General case' 0 C--O 1.245 0.834 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.104 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 72.8 mtm -65.43 -39.6 92.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.41 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 36.8 pt -66.93 -43.21 89.47 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 C-N-CA 118.367 -1.333 . . . . 0.0 111.024 177.423 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.14 -39.7 75.69 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.817 0.341 . . . . 0.0 110.756 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 14.0 tp10 -58.69 -56.2 25.23 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.607 176.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.5 mt -65.88 -39.62 85.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 123.985 0.914 . . . . 0.0 112.946 -176.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.608 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 96.6 mt -53.36 -46.98 69.8 Favored 'General case' 0 C--O 1.217 -0.614 0 C-N-CA 122.615 0.366 . . . . 0.0 111.445 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.551 ' HG2' HG23 ' A' ' 41' ' ' ILE . 44.4 mt-30 -72.53 -49.16 34.61 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 122.304 1.049 . . . . 0.0 109.784 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 68' ' ' GLU . 19.6 ttt180 -53.45 -42.03 66.74 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 127.194 2.197 . . . . 0.0 111.725 -176.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.545 ' OH ' ' HB2' ' A' ' 6' ' ' ASP . 55.6 m-85 -100.48 -14.36 18.3 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -178.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.608 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.71 -28.4 68.4 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.636 -0.826 . . . . 0.0 109.781 178.64 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -74.96 -19.45 60.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.511 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -97.79 -50.31 4.49 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -174.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.8 pt -118.73 -29.81 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.541 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 125.61 146.69 6.78 Favored Glycine 0 CA--C 1.5 -0.852 0 C-N-CA 120.299 -0.953 . . . . 0.0 110.893 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.3 tp -64.61 -38.72 83.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.972 0.386 . . . . 0.0 111.798 -175.022 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -59.22 -38.96 81.21 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.943 0.878 . . . . 0.0 110.133 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.448 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 1.8 m-20 -69.35 -48.57 60.97 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.354 -1.294 . . . . 0.0 109.774 -179.104 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.9 t -62.9 -43.09 98.71 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.294 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.581 -177.85 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.432 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 95.5 m-20 -56.46 -44.9 80.97 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.094 0.474 . . . . 0.0 110.778 178.761 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -40.36 90.48 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.2 mt -65.26 -40.26 93.73 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.336 179.055 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.5 mm -62.81 -43.64 98.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 177.27 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 87.7 mt -59.69 -44.52 93.61 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.62 176.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.4 m -62.08 -34.22 75.87 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 121.233 0.539 . . . . 0.0 110.877 178.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 76.7 m -70.82 -31.91 68.79 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 123.177 0.591 . . . . 0.0 111.905 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.5 pt . . . . . 0 C--N 1.315 -0.93 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.383 178.327 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 13.8 t70 . . . . . 0 C--O 1.25 1.129 0 N-CA-C 110.601 -0.148 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.537 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 38.8 Cg_exo -62.38 -34.69 76.17 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.76 2.307 . . . . 0.0 113.206 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -76.21 -34.5 59.26 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.666 0.746 . . . . 0.0 109.598 -178.207 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -64.47 -41.36 96.55 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.63 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.27 -33.77 65.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 C-N-CA 120.595 -0.442 . . . . 0.0 109.962 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.3 mttt -61.05 -43.27 99.14 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 174.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.0 mt -56.64 -42.58 79.14 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.014 0.525 . . . . 0.0 111.245 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.1 mmt180 -59.47 -39.37 83.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.155 178.183 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 . . . . . 0 C--N 1.312 -1.044 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.262 -179.137 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.424 HG11 ' CE2' ' A' ' 63' ' ' TYR . 16.5 m . . . . . 0 N--CA 1.431 -1.413 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.422 ' O ' HG23 ' A' ' 24' ' ' VAL . 49.7 t-20 -66.71 125.27 25.3 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -54.1 -37.42 64.27 Favored 'General case' 0 C--N 1.321 -0.658 0 O-C-N 123.955 0.785 . . . . 0.0 111.091 178.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -68.11 -36.62 80.04 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.137 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.64 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.3 tp -76.45 -39.13 54.2 Favored 'General case' 0 N--CA 1.416 -2.148 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.186 -177.39 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 20' ' ' ASN . 61.8 t -58.17 -48.07 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 176.379 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 48.4 ttp -58.29 -40.47 82.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.331 177.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -70.65 -36.2 73.28 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.396 178.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.64 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -58.93 -51.74 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 176.556 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 78.1 mt -60.66 -38.14 83.89 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.613 -179.326 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -71.15 -47.14 59.53 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.925 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.419 ' OE2' HG22 ' A' ' 48' ' ' VAL . 15.4 tt0 -63.46 -42.9 98.63 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.375 -176.563 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.4 HG21 HD13 ' A' ' 45' ' ' ILE . 32.5 pt -68.67 -37.63 77.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.696 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.931 177.782 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.37 -52.5 65.38 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 123.203 0.601 . . . . 0.0 111.48 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.98 -29.26 69.62 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.208 -177.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -76.21 -46.91 26.05 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.004 0.43 . . . . 0.0 110.476 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 20.7 tp . . . . . 0 C--O 1.253 1.243 0 C-N-CA 124.223 1.009 . . . . 0.0 112.451 -179.726 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.52 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.4 tt . . . . . 0 N--CA 1.446 -0.658 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.476 ' O ' HG13 ' A' ' 46' ' ' ILE . 65.2 pttt -69.28 -28.41 66.27 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.836 -178.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.0 m -71.33 -43.8 66.33 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.353 -0.84 . . . . 0.0 108.966 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.4 m -59.52 -40.61 87.68 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.092 176.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 41' ' ' ILE . 26.7 mm -51.66 -45.66 37.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.948 0.899 . . . . 0.0 110.108 175.701 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 42' ' ' LYS . 70.2 mt -56.85 -51.8 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.441 -177.244 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -60.57 -43.86 96.83 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.432 0.634 . . . . 0.0 110.871 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.419 HG22 ' OE2' ' A' ' 30' ' ' GLU . 46.6 t -69.15 -45.96 78.79 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.023 -174.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -68.05 -37.94 81.9 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.259 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 75.7 p -70.51 -21.46 62.74 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.119 0.485 . . . . 0.0 112.033 -178.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.3 t -92.86 -48.14 6.69 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.972 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.477 ' O ' HG12 ' A' ' 56' ' ' ILE . 86.2 m-70 -96.15 41.07 1.11 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 -174.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 85.6 mt -47.66 -41.32 22.04 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.679 1.592 . . . . 0.0 114.386 -175.414 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -53.56 -52.93 58.16 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.556 0.535 . . . . 0.0 112.431 -172.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -73.56 -34.06 64.97 Favored 'General case' 0 C--O 1.249 1.063 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.263 -176.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.521 ' HA ' ' CD2' ' A' ' 63' ' ' TYR . 40.1 mm -59.4 -43.45 90.37 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.66 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 50.1 mtp180 -70.84 -28.09 64.34 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -60.71 -55.83 28.57 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-O 121.676 0.75 . . . . 0.0 110.447 174.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -116.14 60.88 0.72 Allowed 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.514 -174.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -56.94 -36.65 70.49 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.544 -178.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -65.22 -39.47 92.81 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.682 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -64.6 -51.49 62.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.8 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.521 ' CD2' ' HA ' ' A' ' 56' ' ' ILE . 68.7 m-85 -68.72 -34.13 75.11 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -177.266 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -70.21 -45.49 66.48 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.858 0.361 . . . . 0.0 110.103 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.1 mtm -67.56 -41.74 83.74 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.244 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.513 HG12 ' HA ' ' A' ' 63' ' ' TYR . 43.7 pt -65.02 -35.96 76.69 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.013 0 C-N-CA 118.695 -1.202 . . . . 0.0 111.131 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.54 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -55.67 -44.56 77.38 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 123.409 0.443 . . . . 0.0 111.734 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -74.06 -37.96 64.09 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.375 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 90.3 mt -65.4 -42.42 93.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.543 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.609 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.6 mt -54.59 -46.13 73.73 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.728 178.519 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 64.2 mt-30 -62.34 -52.22 64.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.629 0.728 . . . . 0.0 109.828 179.232 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -58.9 -52.75 64.38 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.364 1.465 . . . . 0.0 112.403 -174.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -83.99 -22.54 31.34 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -175.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.609 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.98 -30.79 71.0 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 118.993 -1.083 . . . . 0.0 109.709 176.814 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -73.89 -19.84 60.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.943 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -99.66 -51.28 3.79 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.0 pt -113.95 -29.66 2.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.053 0.454 . . . . 0.0 111.803 -174.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.497 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 122.71 146.97 7.32 Favored Glycine 0 CA--C 1.491 -1.419 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 178.111 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tp -63.09 -35.91 73.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.938 0.369 . . . . 0.0 111.063 -175.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -55.36 -46.8 76.43 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-O 121.255 0.55 . . . . 0.0 110.729 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.466 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.0 t-20 -63.71 -49.49 72.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.237 -177.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 78' ' ' GLY . 20.6 t -62.59 -45.87 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.712 -175.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -53.83 -43.65 69.62 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.284 0.564 . . . . 0.0 111.26 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -44.46 78.59 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.245 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 84.6 mt -62.46 -38.07 88.39 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.637 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.475 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.4 mm -61.79 -41.94 92.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.09 -41.44 99.41 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.175 178.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.9 m -61.13 -34.29 74.74 Favored 'General case' 0 CA--C 1.555 1.161 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.985 176.207 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 36.5 m -63.4 -39.46 94.56 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 123.205 0.602 . . . . 0.0 111.453 -176.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 27.1 pt . . . . . 0 C--N 1.315 -0.925 0 CA-C-O 121.259 0.552 . . . . 0.0 111.748 179.989 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.462 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 18.2 t70 . . . . . 0 N--CA 1.439 -1.022 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.493 ' HA ' HG12 ' A' ' 10' ' ' VAL . 31.8 Cg_exo -61.97 -29.92 82.64 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.72 2.947 . . . . 0.0 113.95 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.98 -45.63 63.72 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -177.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -61.1 -44.83 96.76 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.313 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' A' ' 7' ' ' PRO . 9.2 p -62.62 -34.32 64.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 120.936 0.398 . . . . 0.0 110.65 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HE3' ' SD ' ' A' ' 65' ' ' MET . 55.8 mtmt -65.66 -43.26 89.9 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 122.221 -0.299 . . . . 0.0 110.697 173.872 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 94.9 mt -57.73 -38.63 75.63 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.117 0.484 . . . . 0.0 110.893 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -59.46 -40.52 87.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.426 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 . . . . . 0 C--N 1.314 -0.94 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.192 179.552 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.407 HG21 HG21 ' A' ' 24' ' ' VAL . 29.3 m . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -86.06 128.4 34.86 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -57.08 -39.93 75.93 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 123.041 0.536 . . . . 0.0 111.998 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -72.56 -34.61 67.62 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -174.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.635 ' O ' HG12 ' A' ' 27' ' ' ILE . 38.5 tp -71.75 -41.92 67.86 Favored 'General case' 0 N--CA 1.425 -1.696 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.233 -177.392 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.447 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 91.0 t -66.18 -41.62 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 120.829 0.347 . . . . 0.0 110.098 178.317 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 50.7 ttp -61.23 -37.08 81.79 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.891 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -69.48 -40.62 76.95 Favored 'General case' 0 C--O 1.205 -1.239 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.545 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.635 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.6 mm -56.66 -47.17 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 94.1 mt -62.22 -44.79 95.77 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.996 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.92 -46.92 73.33 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.304 0.573 . . . . 0.0 110.503 -178.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -62.04 -40.84 97.09 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.102 -175.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.435 ' CD1' HD13 ' A' ' 70' ' ' LEU . 45.2 pt -72.98 -40.71 59.61 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.676 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.045 176.148 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.14 -49.7 76.17 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 122.98 0.512 . . . . 0.0 111.423 -178.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.47 -31.85 72.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.989 0.423 . . . . 0.0 111.154 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -75.35 -44.47 45.0 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 57.0 tp . . . . . 0 N--CA 1.477 0.916 0 C-N-CA 124.636 1.174 . . . . 0.0 112.807 179.7 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.536 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.5 tt . . . . . 0 N--CA 1.444 -0.766 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.459 ' O ' HG13 ' A' ' 46' ' ' ILE . 64.8 pttt -66.49 -34.61 78.31 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.668 178.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.2 m -64.25 -44.87 90.43 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 176.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.6 m -57.53 -41.66 81.33 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.643 176.098 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.0 mm -55.64 -44.78 78.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 123.476 0.71 . . . . 0.0 110.104 177.086 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 42' ' ' LYS . 68.3 mt -52.27 -51.05 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.372 0.669 . . . . 0.0 111.875 -178.178 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -63.72 -52.74 59.17 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.438 0.637 . . . . 0.0 110.716 -176.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.8 t -62.53 -43.4 98.35 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.039 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.414 ' CE2' ' HB3' ' A' ' 63' ' ' TYR . 2.1 m-85 -72.19 -31.51 65.96 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.286 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.425 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 29.2 t -73.78 -31.27 63.21 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.384 0.612 . . . . 0.0 109.377 177.182 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.6 t -73.51 -53.39 10.7 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.424 178.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.521 ' O ' HG12 ' A' ' 56' ' ' ILE . 78.8 m-70 -100.68 42.62 1.1 Allowed 'General case' 0 C--N 1.304 -1.394 0 O-C-N 122.034 -0.416 . . . . 0.0 110.642 -172.469 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 50' ' ' SER . 82.1 mt -48.61 -38.75 21.72 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.529 1.132 . . . . 0.0 113.022 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -53.24 -50.81 64.01 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.402 ' HG3' ' CE2' ' A' ' 63' ' ' TYR . 14.3 tp10 -75.2 -34.04 61.46 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.209 177.285 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 52' ' ' HIS . 42.5 mm -60.34 -42.46 90.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-O 120.969 0.414 . . . . 0.0 110.39 -178.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.475 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 34.2 ptt180 -71.63 -33.65 69.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.07 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.3 tttm -66.56 -50.41 63.21 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 123.208 0.603 . . . . 0.0 109.615 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -114.71 60.38 0.68 Allowed 'General case' 0 CA--C 1.48 -1.725 0 CA-C-O 122.168 0.985 . . . . 0.0 111.279 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.475 ' HE3' ' O ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -55.59 -37.63 68.33 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 113.627 -1.624 . . . . 0.0 112.267 -177.088 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -70.93 -41.26 71.4 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 120.698 0.285 . . . . 0.0 110.78 -178.469 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.436 ' O ' HG12 ' A' ' 66' ' ' ILE . 83.3 t80 -62.91 -51.48 66.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.125 -178.397 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.533 ' HA ' HG12 ' A' ' 66' ' ' ILE . 93.4 m-85 -73.47 -24.69 60.23 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -177.097 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -72.93 -50.09 25.6 Favored 'General case' 0 C--O 1.265 1.902 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.475 ' SD ' ' HE3' ' A' ' 11' ' ' LYS . 79.2 mtm -65.37 -47.93 74.69 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.421 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.533 HG12 ' HA ' ' A' ' 63' ' ' TYR . 48.5 pt -63.95 -34.5 68.81 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.525 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.69 -178.451 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.536 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.01 -45.47 79.08 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 123.125 0.266 . . . . 0.0 111.614 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.71 -34.3 58.16 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 118.67 -1.212 . . . . 0.0 111.789 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 65' ' ' MET . 85.0 mt -60.59 -45.08 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.214 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.619 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 87.3 mt -55.65 -45.64 77.61 Favored 'General case' 0 C--O 1.21 -1.021 0 C-N-CA 123.535 0.734 . . . . 0.0 110.89 179.741 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.536 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.7 mt-30 -68.86 -49.34 59.14 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 121.31 0.576 . . . . 0.0 110.566 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -61.86 -49.17 77.32 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 124.161 0.984 . . . . 0.0 111.817 -177.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.469 ' CE2' ' HD3' ' A' ' 76' ' ' LYS . 63.6 m-85 -82.38 -16.9 47.45 Favored 'General case' 0 N--CA 1.427 -1.581 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -177.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.619 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.46 -29.79 69.33 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 172.651 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -79.63 -44.11 21.57 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.904 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.469 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 65.7 tttm -72.85 -44.82 60.91 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.76 -25.92 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.589 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 122.05 141.36 6.02 Favored Glycine 0 C--N 1.311 -0.824 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 178.552 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.3 tp -61.06 -37.66 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 117.202 0.501 . . . . 0.0 112.061 -173.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -60.41 -43.73 96.41 Favored 'General case' 0 C--O 1.244 0.796 0 CA-C-O 122.136 0.969 . . . . 0.0 109.667 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.422 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 94.0 m-20 -67.66 -40.39 84.49 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.729 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.5 t -66.52 -41.42 88.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.74 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.428 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.9 OUTLIER -52.43 -49.58 64.27 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 121.218 0.532 . . . . 0.0 110.199 177.559 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -44.9 92.09 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.401 -177.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.7 mt -66.18 -35.96 81.83 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.8 mm -65.53 -41.64 91.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 175.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 94.8 mt -63.34 -40.1 96.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.98 176.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 94.3 m -59.07 -33.61 71.0 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 123.859 0.864 . . . . 0.0 110.914 176.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.4 m -69.14 -48.29 62.77 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.94 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.2 pt . . . . . 0 C--O 1.237 0.434 0 CA-C-O 121.037 0.446 . . . . 0.0 112.061 -178.886 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.401 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 4.8 t70 . . . . . 0 N--CA 1.447 -0.608 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -65.57 -28.92 52.84 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.624 2.216 . . . . 0.0 112.522 175.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -74.84 -39.32 61.67 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 121.765 -0.584 . . . . 0.0 109.425 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -65.51 -44.04 88.22 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.143 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.07 -34.71 70.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 121.195 0.521 . . . . 0.0 110.14 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.4 mtmp? -67.83 -36.95 81.26 Favored 'General case' 0 C--O 1.198 -1.64 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.165 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.9 mt -59.29 -40.46 86.22 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.778 0.263 . . . . 0.0 111.337 176.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -61.37 -41.18 96.66 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.273 0.559 . . . . 0.0 111.644 177.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 . . . . . 0 C--N 1.305 -1.347 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.961 -178.426 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.465 HG21 HG21 ' A' ' 24' ' ' VAL . 19.7 m . . . . . 0 C--O 1.252 1.196 0 CA-C-O 120.946 0.403 . . . . 0.0 111.059 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -85.76 119.72 26.4 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 171.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -54.62 -35.96 63.99 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 123.486 0.491 . . . . 0.0 111.552 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -70.22 -35.0 73.57 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-O 121.252 0.548 . . . . 0.0 109.964 -176.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.602 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.1 tp -76.83 -42.32 40.75 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.16 -177.495 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.526 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 62.9 t -61.2 -43.6 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.687 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.8 ttp -60.52 -33.68 72.99 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.236 178.265 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -75.4 -38.86 59.64 Favored 'General case' 0 C--O 1.206 -1.212 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.613 176.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.2 mm -56.99 -52.39 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 121.331 0.586 . . . . 0.0 110.161 -179.74 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.552 ' HB2' ' OD1' ' A' ' 83' ' ' ASN . 3.2 pp -71.4 -30.57 66.25 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.582 -178.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -68.38 -44.37 75.3 Favored 'General case' 0 C--N 1.299 -1.587 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.019 176.075 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.19 -38.19 90.16 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.75 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.6 pt -70.15 -41.43 78.97 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.188 176.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.451 ' OE1' ' HG2' ' A' ' 80' ' ' GLU . 37.2 tt0 -59.13 -54.45 46.82 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.013 0.925 . . . . 0.0 111.383 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -63.63 -34.52 78.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -178.271 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.48 ' N ' HD12 ' A' ' 33' ' ' LEU . 18.4 t0 -76.28 -40.73 50.94 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.139 -178.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.9 tp . . . . . 0 C--O 1.249 1.059 0 C-N-CA 124.776 1.231 . . . . 0.0 111.792 179.827 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.568 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.5 tt . . . . . 0 CA--C 1.547 0.862 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.449 ' O ' HG13 ' A' ' 46' ' ' ILE . 58.6 pttt -61.75 -33.7 74.52 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.19 0.519 . . . . 0.0 110.445 175.698 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.4 m -74.55 -41.65 60.21 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.235 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.401 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 12.8 m -58.45 -40.77 83.5 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.835 175.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.568 HG12 ' O ' ' A' ' 41' ' ' ILE . 32.8 mm -54.34 -46.92 69.71 Favored 'Isoleucine or valine' 0 C--N 1.349 0.555 0 C-N-CA 123.815 0.846 . . . . 0.0 110.256 176.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 42' ' ' LYS . 71.8 mt -52.13 -51.43 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 123.481 0.712 . . . . 0.0 111.789 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.401 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 25.1 m-85 -59.73 -53.26 60.09 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.676 0.75 . . . . 0.0 110.971 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.1 t -66.83 -41.91 88.42 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.665 -174.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -68.86 -38.98 80.1 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.314 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.4 t -69.96 -26.71 64.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.417 0.627 . . . . 0.0 110.292 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.8 t -82.31 -48.21 11.46 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-O 121.341 0.591 . . . . 0.0 110.696 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.487 ' O ' HG12 ' A' ' 56' ' ' ILE . 73.9 m-70 -101.19 40.9 1.23 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.73 -174.375 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 89.5 mt -47.04 -39.87 13.71 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.332 1.453 . . . . 0.0 113.893 -177.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -54.14 -50.79 66.12 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -175.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -73.07 -35.79 66.74 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 120.991 0.424 . . . . 0.0 109.861 -178.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 52' ' ' HIS . 43.6 mm -58.58 -51.16 75.08 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.165 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.915 -179.138 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -77.47 -16.09 58.95 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -74.99 -48.56 23.57 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 20.7 m120 -116.83 53.55 0.89 Allowed 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.073 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -57.23 -39.96 76.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.012 -0.995 . . . . 0.0 113.408 -174.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -62.03 -37.27 84.31 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.268 0.556 . . . . 0.0 110.957 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -69.01 -49.3 58.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.897 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.544 ' HA ' HG12 ' A' ' 66' ' ' ILE . 72.9 m-85 -68.31 -33.45 74.34 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.298 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.19 -48.12 82.99 Favored 'General case' 0 C--O 1.254 1.339 0 CA-C-O 121.209 0.528 . . . . 0.0 109.882 177.198 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.421 ' O ' ' HB3' ' A' ' 68' ' ' GLU . 79.2 mtm -68.9 -45.8 69.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.82 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.545 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.6 pt -69.23 -37.86 76.79 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.448 0 C-N-CA 119.014 -1.075 . . . . 0.0 112.968 -177.295 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.12 -38.39 76.41 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.427 0.632 . . . . 0.0 109.815 177.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 65' ' ' MET . 19.3 tp10 -63.51 -56.38 16.48 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.27 176.191 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.6 mt -59.47 -39.08 78.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.208 0.603 . . . . 0.0 112.498 -178.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.8 mt -53.98 -50.95 65.4 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 122.658 0.383 . . . . 0.0 111.771 178.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -70.84 -49.4 46.65 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 122.241 1.02 . . . . 0.0 109.385 -178.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.417 ' HD2' ' OE2' ' A' ' 68' ' ' GLU . 29.0 ttt180 -54.93 -38.95 68.34 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 127.655 2.382 . . . . 0.0 111.797 -177.047 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.401 ' OH ' ' HB2' ' A' ' 6' ' ' ASP 0.257 28.6 m-85 -99.83 -14.69 18.69 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -178.652 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.436 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.26 -26.58 66.64 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 174.374 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -78.13 -17.87 56.36 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.653 176.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.418 ' HE2' ' HB3' ' A' ' 76' ' ' LYS . 52.8 mtpt -99.93 -51.57 3.67 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.389 0.614 . . . . 0.0 112.307 179.209 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.4 pt -117.37 -27.23 2.45 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.072 -173.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 116.83 148.66 8.95 Favored Glycine 0 N--CA 1.434 -1.46 0 C-N-CA 120.297 -0.954 . . . . 0.0 111.076 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.41 HD13 ' CD1' ' A' ' 41' ' ' ILE . 5.5 tp -59.71 -42.41 88.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -175.305 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.451 ' HG2' ' OE1' ' A' ' 32' ' ' GLU . 41.6 mt-10 -64.59 -35.85 82.34 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 121.151 0.5 . . . . 0.0 111.56 -176.555 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -64.51 -47.3 79.4 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.552 174.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.7 t -63.83 -42.32 95.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.08 -178.438 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.552 ' OD1' ' HB2' ' A' ' 28' ' ' LEU . 95.3 m-20 -51.92 -47.93 64.44 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.513 0.725 . . . . 0.0 111.307 177.457 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -45.02 76.92 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.295 -0.866 . . . . 0.0 108.868 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.404 ' O ' ' HB ' ' A' ' 88' ' ' THR . 95.7 mt -61.98 -39.59 92.72 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.9 mm -63.56 -40.2 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 120.915 0.388 . . . . 0.0 109.958 177.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 92.6 mt -64.35 -37.09 86.28 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.801 0.81 . . . . 0.0 109.467 177.441 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 85' ' ' LEU . 86.4 m -66.05 -34.31 77.78 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.59 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 m -64.48 -40.9 96.55 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 120.822 0.344 . . . . 0.0 110.508 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.0 pt . . . . . 0 C--N 1.318 -0.795 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -177.048 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.6 t70 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 120.396 0.141 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.492 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 39.4 Cg_exo -61.87 -28.03 80.86 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.165 2.576 . . . . 0.0 113.664 -179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 9.4 mm-40 -72.23 -32.21 66.53 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.586 -176.403 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -66.86 -44.11 81.83 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.349 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.8 p -67.44 -34.21 67.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-O 121.269 0.557 . . . . 0.0 109.859 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.492 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 68.5 mttm -62.37 -42.65 99.58 Favored 'General case' 0 C--O 1.207 -1.17 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.731 174.82 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 92.9 mt -58.62 -34.97 71.76 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.586 0.231 . . . . 0.0 111.564 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.4 mmm180 -63.86 -32.02 73.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.117 0.484 . . . . 0.0 110.416 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 . . . . . 0 C--N 1.316 -0.869 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.356 177.987 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 m . . . . . 0 N--CA 1.445 -0.709 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.43 ' O ' HG23 ' A' ' 24' ' ' VAL . 48.7 t-20 -86.91 113.14 22.44 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 106.533 -1.654 . . . . 0.0 106.533 173.004 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -53.09 -36.88 61.18 Favored 'General case' 0 C--N 1.314 -0.958 0 O-C-N 123.657 0.598 . . . . 0.0 111.166 179.393 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -74.49 -35.17 63.23 Favored 'General case' 0 CA--C 1.487 -1.478 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.646 -172.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.622 ' O ' HG12 ' A' ' 27' ' ' ILE . 25.0 tp -76.64 -39.08 53.44 Favored 'General case' 0 N--CA 1.418 -2.051 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.162 -178.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 20' ' ' ASN . 61.2 t -62.44 -40.91 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.1 ttp -59.65 -43.18 94.0 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.722 176.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -67.2 -38.28 85.06 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.911 177.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.75 -52.08 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 176.921 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.5 mt -62.02 -41.42 98.07 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.961 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -66.93 -47.29 72.14 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-O 121.436 0.636 . . . . 0.0 110.472 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -64.16 -40.79 96.88 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.907 -176.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.1 pt -70.09 -40.05 77.9 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.933 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.808 176.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.63 -50.21 74.68 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.076 0.95 . . . . 0.0 111.407 -178.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.424 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.3 pp -62.59 -34.09 76.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.184 -178.224 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.424 ' N ' HD12 ' A' ' 33' ' ' LEU . 29.4 t70 -76.75 -50.26 14.01 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.728 176.071 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.0 tp . . . . . 0 C--O 1.247 0.964 0 C-N-CA 125.258 1.423 . . . . 0.0 113.05 -176.421 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.53 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.8 tt . . . . . 0 C--O 1.206 -1.231 0 CA-C-O 120.936 0.398 . . . . 0.0 110.328 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.415 ' O ' HG13 ' A' ' 46' ' ' ILE . 40.4 mtmt -56.68 -46.96 80.85 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.524 0.729 . . . . 0.0 109.764 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.6 m -71.65 -36.62 70.75 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 114.667 -1.151 . . . . 0.0 109.754 -179.027 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.5 m -61.4 -39.68 91.59 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.917 176.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 41' ' ' ILE . 35.7 mm -56.9 -48.75 80.9 Favored 'Isoleucine or valine' 0 C--N 1.351 0.637 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 42' ' ' LYS . 68.1 mt -52.93 -48.72 51.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 115.333 -0.848 . . . . 0.0 112.473 -177.404 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -60.96 -53.36 58.16 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.769 0.795 . . . . 0.0 110.312 -176.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.04 -46.04 94.96 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.634 -174.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -66.49 -37.7 85.65 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.32 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.9 t -71.81 -26.93 62.6 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-O 120.983 0.421 . . . . 0.0 110.775 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.2 t -81.79 -44.73 16.58 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.376 0.608 . . . . 0.0 109.97 178.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.494 ' O ' HG12 ' A' ' 56' ' ' ILE . 82.7 m-70 -102.14 38.97 1.55 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.349 -175.034 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 77.8 mt -47.64 -36.79 11.5 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 -177.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.547 ' O ' ' HD3' ' A' ' 58' ' ' LYS . 26.1 t70 -54.43 -51.55 64.58 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -176.526 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -73.55 -29.72 62.61 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.65 -177.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 52' ' ' HIS . 37.8 mm -64.19 -45.74 95.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.054 179.336 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -74.3 -32.71 62.98 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.537 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' A' ' 54' ' ' ASP . 2.1 mptm? -63.8 -43.44 96.27 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 120.769 0.319 . . . . 0.0 110.87 177.145 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -123.92 60.99 1.1 Allowed 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.864 0.84 . . . . 0.0 111.076 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -64.06 -25.88 68.31 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.156 -176.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -69.41 -52.16 29.5 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -59.41 -50.66 73.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.778 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.531 ' HA ' HG12 ' A' ' 66' ' ' ILE . 74.2 m-85 -67.05 -32.29 73.38 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.007 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -67.74 -44.94 76.38 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.17 0.51 . . . . 0.0 110.297 177.265 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 88.2 mtp -67.55 -45.8 74.61 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.694 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.533 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 48.0 pt -66.64 -36.36 77.06 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.566 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.681 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.78 -40.7 80.43 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.112 0.415 . . . . 0.0 110.424 178.012 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -62.71 -51.38 67.39 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.268 177.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 82.0 mt -63.64 -41.29 92.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.956 -178.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 86.5 mt -58.51 -48.71 79.92 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.85 0.46 . . . . 0.0 111.554 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.47 ' HG2' HG23 ' A' ' 41' ' ' ILE . 46.6 mt-30 -64.43 -48.7 74.33 Favored 'General case' 0 C--O 1.251 1.17 0 CA-C-O 122.192 0.996 . . . . 0.0 109.815 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -60.0 -45.7 91.88 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 113.833 -1.531 . . . . 0.0 110.905 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.5 ' CE2' ' HD3' ' A' ' 76' ' ' LYS 0.252 31.5 m-85 -91.81 -21.28 20.75 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -174.921 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -67.5 -31.19 71.15 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 118.37 -1.332 . . . . 0.0 108.543 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -74.26 -38.16 63.53 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.177 0.513 . . . . 0.0 110.141 176.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.5 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 87.1 tttt -75.66 -51.02 13.72 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.711 -175.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.5 pt -122.27 -30.7 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.154 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.542 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 127.58 143.8 5.8 Favored Glycine 0 C--N 1.315 -0.602 0 C-N-CA 120.347 -0.93 . . . . 0.0 111.997 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tp -60.87 -40.55 85.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -175.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -59.58 -39.6 84.66 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.678 0.752 . . . . 0.0 110.225 -178.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.498 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.3 m-20 -66.24 -50.26 64.38 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.291 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 78' ' ' GLY . 25.3 t -63.88 -38.34 82.1 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.885 -176.531 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 -52.94 -50.11 64.68 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.024 0.929 . . . . 0.0 109.715 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -39.47 80.6 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.009 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 91.7 mt -66.22 -38.4 87.86 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -178.117 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.7 mm -66.11 -39.44 84.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.18 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.06 -39.25 93.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.325 176.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 86.0 m -58.87 -34.03 71.15 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.426 0.69 . . . . 0.0 110.193 176.179 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 65.1 m -65.18 -45.94 82.83 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.825 -178.134 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.1 pt . . . . . 0 C--N 1.32 -0.717 0 CA-C-O 121.288 0.566 . . . . 0.0 112.095 -177.977 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.482 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 13.8 t70 . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 9.1 Cg_exo -72.16 -28.73 15.31 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.042 2.494 . . . . 0.0 113.19 178.298 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -76.23 -31.33 58.31 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 122.038 0.923 . . . . 0.0 109.052 -177.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -59.4 -43.06 93.05 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.512 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 7' ' ' PRO . 7.5 p -68.05 -33.8 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 C-N-CA 120.171 -0.611 . . . . 0.0 110.19 178.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.27 -38.09 79.24 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.868 0.365 . . . . 0.0 110.08 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.67 -38.72 90.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.689 176.164 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -61.9 -38.57 88.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.576 177.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 . . . . . 0 C--N 1.317 -0.806 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.915 178.354 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.447 HG21 HG21 ' A' ' 24' ' ' VAL . 27.2 m . . . . . 0 C--O 1.249 1.047 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.474 ' O ' HG23 ' A' ' 24' ' ' VAL . 19.9 m120 -72.95 107.09 5.14 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.848 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -51.91 -48.29 64.25 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -68.56 -29.45 68.0 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-O 121.155 0.502 . . . . 0.0 110.341 -175.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.56 ' O ' HG12 ' A' ' 27' ' ' ILE . 32.7 tp -77.34 -41.83 38.97 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.934 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 20' ' ' ASN . 60.8 t -61.81 -43.96 98.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.539 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.4 ttp -56.37 -36.64 69.05 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.682 177.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -75.62 -38.44 58.98 Favored 'General case' 0 C--O 1.211 -0.942 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.221 177.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.56 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.8 mm -57.0 -50.62 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.359 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.459 ' HB3' ' CG ' ' A' ' 83' ' ' ASN . 86.3 mt -61.61 -42.92 99.57 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.325 -1.307 . . . . 0.0 110.273 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -62.05 -48.29 80.89 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.65 178.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -62.53 -39.89 95.02 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.516 -175.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.439 HG21 HD13 ' A' ' 45' ' ' ILE . 38.7 pt -73.54 -37.9 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.807 176.226 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -59.54 -52.7 64.44 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.943 0.897 . . . . 0.0 110.844 -178.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.414 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.4 pp -68.12 -28.6 67.47 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.086 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.414 ' N ' HD12 ' A' ' 33' ' ' LEU . 26.9 t70 -70.74 -44.02 67.65 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.011 0.434 . . . . 0.0 110.357 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.0 tt . . . . . 0 C--O 1.248 1.005 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 176.081 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.514 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.0 tt . . . . . 0 N--CA 1.434 -1.23 0 N-CA-C 111.472 0.175 . . . . 0.0 111.472 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.536 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.5 ptmt -64.48 -32.64 74.36 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.356 -179.475 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.6 m -67.31 -45.77 75.51 Favored 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.7 m -61.24 -40.64 94.8 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.608 177.455 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.514 HG12 ' O ' ' A' ' 41' ' ' ILE . 30.1 mm -53.67 -44.3 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.904 0.881 . . . . 0.0 109.948 176.087 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 42' ' ' LYS . 77.2 mt -54.75 -52.46 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.87 -177.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.38 -46.07 90.3 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-O 121.35 0.595 . . . . 0.0 111.349 -176.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.54 -46.21 71.14 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.581 -172.251 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.404 ' HA ' HG13 ' A' ' 56' ' ' ILE . 4.2 m-30 -65.18 -38.81 91.71 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.232 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 82.9 p -73.81 -21.77 60.03 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.379 0.609 . . . . 0.0 111.692 -177.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.7 t -93.58 -20.33 20.32 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-O 121.1 0.476 . . . . 0.0 110.99 -178.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.522 ' O ' HG12 ' A' ' 56' ' ' ILE . 62.5 m-70 -123.8 39.27 4.0 Favored 'General case' 0 C--N 1.317 -0.805 0 O-C-N 121.804 -0.56 . . . . 0.0 109.738 -176.359 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 93.8 mt -49.32 -36.79 22.19 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -174.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -56.59 -51.51 68.34 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -176.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -73.14 -36.91 66.75 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 52' ' ' HIS . 42.4 mm -62.36 -49.3 84.48 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.648 -177.062 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -77.18 -26.58 53.07 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.254 0.55 . . . . 0.0 111.398 -175.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -71.41 -43.49 66.67 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.561 0.696 . . . . 0.0 109.681 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -116.32 46.54 1.57 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 114.909 -1.041 . . . . 0.0 108.479 -177.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -59.97 -32.64 71.01 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.561 -174.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -64.14 -43.36 95.44 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -66.07 -51.57 56.9 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.999 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.496 ' HA ' HG12 ' A' ' 66' ' ' ILE . 68.3 m-85 -67.82 -28.95 68.01 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -74.05 -44.47 54.11 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.467 177.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.8 mtm -65.07 -45.85 83.6 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.664 179.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.7 pt -63.38 -41.96 94.6 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.028 0 C-N-CA 119.519 -0.872 . . . . 0.0 111.912 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.524 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.88 -36.69 65.39 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.193 0.52 . . . . 0.0 111.433 -178.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.51 -54.9 10.37 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.602 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 78.9 mt -60.57 -40.73 85.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.146 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.1 mt -55.22 -46.89 75.95 Favored 'General case' 0 C--O 1.213 -0.854 0 C-N-CA 123.129 0.571 . . . . 0.0 111.436 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.524 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 63.2 mt-30 -69.33 -41.37 76.75 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.314 0.578 . . . . 0.0 110.15 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -59.97 -47.04 87.44 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.214 1.006 . . . . 0.0 110.308 -178.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -87.14 -15.51 38.18 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.494 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.81 -29.65 69.64 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 176.369 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -78.76 -28.11 44.76 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.404 176.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -90.18 -51.31 5.51 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -174.006 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.3 pt -121.47 -19.07 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -176.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.592 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 109.0 140.6 9.08 Favored Glycine 0 C--N 1.305 -1.188 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 178.68 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.404 HD13 HD12 ' A' ' 41' ' ' ILE . 7.2 tp -57.26 -40.47 73.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -174.023 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -57.69 -41.77 82.33 Favored 'General case' 0 C--O 1.251 1.142 0 CA-C-O 122.252 1.025 . . . . 0.0 109.993 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.524 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 49.0 m-80 -70.51 -43.53 69.45 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 113.971 -1.468 . . . . 0.0 111.379 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 78' ' ' GLY . 12.6 t -63.51 -46.21 95.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 O-C-N 123.231 0.332 . . . . 0.0 110.293 -177.709 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.459 ' CG ' ' HB3' ' A' ' 28' ' ' LEU . 95.1 m-20 -52.31 -47.06 66.17 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.818 0.699 . . . . 0.0 110.83 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -60.84 -41.33 95.61 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.378 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 65.7 mt -74.34 -31.24 62.36 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.368 -177.166 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.7 mm -63.2 -37.49 79.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 84.9 mt -63.31 -39.52 94.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.549 176.575 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 17.3 m -66.39 -33.67 76.23 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.556 0.693 . . . . 0.0 110.056 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 78.6 m -64.72 -48.62 73.98 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.102 -178.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 36.6 pt . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.44 -179.576 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.2 t70 . . . . . 0 N--CA 1.435 -1.221 0 CA-C-O 120.325 0.107 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.526 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 26.8 Cg_exo -63.02 -34.67 69.65 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.652 2.235 . . . . 0.0 113.018 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 5.6 mm-40 -77.64 -30.13 52.05 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.309 0.576 . . . . 0.0 111.528 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -66.35 -38.71 88.23 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.762 176.555 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG12 ' O ' ' A' ' 7' ' ' PRO . 9.3 p -68.6 -33.43 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.817 177.11 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 7' ' ' PRO . 40.1 mmtm -55.04 -36.03 65.09 Favored 'General case' 0 C--N 1.361 1.104 0 CA-C-O 121.054 0.454 . . . . 0.0 110.038 173.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.34 -38.41 81.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.068 179.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -65.28 -32.89 74.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.569 0.699 . . . . 0.0 109.708 176.308 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 . . . . . 0 C--N 1.309 -1.165 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.079 177.522 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.42 HG21 HG21 ' A' ' 24' ' ' VAL . 15.7 m . . . . . 0 C--O 1.247 0.972 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -78.78 118.64 21.03 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 173.144 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -55.37 -35.51 65.35 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 123.643 0.777 . . . . 0.0 111.657 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -74.24 -31.52 62.62 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.12 -174.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.607 ' O ' HG12 ' A' ' 27' ' ' ILE . 31.4 tp -76.48 -41.95 45.3 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.434 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.42 HG21 HG21 ' A' ' 19' ' ' VAL . 59.3 t -61.54 -42.17 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 176.725 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 38.1 ttm -55.61 -44.65 77.24 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 175.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -67.12 -40.84 86.9 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.133 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.2 mm -56.74 -52.03 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.402 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.05 -40.88 99.03 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.683 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -65.22 -49.02 71.3 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.418 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -60.95 -42.5 98.36 Favored 'General case' 0 C--O 1.246 0.891 0 C-N-CA 124.643 1.177 . . . . 0.0 110.471 -176.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.41 ' CD1' HD13 ' A' ' 70' ' ' LEU . 41.2 pt -72.69 -38.99 59.77 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.96 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.542 177.152 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -61.94 -48.72 79.12 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 123.523 0.729 . . . . 0.0 112.022 -176.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.408 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -69.89 -27.0 64.44 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.996 0.427 . . . . 0.0 111.711 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.408 ' N ' HD12 ' A' ' 33' ' ' LEU . 19.0 t70 -75.78 -43.4 46.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.286 0.565 . . . . 0.0 109.6 177.269 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 41' ' ' ILE . 58.6 tp . . . . . 0 C--N 1.316 -0.888 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.885 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.633 HG23 ' HG2' ' A' ' 71' ' ' GLN . 6.7 tt . . . . . 0 N--CA 1.445 -0.69 0 CA-C-O 120.168 0.032 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.529 ' O ' HG13 ' A' ' 46' ' ' ILE . 60.4 pttt -56.49 -38.62 72.0 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-O 120.712 0.291 . . . . 0.0 111.142 176.449 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.0 m -69.55 -42.05 75.09 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.684 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.433 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 22.8 m -62.15 -38.19 88.06 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.496 176.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 41' ' ' ILE . 33.5 mm -56.55 -48.96 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.53 0.732 . . . . 0.0 110.055 176.303 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 42' ' ' LYS . 77.1 mt -52.89 -47.58 52.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.537 -177.068 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.433 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 23.9 m-85 -61.07 -53.36 58.1 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.661 0.744 . . . . 0.0 109.939 -175.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -64.77 -44.77 96.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-N 114.295 -1.321 . . . . 0.0 111.481 -174.395 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -63.41 -39.28 94.06 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.265 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.42 ' HA ' ' CD2' ' A' ' 53' ' ' LEU . 21.9 t -73.52 -21.82 60.28 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 120.677 0.275 . . . . 0.0 111.165 -179.392 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.1 t -94.1 -3.96 50.17 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.433 0.635 . . . . 0.0 110.333 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.544 ' O ' HG12 ' A' ' 56' ' ' ILE . 91.6 m-70 -140.48 37.47 1.86 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.42 ' CD2' ' HA ' ' A' ' 50' ' ' SER . 84.0 mt -47.62 -45.18 27.42 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -172.491 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -60.1 -48.94 79.62 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -172.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -67.38 -33.95 76.28 Favored 'General case' 0 C--O 1.245 0.819 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 52' ' ' HIS . 39.3 mm -63.94 -42.14 94.81 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.25 0 CA-C-N 115.19 -0.913 . . . . 0.0 108.969 178.181 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.476 ' NE ' ' HA ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -65.15 -50.05 67.51 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 123.351 0.661 . . . . 0.0 111.06 -177.386 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -57.75 -33.78 68.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.461 -178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.437 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 30.6 m-80 -127.3 46.52 2.51 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -175.595 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -53.45 -36.6 61.77 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.774 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -71.32 -42.04 69.09 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.437 ' HB3' ' HB3' ' A' ' 59' ' ' ASN . 85.8 t80 -62.18 -49.6 75.14 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.895 178.487 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.497 ' HA ' HG12 ' A' ' 66' ' ' ILE . 61.5 m-85 -67.7 -32.89 73.85 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -178.013 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -69.2 -47.41 64.91 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.142 -0.623 . . . . 0.0 109.966 174.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.8 mtm -59.18 -46.54 88.13 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.92 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.535 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 37.9 pt -66.71 -41.03 87.44 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.974 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.231 178.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.18 -41.63 93.3 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.102 0.477 . . . . 0.0 110.191 179.105 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -58.71 -55.99 27.94 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.002 177.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.5 mt -61.8 -40.62 87.6 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.838 0 C-N-CA 124.173 0.989 . . . . 0.0 112.301 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 89.7 mt -55.8 -46.02 78.12 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.556 0.343 . . . . 0.0 111.321 177.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.633 ' HG2' HG23 ' A' ' 41' ' ' ILE . 44.7 mt-30 -69.99 -51.67 30.59 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.934 0.873 . . . . 0.0 109.792 179.295 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.8 ttt85 -54.84 -43.82 73.39 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 125.709 1.604 . . . . 0.0 111.506 -179.035 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -95.92 -14.87 22.77 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 115.601 1.704 . . . . 0.0 115.601 -176.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.51 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -64.84 -31.45 72.69 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 174.058 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 71' ' ' GLN . 91.3 mttt -70.47 -46.25 64.13 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.05 177.203 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -76.66 -50.53 13.49 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -173.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.7 pt -121.23 -29.64 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -174.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.529 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.33 145.13 6.6 Favored Glycine 0 C--N 1.317 -0.488 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.8 tp -62.69 -39.26 84.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -175.218 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -62.83 -36.22 82.49 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-O 121.29 0.567 . . . . 0.0 111.808 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.576 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 16.3 m120 -65.54 -48.26 73.06 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.632 178.032 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 78' ' ' GLY . 19.5 t -64.42 -44.98 97.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.415 -177.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -50.82 -49.94 57.61 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.618 1.167 . . . . 0.0 110.137 179.268 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -43.31 79.48 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.604 -178.27 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 81.3 mt -64.85 -35.4 80.99 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.9 mm -64.97 -43.06 96.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.3 mt -62.0 -42.12 98.8 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.797 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.1 m -62.58 -32.16 73.1 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 123.911 0.885 . . . . 0.0 110.78 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.6 m -69.57 -43.95 71.82 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.279 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.7 pt . . . . . 0 C--N 1.317 -0.837 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.518 -179.346 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 C--O 1.241 0.614 0 CA-C-O 121.564 0.697 . . . . 0.0 110.025 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.2 m -138.6 179.89 6.21 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.1 tp -156.26 14.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 84.0 mt -97.87 -14.88 20.46 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 113.79 -1.55 . . . . 0.0 111.833 -168.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.37 -18.61 61.97 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -177.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -112.06 131.55 22.45 Favored Pre-proline 0 C--N 1.314 -0.973 0 C-N-CA 118.779 -1.169 . . . . 0.0 113.648 -174.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.09 -23.69 62.37 Favored 'Trans proline' 0 CA--C 1.548 1.218 0 C-N-CA 123.804 3.002 . . . . 0.0 115.274 175.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.441 ' OE1' ' HG2' ' A' ' 65' ' ' MET . 32.8 mm-40 -65.14 -34.57 78.72 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.382 0.992 . . . . 0.0 109.917 179.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -67.36 -42.78 82.9 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.753 -177.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.487 ' O ' ' HG3' ' A' ' 14' ' ' GLN . 11.5 p -65.02 -34.59 71.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.123 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -65.69 -38.03 88.12 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.914 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.53 -44.58 93.15 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.503 0.668 . . . . 0.0 109.614 174.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -39.09 90.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.672 178.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.487 ' HG3' ' O ' ' A' ' 10' ' ' VAL . 96.0 mt-30 -63.92 -41.14 97.74 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 122.73 0.412 . . . . 0.0 111.516 178.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -74.46 -13.98 60.77 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt 69.7 2.58 3.87 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.736 1.214 . . . . 0.0 111.473 177.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 95.43 -80.26 0.83 Allowed Glycine 0 N--CA 1.435 -1.378 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt 63.71 10.76 5.31 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.976 1.311 . . . . 0.0 113.11 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.454 HG21 HG21 ' A' ' 24' ' ' VAL . 34.3 m -100.62 169.69 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 C-N-CA 123.321 0.648 . . . . 0.0 110.773 -176.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -76.69 113.25 14.12 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -58.31 -34.8 70.97 Favored 'General case' 0 C--N 1.308 -1.239 0 O-C-N 123.557 0.536 . . . . 0.0 110.607 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -74.94 -37.8 61.9 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.809 -173.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.554 ' O ' HG12 ' A' ' 27' ' ' ILE . 19.3 tp -77.44 -40.81 42.09 Favored 'General case' 0 N--CA 1.423 -1.817 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.747 -177.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.454 HG21 HG21 ' A' ' 19' ' ' VAL . 86.1 t -65.13 -39.1 84.44 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 59.9 ttp -57.86 -37.11 73.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.711 176.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -75.86 -40.13 55.27 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.431 177.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.554 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.4 mm -56.99 -51.75 64.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.05 -41.54 98.23 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-N 115.047 -0.978 . . . . 0.0 110.247 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -63.31 -45.12 92.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.412 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -62.9 -44.96 94.68 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.847 -175.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.515 ' CD1' HD13 ' A' ' 70' ' ' LEU . 46.0 pt -70.31 -37.01 69.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 119.875 -0.73 . . . . 0.0 109.74 176.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.613 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 35.9 tt0 -62.19 -53.4 55.8 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 123.017 0.527 . . . . 0.0 111.223 -178.287 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.47 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.1 pp -59.45 -33.69 71.59 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.47 ' N ' HD12 ' A' ' 33' ' ' LEU . 14.9 t70 -71.04 -47.89 55.94 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.3 tp -65.56 -23.78 66.94 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.429 0.692 . . . . 0.0 112.266 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.613 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 20.3 mtm180 -71.02 -33.12 70.05 Favored 'General case' 0 C--N 1.314 -0.946 0 O-C-N 121.725 -0.609 . . . . 0.0 110.625 176.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -91.15 -38.25 6.04 Favored Glycine 0 C--N 1.315 -0.632 0 C-N-CA 120.571 -0.824 . . . . 0.0 111.268 177.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.8 m -94.52 -170.35 2.23 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 123.324 0.65 . . . . 0.0 110.119 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -128.17 -7.63 5.37 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -113.3 106.09 14.19 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 120.59 -0.444 . . . . 0.0 109.961 -172.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.528 ' O ' HG12 ' A' ' 45' ' ' ILE . 14.4 tt -75.05 -27.63 20.09 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.892 -176.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.522 ' HG2' ' OE1' ' A' ' 71' ' ' GLN . 42.7 mtmt -59.36 -48.67 80.75 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 177.089 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.1 m -65.21 -38.74 91.4 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.589 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.8 m -58.81 -41.09 85.96 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 120.863 0.363 . . . . 0.0 110.405 175.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.5 mm -58.77 -46.31 90.84 Favored 'Isoleucine or valine' 0 C--N 1.343 0.314 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 176.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 42' ' ' LYS . 67.6 mt -51.76 -49.61 35.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.208 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -61.14 -53.72 53.5 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.408 0.623 . . . . 0.0 110.71 -176.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 51.7 t -66.79 -42.82 89.82 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.891 -172.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -70.95 -37.63 72.82 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.44 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.533 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 36.2 t -73.47 -31.41 63.76 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.567 0.699 . . . . 0.0 109.798 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.3 t -73.54 -43.83 59.0 Favored 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.52 ' O ' HG12 ' A' ' 56' ' ' ILE . 68.9 m-70 -103.34 37.42 2.0 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 -176.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 50' ' ' SER . 80.0 mt -47.11 -41.66 17.7 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -57.46 -46.65 83.4 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.554 ' HA ' ' OE1' ' A' ' 55' ' ' GLU . 2.2 tp10 -74.58 -34.31 62.86 Favored 'General case' 0 N--CA 1.432 -1.325 0 C-N-CA 119.626 -0.83 . . . . 0.0 111.312 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 52' ' ' HIS . 47.1 mm -61.26 -45.28 98.92 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.174 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -71.76 -22.97 61.53 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.79 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.446 ' NZ ' ' HB2' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -68.53 -52.72 28.95 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.641 ' HB2' ' CE2' ' A' ' 63' ' ' TYR . 16.9 m120 -112.53 52.66 0.77 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.8 pttp -60.7 -31.55 70.82 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -66.44 -47.53 72.86 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 121.457 0.646 . . . . 0.0 109.396 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -63.12 -51.5 66.27 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 114.412 -1.267 . . . . 0.0 110.714 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.641 ' CE2' ' HB2' ' A' ' 59' ' ' ASN . 79.0 m-85 -68.99 -26.44 65.02 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -176.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -71.23 -50.72 30.0 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.146 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.441 ' HG2' ' OE1' ' A' ' 8' ' ' GLU . 73.6 mtm -66.0 -43.27 88.2 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.54 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.555 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 46.2 pt -65.93 -41.71 90.44 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.634 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.195 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.26 -39.0 71.9 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 117.893 0.315 . . . . 0.0 110.909 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -64.33 -56.6 13.33 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 177.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 95.2 mt -56.63 -44.33 80.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.446 1.099 . . . . 0.0 112.514 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.561 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 82.5 mt -54.57 -50.45 67.95 Favored 'General case' 0 C--O 1.212 -0.876 0 C-N-CA 123.531 0.732 . . . . 0.0 111.826 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.522 ' OE1' ' HG2' ' A' ' 42' ' ' LYS . 46.3 mt-30 -70.16 -45.67 66.27 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 121.984 0.897 . . . . 0.0 109.917 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 46.4 ttt85 -57.91 -45.41 86.54 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 126.62 1.968 . . . . 0.0 111.319 -176.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -94.48 -16.54 23.26 Favored 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.561 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.23 -33.91 77.12 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.054 178.601 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -68.12 -25.61 65.38 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.384 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -99.38 -47.61 5.09 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.9 pt -115.88 -20.79 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -177.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 111.15 142.43 9.01 Favored Glycine 0 CA--C 1.501 -0.795 0 N-CA-C 110.999 -0.841 . . . . 0.0 110.999 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.416 HG13 ' ND2' ' A' ' 83' ' ' ASN . 10.2 tp -62.45 -37.43 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 117.203 0.502 . . . . 0.0 111.559 -174.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -53.19 -48.09 68.34 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.858 0.837 . . . . 0.0 109.455 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.436 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 85.4 m-20 -68.0 -42.97 79.91 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 113.787 -1.551 . . . . 0.0 112.204 -178.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 78' ' ' GLY . 16.8 t -65.49 -45.8 91.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.3 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.416 ' ND2' HG13 ' A' ' 79' ' ' ILE . 94.0 m-20 -56.64 -42.81 79.52 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.435 0.636 . . . . 0.0 111.075 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -45.7 86.84 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.9 mt -63.09 -36.28 83.06 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.632 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.6 mm -64.44 -41.08 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.7 mt -62.41 -38.74 90.84 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-O 121.363 0.601 . . . . 0.0 110.558 176.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.4 m -64.91 -33.44 76.02 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.473 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 29.5 m -72.1 -31.7 66.3 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.488 0.715 . . . . 0.0 111.479 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.6 pt -92.71 -9.11 10.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.621 -178.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -99.57 128.71 45.68 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.7 mp -78.68 144.66 35.12 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 106.004 -1.85 . . . . 0.0 106.004 167.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . 0.266 8.3 tm-20 -46.73 -80.5 0.01 OUTLIER 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -172.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 61.6 m80 -143.57 1.42 1.18 Allowed 'General case' 0 N--CA 1.483 1.188 0 O-C-N 120.914 -1.116 . . . . 0.0 111.728 177.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -96.92 95.15 7.64 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 34.9 m-70 -123.21 -63.59 1.24 Allowed 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.507 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 12.7 p-80 -67.68 -29.07 68.26 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.639 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 27.8 t60 -121.56 87.86 2.83 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 172.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 . . . . . 0 C--N 1.29 -2.002 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 -178.465 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 CA--C 1.513 -0.459 0 CA-C-O 120.926 0.393 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.4 m -113.78 139.47 49.1 Favored 'General case' 0 N--CA 1.423 -1.817 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.5 tt -92.77 -2.72 10.7 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-O 122.487 1.137 . . . . 0.0 108.964 177.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 86.4 mt -72.56 9.93 0.95 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 114.784 -1.098 . . . . 0.0 112.363 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.432 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 34.1 mt-10 -77.44 -21.18 53.37 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 178.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.401 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 14.3 t70 -87.36 135.45 34.54 Favored Pre-proline 0 C--N 1.313 -1.01 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.03 -173.353 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.441 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 13.9 Cg_exo -70.82 -31.53 15.65 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.665 2.243 . . . . 0.0 113.088 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.67 -35.95 57.61 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -61.32 -42.72 99.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.434 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.73 -34.26 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 CA-C-O 121.055 0.455 . . . . 0.0 109.988 178.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 63.5 mttp -63.08 -37.02 85.54 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 174.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.5 mt -63.31 -37.33 86.82 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.115 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.465 HH11 ' HA ' ' A' ' 89' ' ' THR . 24.9 tpt180 -67.5 -35.25 78.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.362 0.601 . . . . 0.0 109.76 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -73.65 -31.01 63.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.084 178.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -74.77 -33.31 62.27 Favored 'General case' 0 C--O 1.251 1.183 0 C-N-CA 123.762 0.825 . . . . 0.0 109.004 177.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.536 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 86.9 tttt 72.97 -67.61 0.26 Allowed 'General case' 0 C--O 1.208 -1.083 0 C-N-CA 126.727 2.011 . . . . 0.0 111.617 178.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 156.6 104.92 0.22 Allowed Glycine 0 N--CA 1.427 -1.937 0 C-N-CA 120.628 -0.796 . . . . 0.0 111.654 -178.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.408 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 26.3 mtpp -112.05 21.7 15.62 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 123.103 1.43 . . . . 0.0 107.743 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 30.1 m -110.3 164.37 6.54 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 CA-C-N 112.868 -1.969 . . . . 0.0 109.444 -176.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -81.16 119.63 23.83 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 174.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CE1' HD22 ' A' ' 87' ' ' LEU . 86.2 t80 -53.25 -47.89 68.68 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.683 0.615 . . . . 0.0 111.692 -179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -59.15 -36.01 74.51 Favored 'General case' 0 CA--C 1.497 -1.09 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.173 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.599 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.2 tp -76.51 -42.62 42.68 Favored 'General case' 0 N--CA 1.419 -2.006 0 C-N-CA 119.441 -0.904 . . . . 0.0 111.248 -178.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.603 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 65.0 t -59.22 -44.71 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 118.205 0.457 . . . . 0.0 109.874 177.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 52.1 ttp -58.76 -38.03 77.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.991 177.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -72.69 -38.59 67.52 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.123 176.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.599 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.1 mm -57.25 -49.61 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 66.8 mt -63.96 -35.23 79.99 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.743 -1.117 . . . . 0.0 110.496 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.73 -44.64 63.77 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 124.139 0.976 . . . . 0.0 110.092 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.568 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 17.3 tt0 -69.7 -39.5 76.88 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.759 -177.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.432 HG21 HD13 ' A' ' 45' ' ' ILE . 41.7 pt -68.34 -37.05 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 119.832 -0.747 . . . . 0.0 109.185 176.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -58.73 -46.28 87.75 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.589 0.555 . . . . 0.0 111.086 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 30' ' ' GLU . 4.4 pp -63.88 -32.85 74.52 Favored 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -177.163 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.53 -48.74 18.41 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.364 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.42 HD13 ' HB ' ' A' ' 41' ' ' ILE . 51.8 tp -56.86 -38.63 72.97 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.748 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.5 ttp180 -63.46 97.83 0.15 Allowed 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 175.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.23 -20.07 3.59 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.254 -176.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.7 p -147.11 -159.43 1.02 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -132.98 12.69 4.31 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 173.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -90.8 63.02 5.2 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.233 -173.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.552 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.8 tt -61.71 -31.2 50.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.333 -178.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -63.21 -34.36 77.48 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.925 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.9 m -79.24 -33.86 43.22 Favored 'General case' 0 N--CA 1.419 -2.007 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.403 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 15.3 m -59.59 -41.26 89.89 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.571 176.195 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 41' ' ' ILE . 43.1 mm -53.76 -48.87 60.57 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.853 176.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 69.6 mt -53.5 -49.12 56.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.228 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.403 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 20.0 m-85 -63.63 -53.01 58.15 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.124 0.487 . . . . 0.0 110.417 -176.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.3 t -60.29 -46.03 95.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.449 -174.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -65.7 -37.54 86.74 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.06 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.0 m -72.85 -22.16 60.83 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.116 0.484 . . . . 0.0 111.092 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.1 t -90.09 -9.99 46.38 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.686 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.463 ' O ' HG12 ' A' ' 56' ' ' ILE . 87.2 m-70 -138.46 36.33 2.26 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 -178.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 80.9 mt -47.64 -38.62 15.15 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -174.107 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -53.79 -50.26 66.48 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.256 0.622 . . . . 0.0 112.275 -175.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.458 ' OE2' ' HD3' ' A' ' 58' ' ' LYS . 9.2 tp10 -73.69 -35.41 65.16 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.286 0.565 . . . . 0.0 109.654 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.5 mm -60.12 -50.0 81.9 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.301 -176.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 13.6 ptt180 -77.6 -24.73 49.6 Favored 'General case' 0 C--N 1.312 -1.041 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.533 -178.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.458 ' HD3' ' OE2' ' A' ' 55' ' ' GLU . 62.7 tttt -60.1 -43.28 95.66 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 123.204 0.601 . . . . 0.0 109.457 177.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.408 ' OD1' ' HB2' ' A' ' 18' ' ' LYS . 49.1 m-80 -126.32 57.24 1.41 Allowed 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.898 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -60.77 -28.54 68.81 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.341 -175.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -61.52 -53.25 58.87 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.39 -50.6 73.33 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.08 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.507 ' HA ' HG12 ' A' ' 66' ' ' ILE . 71.2 m-85 -68.94 -30.4 68.84 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -176.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -75.03 -37.97 61.61 Favored 'General case' 0 C--O 1.248 1.0 0 C-N-CA 119.506 -0.877 . . . . 0.0 109.101 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.6 mtm -69.49 -48.08 61.8 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.142 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.515 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.6 pt -64.11 -38.84 83.49 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.713 0 C-N-CA 119.404 -0.919 . . . . 0.0 111.573 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.531 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.28 -39.74 67.21 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.884 0.373 . . . . 0.0 110.978 178.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.1 -55.69 11.57 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.377 178.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.4 mt -58.12 -41.3 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.805 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.623 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 94.5 mt -56.44 -47.93 78.08 Favored 'General case' 0 C--O 1.213 -0.837 0 C-N-CA 122.633 0.373 . . . . 0.0 111.11 179.159 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.531 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.0 mt-30 -65.08 -50.01 67.81 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.726 0.774 . . . . 0.0 109.714 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -57.9 -52.95 63.39 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-N 114.009 -1.45 . . . . 0.0 112.076 -177.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.432 ' OH ' ' HB2' ' A' ' 5' ' ' GLU . 29.5 m-85 -83.41 -19.88 35.18 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.623 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.36 -34.41 77.24 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.509 -0.876 . . . . 0.0 109.708 175.714 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HG3' ' CE2' ' A' ' 74' ' ' TYR . 55.2 mttp -81.62 -16.76 50.46 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 174.267 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -86.84 -51.33 6.13 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.564 177.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.8 pt -121.23 -30.5 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.535 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 128.65 138.83 4.61 Favored Glycine 0 C--N 1.314 -0.676 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.237 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.5 tp -58.39 -39.34 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 122.968 0.507 . . . . 0.0 112.112 -174.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -57.9 -43.99 86.5 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.581 0.705 . . . . 0.0 110.609 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.444 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 40.4 m-80 -67.26 -46.83 72.52 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.34 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 78' ' ' GLY . 23.5 t -61.96 -47.69 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.129 -176.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.4 ' CG ' ' HB3' ' A' ' 28' ' ' LEU . 96.4 m-20 -56.86 -42.06 79.06 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 123.58 0.55 . . . . 0.0 111.339 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -47.7 79.48 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 179.092 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 88.3 mt -62.74 -29.6 70.8 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.8 mm -64.82 -42.28 94.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.401 HD22 ' CE1' ' A' ' 21' ' ' PHE . 85.4 mt -64.01 -38.67 91.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.936 178.116 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.1 m -61.53 -33.92 74.64 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.146 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.465 ' HA ' HH11 ' A' ' 13' ' ' ARG . 23.0 m -73.61 -40.17 64.03 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 120.592 0.235 . . . . 0.0 111.425 -178.227 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.536 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 42.3 pt -85.68 -42.5 16.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -99.42 -39.56 8.31 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -172.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.5 tt -84.0 120.9 26.67 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.334 1.064 . . . . 0.0 112.181 -172.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.508 ' HG3' ' H ' ' A' ' 95' ' ' HIS . 14.5 pt-20 -149.18 -145.01 0.16 Allowed 'General case' 0 C--N 1.287 -2.115 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 177.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -99.62 22.15 11.29 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 119.763 1.165 . . . . 0.0 109.989 176.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.508 ' H ' ' HG3' ' A' ' 93' ' ' GLU . 0.1 OUTLIER -66.92 -54.91 17.41 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.86 -175.589 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 37.3 p-80 -93.42 97.29 10.46 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 174.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -72.45 -14.6 61.72 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 114.064 -1.425 . . . . 0.0 110.642 -171.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -146.06 179.97 7.12 Favored 'General case' 0 C--N 1.313 -1.022 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 178.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.0 m80 . . . . . 0 C--N 1.301 -1.536 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 174.544 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.502 -0.883 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.4 m -112.42 151.88 29.32 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-O 120.943 0.402 . . . . 0.0 110.116 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.7 tt -111.31 -9.88 11.82 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 CA-C-O 121.807 0.813 . . . . 0.0 108.955 175.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 74.7 mt -69.04 -0.89 6.34 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.178 173.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -76.72 -11.78 59.89 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.633 175.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.445 ' OD2' ' HD2' ' A' ' 72' ' ' ARG . 12.1 t70 -90.54 126.8 55.04 Favored Pre-proline 0 C--O 1.245 0.838 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.761 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -68.19 -30.66 30.87 Favored 'Trans proline' 0 C--O 1.24 0.593 0 C-N-CA 122.707 2.271 . . . . 0.0 113.466 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -76.11 -38.17 57.19 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -59.29 -43.57 92.57 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.151 -1.386 . . . . 0.0 111.366 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.6 p -65.38 -34.96 73.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.606 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.428 ' HE3' ' SD ' ' A' ' 65' ' ' MET . 56.6 mtmt -66.8 -36.45 82.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.744 176.233 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.8 -39.54 94.57 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -57.95 -37.79 74.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.318 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -80.09 -24.45 40.59 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.779 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.3 m-30 -80.56 -35.73 33.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.583 0.23 . . . . 0.0 110.878 177.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.0 mttt 71.67 -0.03 3.32 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.916 1.287 . . . . 0.0 113.997 175.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 132.67 -85.27 0.29 Allowed Glycine 0 N--CA 1.437 -1.283 0 C-N-CA 120.01 -1.09 . . . . 0.0 114.556 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER 69.4 11.09 7.99 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.749 1.62 . . . . 0.0 110.219 -171.57 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.4 HG21 HG21 ' A' ' 24' ' ' VAL . 27.6 m -131.11 168.83 22.92 Favored 'Isoleucine or valine' 0 C--O 1.252 1.223 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.003 -171.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -91.68 129.93 37.57 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -51.99 -41.41 62.16 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 124.034 0.934 . . . . 0.0 111.195 177.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -67.7 -37.46 82.32 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.532 -175.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.525 ' O ' HG12 ' A' ' 27' ' ' ILE . 15.9 tp -77.19 -35.93 55.38 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.119 -176.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 88.6 t -68.88 -42.57 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.644 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 56.1 ttp -60.91 -33.61 73.4 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.931 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -70.63 -42.93 70.24 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 123.085 0.24 . . . . 0.0 110.747 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.83 -49.07 80.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.6 mt -63.76 -40.09 95.87 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.713 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -67.41 -47.39 70.39 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.148 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -62.01 -38.96 90.6 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.704 -176.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.472 ' CD1' HD13 ' A' ' 70' ' ' LEU . 35.0 pt -73.06 -38.25 55.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.705 176.01 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -58.22 -52.85 63.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 124.124 0.97 . . . . 0.0 111.029 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -63.52 -30.07 71.25 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.179 -178.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.7 -49.51 18.09 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.391 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.4 tp -67.31 -58.24 5.16 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.356 -175.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 63.54 -74.47 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.956 1.302 . . . . 0.0 110.463 -174.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -158.62 28.91 0.43 Allowed Glycine 0 N--CA 1.431 -1.671 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.5 t -83.67 -175.84 6.01 Favored 'General case' 0 C--O 1.249 1.058 0 CA-C-O 121.062 0.458 . . . . 0.0 110.201 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -100.1 -24.41 14.6 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -173.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -101.95 80.62 2.02 Favored 'General case' 0 CA--C 1.502 -0.894 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.699 -175.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.519 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.5 tt -76.83 -28.08 16.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.487 ' O ' HG13 ' A' ' 46' ' ' ILE . 63.7 pttt -61.21 -36.03 78.82 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.159 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.4 m -74.01 -35.29 64.39 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.783 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.418 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 16.7 m -63.17 -39.63 95.2 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 175.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.519 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.7 mm -57.07 -46.36 84.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.698 176.015 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 42' ' ' LYS . 69.7 mt -53.22 -47.01 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.871 -178.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.418 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 14.4 m-85 -62.35 -52.15 64.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.555 0.693 . . . . 0.0 110.233 -177.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.0 t -66.19 -42.64 91.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.904 -173.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -67.94 -34.58 76.86 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.215 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.9 m -76.36 -24.24 54.17 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.323 0.582 . . . . 0.0 111.058 178.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.3 t -79.67 -29.31 40.82 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.037 0.446 . . . . 0.0 110.488 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.482 ' O ' HG12 ' A' ' 56' ' ' ILE . 67.4 m-70 -120.76 37.64 4.24 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -175.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 87.5 mt -47.02 -51.7 16.69 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 -175.345 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.592 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 3.8 p30 -59.68 -33.02 71.04 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -73.89 -46.3 45.41 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 121.193 0.52 . . . . 0.0 110.041 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 52' ' ' HIS . 47.3 mm -56.27 -40.96 68.91 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.15 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.627 179.053 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 82.8 mtp180 -63.38 -38.73 92.3 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 177.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.592 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 50.5 mttp -63.15 -48.37 78.74 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.861 0.838 . . . . 0.0 110.532 -176.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -123.43 51.72 1.46 Allowed 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.918 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -59.7 -19.62 50.98 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.955 -1.021 . . . . 0.0 111.986 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.401 ' H ' ' HG3' ' A' ' 61' ' ' GLU . 18.8 mt-10 -61.01 -57.81 11.05 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.374 1.083 . . . . 0.0 108.094 174.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -65.87 -51.25 60.38 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.194 -1.821 . . . . 0.0 109.969 -176.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.472 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.7 m-85 -66.99 -25.95 66.57 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -175.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -83.68 -39.43 20.21 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 118.728 -1.189 . . . . 0.0 109.896 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.468 ' O ' HG13 ' A' ' 69' ' ' ILE . 73.3 mtm -64.11 -44.27 92.77 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.476 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.6 pt -62.74 -38.59 82.1 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.302 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.938 178.195 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.415 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -52.68 -45.5 66.84 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.399 0.437 . . . . 0.0 111.797 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -74.5 -36.33 63.22 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 119.922 -0.711 . . . . 0.0 112.139 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 65' ' ' MET . 80.4 mt -63.99 -46.23 94.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-O 120.627 0.251 . . . . 0.0 110.347 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.544 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 79.6 mt -54.07 -45.33 71.69 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 123.461 0.704 . . . . 0.0 110.987 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.506 ' HG2' HG23 ' A' ' 41' ' ' ILE . 48.5 mt-30 -66.65 -49.38 66.38 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.574 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.445 ' HD2' ' OD2' ' A' ' 6' ' ' ASP . 41.4 ttm180 -61.31 -45.22 95.33 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 124.48 1.112 . . . . 0.0 111.74 -177.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -88.93 -18.09 28.19 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -176.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.544 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.49 -29.4 68.82 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 173.094 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -71.9 -31.58 66.55 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.871 175.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -86.44 -52.08 5.81 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -177.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.1 pt -121.25 -27.22 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -172.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.602 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 121.85 146.66 7.4 Favored Glycine 0 CA--C 1.496 -1.124 0 C-N-CA 119.513 -1.327 . . . . 0.0 111.804 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.1 tp -61.8 -40.14 85.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -56.16 -46.35 79.34 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-O 121.825 0.821 . . . . 0.0 110.137 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.428 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 91.4 m-20 -65.03 -44.16 90.01 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 114.051 -1.431 . . . . 0.0 111.623 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.9 t -65.45 -42.79 94.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.467 -177.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -57.33 -44.97 84.71 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.264 0.554 . . . . 0.0 110.655 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.75 -43.06 94.56 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 86.7 mt -65.95 -37.34 85.78 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.1 mm -63.87 -41.06 91.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 176.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.2 mt -62.98 -39.45 94.76 Favored 'General case' 0 C--O 1.21 -1.01 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.515 175.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 50.0 m -63.82 -33.31 75.4 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.65 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 41.2 m -70.49 -37.71 74.24 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.336 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.5 pt -88.61 -29.22 5.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 C-N-CA 119.884 -0.726 . . . . 0.0 111.597 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.416 ' HD2' ' HA ' ' A' ' 91' ' ' LYS . 46.0 tptt -93.01 85.33 5.08 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-O 121.982 0.896 . . . . 0.0 110.378 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 73.0 mt -101.78 165.16 11.35 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.34 -178.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.11 104.91 17.25 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -70.89 -22.91 62.21 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.132 -170.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -82.93 -22.91 33.7 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 21.2 m80 61.66 50.76 4.26 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 114.886 -1.052 . . . . 0.0 112.795 -178.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -77.4 -18.71 57.05 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 172.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 31.8 p-80 -147.72 147.58 30.08 Favored 'General case' 0 N--CA 1.432 -1.331 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 172.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 63.4 t-80 . . . . . 0 C--N 1.29 -2.009 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.933 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.508 -0.667 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m -119.12 136.78 53.99 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.019 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.49 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 19.7 tt -129.08 -14.66 2.41 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-O 121.486 0.66 . . . . 0.0 110.442 177.167 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.9 mt -74.98 6.11 4.46 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.468 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.14 -21.3 59.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.452 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.8 t70 -89.36 123.8 66.05 Favored Pre-proline 0 N--CA 1.44 -0.97 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.652 -174.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 7.9 Cg_exo -69.84 -29.12 23.97 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.547 2.164 . . . . 0.0 113.131 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.471 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 20.0 mm-40 -75.38 -31.34 60.43 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -178.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -62.73 -40.75 98.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.902 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -71.28 -34.35 53.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.05 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -61.75 -36.07 79.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.037 173.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 95.5 mt -60.69 -35.84 77.29 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.602 176.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 mmt85 -65.04 -29.36 70.25 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.163 0.506 . . . . 0.0 110.318 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -76.25 -36.62 58.41 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.515 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -79.0 -35.73 42.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.692 0.282 . . . . 0.0 111.43 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 48.5 mmtt 74.34 -82.83 0.03 OUTLIER 'General case' 0 C--O 1.206 -1.225 0 C-N-CA 124.766 1.227 . . . . 0.0 110.645 -171.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.5 -74.33 0.02 OUTLIER Glycine 0 N--CA 1.427 -1.922 0 C-N-CA 118.931 -1.604 . . . . 0.0 113.036 -178.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp 68.12 6.11 5.04 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.54 1.136 . . . . 0.0 111.235 -175.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.6 m -125.09 167.73 18.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.307 0 C-N-CA 125.206 1.403 . . . . 0.0 107.981 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -74.72 121.81 22.28 Favored 'General case' 0 CA--C 1.499 -0.995 0 C-N-CA 119.881 -0.728 . . . . 0.0 109.522 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -55.48 -41.54 73.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -56.68 -42.13 78.52 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.79 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.601 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.6 tp -75.64 -43.1 49.51 Favored 'General case' 0 N--CA 1.417 -2.119 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.658 -175.431 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.0 t -63.82 -38.97 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.2 ttp -59.81 -35.04 73.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.989 176.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -75.83 -41.7 51.85 Favored 'General case' 0 C--O 1.197 -1.667 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.449 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.601 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.5 mm -55.97 -51.2 63.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 121.456 0.646 . . . . 0.0 109.73 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 76.2 mt -64.69 -34.14 77.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.878 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -72.45 -44.87 61.76 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 122.024 0.916 . . . . 0.0 109.979 -179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -65.62 -37.84 87.73 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.893 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.403 HG21 HD13 ' A' ' 45' ' ' ILE . 33.7 pt -72.07 -37.87 61.6 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.852 176.042 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.442 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 37.8 tt0 -61.5 -52.53 64.13 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 124.165 0.986 . . . . 0.0 110.908 -178.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.19 -30.9 71.95 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 116.322 -0.399 . . . . 0.0 112.06 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -75.43 -46.54 32.12 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.971 0.415 . . . . 0.0 110.231 178.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.497 HD21 ' CE1' ' A' ' 74' ' ' TYR . 58.7 tp -63.11 -23.5 67.47 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.889 -178.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.442 ' HG2' ' O ' ' A' ' 32' ' ' GLU . 27.0 mmm180 -66.12 97.99 0.42 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-O 121.711 0.767 . . . . 0.0 109.016 174.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 152.96 -96.77 0.17 Allowed Glycine 0 N--CA 1.401 -3.698 0 N-CA-C 108.503 -1.839 . . . . 0.0 108.503 -174.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 36.3 p 169.24 107.99 0.01 OUTLIER 'General case' 0 C--O 1.239 0.548 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -174.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -168.55 -79.53 0.02 OUTLIER 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 167.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -177.97 143.8 0.33 Allowed 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.582 ' O ' HG12 ' A' ' 45' ' ' ILE . 14.8 tt -65.57 -29.66 47.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.073 0 O-C-N 123.157 0.286 . . . . 0.0 110.454 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.492 ' O ' HG13 ' A' ' 46' ' ' ILE . 49.7 mtpt -55.31 -50.09 70.49 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-O 121.688 0.756 . . . . 0.0 110.008 174.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.0 m -59.05 -47.12 86.39 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 113.707 -1.588 . . . . 0.0 110.279 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 23.1 m -58.34 -39.55 79.77 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 123.771 0.669 . . . . 0.0 111.077 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.3 mm -58.2 -42.54 83.66 Favored 'Isoleucine or valine' 0 C--N 1.344 0.326 0 C-N-CA 123.145 0.578 . . . . 0.0 109.812 176.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 42' ' ' LYS . 63.9 mt -59.36 -47.45 90.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.59 -175.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -61.79 -50.79 70.92 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 121.671 0.748 . . . . 0.0 109.462 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.52 -47.22 93.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.573 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -64.99 -39.57 93.66 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.837 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.9 m -70.17 -27.57 64.64 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.135 0.493 . . . . 0.0 111.457 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -82.34 -32.11 29.52 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.306 0.574 . . . . 0.0 110.42 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.548 ' O ' HG12 ' A' ' 56' ' ' ILE . 90.0 m-70 -114.97 35.52 4.28 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.447 -174.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.6 mt -47.35 -39.0 14.01 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.65 1.18 . . . . 0.0 113.734 -177.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.516 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 12.3 t70 -54.17 -50.85 66.07 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -73.79 -38.08 64.75 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.624 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.548 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.8 mm -56.5 -52.14 56.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.668 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.949 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.06 -36.8 82.84 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -176.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 33.4 mtmm -71.78 -24.79 61.81 Favored 'General case' 0 CA--C 1.51 -0.572 0 C-N-CA 119.921 -0.712 . . . . 0.0 111.277 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -130.24 49.71 2.26 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -178.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.464 ' HD3' ' H ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -57.54 -31.07 65.73 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.58 -1.191 . . . . 0.0 112.773 -177.782 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.67 -50.23 67.84 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -59.84 -50.77 72.48 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.501 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.486 ' HA ' HG12 ' A' ' 66' ' ' ILE . 69.6 m-85 -69.7 -25.6 63.95 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -177.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -75.73 -44.63 40.91 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 176.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.1 mtm -61.13 -50.83 71.61 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.33 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.597 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.6 pt -64.43 -38.73 83.34 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.746 0 C-N-CA 119.47 -0.892 . . . . 0.0 111.801 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.457 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -59.31 -41.02 88.04 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 117.927 0.331 . . . . 0.0 110.642 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.28 -55.32 29.47 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 89.8 mt -58.03 -42.4 82.71 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 CA-C-N 115.212 -0.903 . . . . 0.0 111.929 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.4 mt -54.55 -47.87 72.69 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 122.812 0.445 . . . . 0.0 111.284 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 64.5 mt-30 -69.73 -47.95 61.24 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.74 0.781 . . . . 0.0 109.557 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -59.47 -43.06 93.31 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 113.989 -1.459 . . . . 0.0 110.782 -176.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.49 ' CE2' ' HA ' ' A' ' 3' ' ' ILE . 40.0 m-85 -93.68 -15.5 25.22 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -177.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.497 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.75 -29.71 69.0 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 174.291 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -77.61 -28.33 51.49 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.75 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.404 ' HD2' ' CE2' ' A' ' 73' ' ' TYR . 41.1 ttmt -87.1 -51.64 5.88 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.256 -0.577 . . . . 0.0 111.486 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.3 pt -119.52 -26.71 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -173.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.535 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 117.04 148.17 8.77 Favored Glycine 0 C--N 1.307 -1.057 0 C-N-CA 120.298 -0.953 . . . . 0.0 110.996 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.8 tp -64.87 -37.87 81.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 117.029 0.414 . . . . 0.0 111.999 -174.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -55.92 -42.84 76.7 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 122.125 0.965 . . . . 0.0 110.148 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.484 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 48.6 m-80 -67.05 -50.06 63.15 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.145 -1.388 . . . . 0.0 111.324 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.3 t -61.67 -39.55 83.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -177.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -51.05 -50.39 58.74 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.868 1.267 . . . . 0.0 110.129 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.11 -40.58 71.4 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.062 -177.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.7 mt -64.9 -34.8 79.25 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.125 -178.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.8 mm -68.38 -41.96 83.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.5 mt -62.11 -40.73 96.88 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.137 0.494 . . . . 0.0 110.889 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 48.9 m -63.96 -33.38 75.6 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.786 177.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.4 m -74.19 -48.26 30.24 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.989 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.527 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 39.4 pt -74.02 -32.51 33.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -176.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.49 ' HG3' ' H ' ' A' ' 92' ' ' LEU . 20.7 tptp -104.75 -147.9 0.4 Allowed 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.49 ' H ' ' HG3' ' A' ' 91' ' ' LYS . 18.9 tp 58.76 69.32 0.74 Allowed 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.042 0.937 . . . . 0.0 110.218 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -96.21 124.35 40.18 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.805 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -137.19 165.07 26.98 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.817 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 75.8 m-70 69.17 -170.21 0.18 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.515 1.126 . . . . 0.0 108.207 -176.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 -70.77 -61.38 1.79 Allowed 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 119.319 -0.952 . . . . 0.0 108.79 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 53.3 t60 34.09 62.58 0.45 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 126.361 1.864 . . . . 0.0 113.479 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -156.57 138.53 14.42 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.217 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 . . . . . 0 C--N 1.31 -1.151 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 175.525 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.357 0 CA-C-O 120.942 0.401 . . . . 0.0 110.515 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.5 m -168.36 149.34 4.9 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 178.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.5 pt -76.08 81.9 0.65 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.412 0 CA-C-O 122.265 1.031 . . . . 0.0 111.253 176.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.9 mt -87.4 11.99 13.2 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 114.792 -1.094 . . . . 0.0 110.997 -176.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -71.41 -11.45 60.89 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.2 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 15.0 t70 -111.59 130.95 22.6 Favored Pre-proline 0 N--CA 1.448 -0.562 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.745 -176.031 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.518 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 17.3 Cg_exo -69.76 -28.26 25.48 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.947 2.432 . . . . 0.0 113.9 177.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -75.16 -33.27 61.48 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -60.17 -44.57 94.92 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.484 -1.234 . . . . 0.0 110.552 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -66.78 -34.09 67.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.235 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.2 mttt -62.77 -37.2 85.7 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.217 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.38 -38.17 88.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.151 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.6 mtp180 -72.4 -25.43 61.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.31 0.576 . . . . 0.0 110.339 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -80.51 -20.73 42.91 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.212 174.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -83.81 -49.02 9.46 Favored 'General case' 0 C--O 1.246 0.907 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 91.3 mttt 72.44 -171.52 0.14 Allowed 'General case' 0 C--O 1.242 0.698 0 C-N-CA 125.35 1.46 . . . . 0.0 113.274 175.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.4 77.8 1.68 Allowed Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 114.718 0.647 . . . . 0.0 114.718 -171.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -97.23 5.95 49.22 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 122.706 1.241 . . . . 0.0 108.333 172.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 29.7 m -117.4 158.32 18.12 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 CA-C-N 113.275 -1.784 . . . . 0.0 107.939 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -74.92 121.85 22.54 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.316 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -53.43 -50.62 64.83 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.681 0.613 . . . . 0.0 111.658 -178.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -64.61 -29.54 70.55 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.359 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.617 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.2 tp -75.93 -39.6 55.85 Favored 'General case' 0 N--CA 1.425 -1.703 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.054 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 62.8 t -63.36 -43.21 98.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 175.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 60.7 ttp -57.94 -39.34 77.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.667 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.736 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 58.9 tt0 -67.63 -45.42 75.44 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.736 176.016 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.617 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.6 mm -55.93 -44.8 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 CA-C-O 121.403 0.621 . . . . 0.0 110.047 -179.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 68.5 mt -68.65 -33.87 74.74 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.7 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -71.63 -43.6 65.87 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.197 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.736 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.7 mm-40 -53.66 -53.99 44.19 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.664 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.461 HG21 HD13 ' A' ' 45' ' ' ILE . 31.7 pt -67.59 -34.28 67.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.37 -177.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -63.23 -51.46 66.17 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.317 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.423 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.4 pp -72.19 -30.29 64.81 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.462 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.423 ' N ' HD12 ' A' ' 33' ' ' LEU . 15.6 t70 -75.11 -45.43 41.18 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.245 -178.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.2 tt -69.45 -61.52 1.75 Allowed 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -176.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 55.04 -85.65 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.909 0 O-C-N 123.727 0.642 . . . . 0.0 109.398 -170.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -155.31 32.3 0.65 Allowed Glycine 0 N--CA 1.433 -1.531 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 174.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 51.0 p -87.03 -87.25 0.14 Allowed 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -175.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -101.42 -72.93 0.67 Allowed 'General case' 0 CA--C 1.512 -0.492 0 C-N-CA 119.946 -0.701 . . . . 0.0 112.643 -174.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.581 ' OD1' ' HG2' ' A' ' 42' ' ' LYS . 7.8 t-20 -170.29 157.59 6.28 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.54 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.464 ' O ' HG12 ' A' ' 45' ' ' ILE . 13.9 tt -68.13 -37.7 78.58 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.425 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.581 ' HG2' ' OD1' ' A' ' 40' ' ' ASN . 11.2 ptmm? -65.52 -32.33 73.87 Favored 'General case' 0 CA--C 1.509 -0.624 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.535 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.4 m -66.3 -44.61 82.99 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.065 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.42 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 48.4 m -63.68 -38.36 90.83 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.339 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 41' ' ' ILE . 25.7 mm -54.68 -43.57 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.55 0.74 . . . . 0.0 110.077 175.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 42' ' ' LYS . 74.6 mt -54.6 -50.26 60.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.597 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.42 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 20.2 m-85 -62.88 -53.1 59.34 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.511 0.672 . . . . 0.0 110.321 -177.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 44' ' ' SER . 60.2 t -58.78 -44.94 91.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.667 -176.05 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -71.21 -27.37 63.45 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.9 m -80.95 -25.48 37.36 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.372 0.606 . . . . 0.0 110.372 176.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.1 t -78.07 -52.94 7.98 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.489 177.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.566 ' O ' HG12 ' A' ' 56' ' ' ILE . 86.0 m-70 -98.46 48.53 0.99 Allowed 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.316 -172.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 98.2 mt -48.59 -48.04 39.34 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -175.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 3.1 t70 -54.11 -52.04 62.26 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -174.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -72.59 -32.18 65.78 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.759 -0.776 . . . . 0.0 110.031 -176.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.566 HG12 ' O ' ' A' ' 52' ' ' HIS . 44.7 mm -63.57 -49.74 81.18 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.033 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.101 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.3 ptt-85 -69.76 -29.81 67.24 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -175.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 54' ' ' ASP . 32.5 mmtp -70.98 -34.05 71.03 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.012 0.434 . . . . 0.0 110.661 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -131.36 53.91 1.95 Allowed 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -59.65 -35.04 73.63 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.208 -176.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -64.38 -40.47 95.89 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 120.955 0.407 . . . . 0.0 110.925 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -65.61 -50.13 66.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.382 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.557 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.3 m-85 -68.88 -34.26 75.14 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -177.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.61 -45.09 76.45 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.274 177.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.6 mtm -65.69 -44.0 87.54 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.998 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.596 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 45.0 pt -66.04 -39.08 83.54 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.824 0 C-N-CA 118.588 -1.245 . . . . 0.0 111.173 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.576 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.05 -40.67 73.87 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 117.99 0.359 . . . . 0.0 110.839 178.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.89 -54.15 35.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.749 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 98.1 mt -58.27 -41.47 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.289 -179.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 96.9 mt -55.97 -48.73 75.28 Favored 'General case' 0 C--O 1.216 -0.694 0 C-N-CA 122.989 0.516 . . . . 0.0 111.506 178.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 57.3 mt-30 -68.37 -45.82 71.76 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.483 0.658 . . . . 0.0 109.78 -178.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 45.3 ttm180 -57.81 -49.34 76.98 Favored 'General case' 0 N--CA 1.424 -1.76 0 C-N-CA 124.71 1.204 . . . . 0.0 111.831 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.41 ' CE2' ' HD3' ' A' ' 76' ' ' LYS . 66.1 m-85 -87.86 -15.06 37.8 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 -176.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.538 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.14 -32.37 73.44 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 174.753 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.43 ' NZ ' ' HB3' ' A' ' 75' ' ' LYS . 7.2 mtpm? -81.25 -18.02 47.44 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.144 176.551 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.41 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 64.7 tttm -94.48 -47.42 6.56 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.163 -176.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.1 pt -126.55 -30.09 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.583 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 123.77 142.89 6.13 Favored Glycine 0 CA--C 1.499 -0.908 0 C-N-CA 120.238 -0.982 . . . . 0.0 112.043 177.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.3 tp -62.03 -33.64 59.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 117.018 0.409 . . . . 0.0 111.372 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.45 ' H ' ' CD ' ' A' ' 80' ' ' GLU . 2.3 mp0 -53.59 -49.47 67.7 Favored 'General case' 0 C--O 1.248 0.979 0 CA-C-O 122.376 1.084 . . . . 0.0 109.156 177.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -68.47 -46.98 68.27 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 113.795 -1.548 . . . . 0.0 110.756 -177.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.3 t -62.99 -38.24 81.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.737 -177.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -52.92 -50.34 64.16 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.673 0.749 . . . . 0.0 109.429 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -39.33 73.71 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.234 -178.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.444 ' O ' ' HB ' ' A' ' 88' ' ' THR . 87.0 mt -68.12 -32.77 73.29 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -178.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 82' ' ' VAL . 43.7 mm -67.12 -37.69 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 CA-C-O 121.777 0.799 . . . . 0.0 108.983 175.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.36 -38.68 88.16 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.135 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 85' ' ' LEU . 90.5 m -61.3 -34.47 75.27 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.973 0.909 . . . . 0.0 110.562 175.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 28.7 m -57.32 -49.97 74.43 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.955 0.902 . . . . 0.0 110.47 -177.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.402 HG13 ' N ' ' A' ' 91' ' ' LYS . 39.5 pt -89.65 -40.76 13.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.985 -176.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.402 ' N ' HG13 ' A' ' 90' ' ' ILE . 84.7 tttt -75.09 -29.25 60.59 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -171.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.3 mt -89.57 34.55 0.82 Allowed 'General case' 0 C--O 1.24 0.557 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.984 178.123 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -65.93 -68.59 0.36 Allowed 'General case' 0 C--O 1.243 0.711 0 N-CA-C 104.266 -2.494 . . . . 0.0 104.266 171.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 41.4 t60 57.56 -62.41 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.787 2.035 . . . . 0.0 115.224 170.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -83.5 87.04 7.0 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -75.1 98.0 3.58 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 113.926 -1.488 . . . . 0.0 112.116 -168.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -86.55 99.02 11.4 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 176.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 43.2 t60 68.34 -65.34 0.27 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.368 1.467 . . . . 0.0 111.703 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 81.0 t60 . . . . . 0 C--N 1.297 -1.702 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.727 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.501 -0.909 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.436 ' O ' HG22 ' A' ' 3' ' ' ILE . 22.8 t -144.73 142.3 29.93 Favored 'General case' 0 N--CA 1.422 -1.863 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 175.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.436 HG22 ' O ' ' A' ' 2' ' ' SER 0.3 14.0 tt 69.2 -32.45 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 C-N-CA 127.424 2.29 . . . . 0.0 113.276 178.462 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.4 mt -73.41 5.06 4.0 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.917 0.865 . . . . 0.0 109.976 175.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.408 ' H ' ' C ' ' A' ' 3' ' ' ILE . 21.0 mt-10 -83.78 -6.15 59.36 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 125.878 1.671 . . . . 0.0 108.312 178.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.486 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 14.3 t70 -103.06 126.93 30.98 Favored Pre-proline 0 N--CA 1.441 -0.923 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.92 -178.169 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.498 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 5.5 Cg_exo -71.58 -25.62 20.76 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.59 2.193 . . . . 0.0 113.426 -178.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -76.84 -40.13 48.83 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -59.49 -41.54 90.07 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.085 178.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 7' ' ' PRO . 7.8 p -66.09 -34.55 70.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-O 121.347 0.594 . . . . 0.0 110.043 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 64.4 mttp -65.04 -35.48 81.29 Favored 'General case' 0 C--O 1.217 -0.655 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 176.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.69 -42.47 98.97 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.537 ' HG2' HG23 ' A' ' 89' ' ' THR . 38.0 mtm180 -66.79 -30.2 70.34 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 121.724 0.774 . . . . 0.0 110.027 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -78.8 -32.02 46.21 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.621 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -77.11 -48.19 18.41 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 123.856 0.862 . . . . 0.0 110.51 -176.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 58.3 mttp 71.29 177.24 0.27 Allowed 'General case' 0 C--O 1.242 0.691 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 179.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -104.89 104.57 2.39 Favored Glycine 0 N--CA 1.418 -2.545 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.906 -173.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.82 38.3 1.12 Allowed 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 174.478 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 9.2 m -130.62 167.28 26.12 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.782 0 CA-C-N 112.498 -2.137 . . . . 0.0 108.192 -176.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -75.79 125.38 28.96 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -56.04 -36.12 67.66 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 123.521 0.513 . . . . 0.0 110.916 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -73.49 -31.55 63.79 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.045 -177.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.609 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.5 tp -76.61 -39.69 51.68 Favored 'General case' 0 N--CA 1.42 -1.927 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.217 -177.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.502 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 60.3 t -64.26 -44.4 97.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 176.013 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 14.9 tmm? -58.85 -32.4 69.4 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.465 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.685 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 63.8 tt0 -74.49 -42.13 59.5 Favored 'General case' 0 C--O 1.192 -1.933 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.483 176.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.609 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.2 mm -56.24 -44.51 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 CA-C-O 121.672 0.749 . . . . 0.0 109.255 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 69.9 mt -67.33 -31.34 71.55 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.668 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -72.4 -48.61 40.05 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.014 0.926 . . . . 0.0 110.115 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.685 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.2 mm-40 -53.79 -53.85 46.6 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.414 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.6 pt -66.77 -38.53 81.7 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.546 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.224 -177.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -58.71 -49.21 78.42 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.269 0.628 . . . . 0.0 111.494 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -71.38 -32.66 68.74 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -75.52 -36.99 60.38 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.8 0.81 . . . . 0.0 109.653 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.413 HD21 ' CD1' ' A' ' 74' ' ' TYR . 46.0 tp -65.81 -37.94 87.62 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.265 177.355 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -73.55 -15.32 61.3 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.123 0.487 . . . . 0.0 111.166 173.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -70.49 -20.4 77.01 Favored Glycine 0 C--O 1.219 -0.796 0 N-CA-C 108.895 -1.682 . . . . 0.0 108.895 171.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.6 m 76.1 90.38 0.08 Allowed 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 171.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -141.2 -83.73 0.21 Allowed 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 169.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.538 ' HB2' ' OG1' ' A' ' 43' ' ' THR . 43.9 m-80 -158.4 137.98 11.88 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 177.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.549 ' O ' HG12 ' A' ' 45' ' ' ILE . 12.0 tt -64.38 -32.47 57.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 118.065 0.393 . . . . 0.0 110.812 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.468 ' HG2' ' HB3' ' A' ' 40' ' ' ASN . 22.5 pttp -61.86 -33.6 74.47 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.324 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.538 ' OG1' ' HB2' ' A' ' 40' ' ' ASN . 8.5 m -72.2 -43.1 65.0 Favored 'General case' 0 C--O 1.25 1.119 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.5 m -58.58 -41.92 86.83 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.125 178.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 41' ' ' ILE . 37.0 mm -52.55 -46.69 48.76 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.388 177.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 42' ' ' LYS . 64.7 mt -56.05 -50.52 69.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.448 -176.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -58.18 -53.01 63.11 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.895 0.855 . . . . 0.0 109.9 -176.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.414 HG22 ' HB3' ' A' ' 30' ' ' GLU . 40.9 t -62.06 -47.56 92.58 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.712 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.718 -176.017 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -68.17 -35.93 78.81 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.665 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.1 t -77.4 -24.92 50.41 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.311 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.6 t -86.8 -19.47 28.98 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.16 0.505 . . . . 0.0 111.048 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.487 ' O ' HG12 ' A' ' 56' ' ' ILE . 76.7 m-70 -124.46 36.85 4.53 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 -177.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.496 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 82.9 mt -47.21 -41.8 18.94 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -174.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -53.66 -50.07 66.59 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -175.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.567 ' OE1' ' HD3' ' A' ' 58' ' ' LYS . 3.7 tp10 -72.99 -36.04 66.97 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.4 mm -63.21 -50.62 78.34 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.141 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.566 -177.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 6.9 ptm180 -70.49 -25.83 63.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.921 0.391 . . . . 0.0 111.762 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.567 ' HD3' ' OE1' ' A' ' 55' ' ' GLU . 78.7 tttt -65.33 -42.96 92.38 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 123.604 0.761 . . . . 0.0 109.984 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -127.22 58.79 1.44 Allowed 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 177.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.457 ' HG3' ' OE2' ' A' ' 61' ' ' GLU . 14.1 ptmm? -60.32 -32.32 71.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.828 -175.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.457 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 3.4 mp0 -65.57 -41.87 92.42 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.873 0.368 . . . . 0.0 110.213 177.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -64.01 -51.74 62.83 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.692 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.512 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.9 m-85 -67.01 -34.08 76.96 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -177.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -66.22 -45.36 80.96 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.585 177.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.8 mtm -66.22 -44.5 83.65 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.872 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.514 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 45.3 pt -67.37 -40.53 84.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.682 0 C-N-CA 118.939 -1.104 . . . . 0.0 112.348 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.92 -35.35 68.92 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 118.482 0.583 . . . . 0.0 110.876 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -67.09 -54.93 16.74 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.083 177.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.4 mt -62.7 -39.55 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.235 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 96.9 mt -54.55 -49.2 70.87 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.009 0.524 . . . . 0.0 111.433 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.507 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 55.1 mt-30 -65.17 -45.4 85.07 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.677 0.751 . . . . 0.0 109.646 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -57.57 -42.72 83.65 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 125.805 1.642 . . . . 0.0 112.07 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.43 ' CE2' ' HA ' ' A' ' 3' ' ' ILE . 64.3 m-85 -97.21 -15.83 20.68 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -178.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.414 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.24 -34.42 77.41 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 118.881 0.764 . . . . 0.0 109.567 177.634 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -79.08 -17.68 54.74 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.533 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -99.83 -51.37 3.74 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.285 -172.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.3 pt -119.31 -20.71 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.573 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 117.32 140.25 6.58 Favored Glycine 0 C--N 1.308 -0.988 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.6 tp -64.72 -37.89 81.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.908 0.354 . . . . 0.0 111.922 -173.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.72 -45.28 82.0 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 122.021 0.915 . . . . 0.0 109.722 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.462 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 79.8 m-20 -61.55 -48.62 80.16 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 113.953 -1.476 . . . . 0.0 111.112 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.6 t -62.34 -44.77 99.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 O-C-N 123.59 0.556 . . . . 0.0 110.441 -177.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -55.1 -47.2 75.28 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.157 0.504 . . . . 0.0 111.973 -178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -40.24 86.69 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 99.0 mt -65.01 -36.92 85.93 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.665 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.3 mm -63.73 -40.25 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 121.136 0.493 . . . . 0.0 109.917 176.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 92.2 mt -65.2 -37.1 86.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.92 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 58.3 m -67.16 -33.62 75.81 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.81 0.814 . . . . 0.0 109.898 176.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.537 HG23 ' HG2' ' A' ' 13' ' ' ARG . 87.6 m -66.59 -44.54 81.88 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.927 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 41.6 pt -83.04 -34.02 10.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -176.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -92.76 120.35 33.05 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -176.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 46.8 tp -80.08 67.64 5.95 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 122.4 1.095 . . . . 0.0 110.311 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -159.63 152.49 21.69 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 102.441 -3.17 . . . . 0.0 102.441 178.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -161.38 -68.07 0.06 Allowed 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 118.977 0.808 . . . . 0.0 109.782 -175.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 46.2 t60 -80.54 98.24 7.52 Favored 'General case' 0 N--CA 1.426 -1.632 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -74.41 105.75 5.7 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.502 -173.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -147.12 77.1 1.44 Allowed 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 35.7 t-80 -99.32 -26.28 14.21 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 165.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 33.6 t-80 . . . . . 0 N--CA 1.405 -2.711 0 N-CA-C 103.202 -2.888 . . . . 0.0 103.202 176.679 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.8 ptp . . . . . 0 CA--C 1.497 -1.062 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.466 ' HB3' ' OE1' ' A' ' 5' ' ' GLU . 45.3 m 64.76 89.48 0.09 Allowed 'General case' 0 CA--C 1.533 0.303 0 O-C-N 124.6 1.188 . . . . 0.0 112.492 177.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.532 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 10.1 tp -154.58 -30.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.792 178.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.3 mt -81.82 13.97 2.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.403 0.621 . . . . 0.0 111.112 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.466 ' OE1' ' HB3' ' A' ' 2' ' ' SER . 39.2 mt-10 -86.65 8.66 21.45 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 123.328 0.651 . . . . 0.0 109.603 178.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.416 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.9 t70 -126.56 129.39 24.12 Favored Pre-proline 0 N--CA 1.441 -0.887 0 C-N-CA 120.411 -0.516 . . . . 0.0 111.491 -174.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 4.0 Cg_exo -72.04 -28.67 15.76 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.608 2.206 . . . . 0.0 112.813 -178.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.415 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 18.0 mm-40 -75.03 -35.69 61.93 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -61.03 -47.47 86.26 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.238 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.5 p -63.37 -34.67 68.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.472 0.653 . . . . 0.0 110.908 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -71.01 -31.82 68.44 Favored 'General case' 0 C--O 1.198 -1.61 0 O-C-N 121.951 -0.468 . . . . 0.0 112.245 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 94.0 mt -62.5 -36.79 83.67 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.277 0.56 . . . . 0.0 110.509 176.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -62.03 -38.82 90.14 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.697 177.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -80.17 -33.52 38.28 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.336 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -62.62 -43.54 98.55 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 124.589 1.155 . . . . 0.0 108.359 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.2 tttt 59.26 69.73 0.7 Allowed 'General case' 0 C--O 1.247 0.923 0 C-N-CA 125.234 1.414 . . . . 0.0 113.228 175.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 74.81 -94.94 0.89 Allowed Glycine 0 N--CA 1.437 -1.299 0 CA-C-N 114.527 -1.215 . . . . 0.0 114.832 173.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp 60.0 17.0 6.28 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.172 1.389 . . . . 0.0 111.395 -172.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.4 m -131.48 168.93 22.77 Favored 'Isoleucine or valine' 0 C--O 1.256 1.43 0 C-N-CA 124.523 1.129 . . . . 0.0 108.649 -177.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.428 ' O ' HG23 ' A' ' 24' ' ' VAL . 45.7 t-20 -81.33 117.87 22.17 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 174.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -58.31 -32.52 68.54 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 123.321 0.388 . . . . 0.0 111.09 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -66.74 -41.73 87.36 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.03 -174.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.586 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.1 tp -77.02 -38.7 52.43 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.234 -176.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 20' ' ' ASN . 56.6 t -59.86 -41.88 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 CA-C-O 121.088 0.471 . . . . 0.0 110.094 178.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 15.9 tmm? -57.92 -40.9 81.54 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.071 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -74.76 -36.26 62.58 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.005 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.5 mm -56.61 -47.12 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 81.0 mt -65.1 -41.16 95.23 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.332 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -64.56 -47.3 79.27 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.755 0.788 . . . . 0.0 110.655 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -59.57 -45.37 92.04 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.322 -177.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.416 ' CD1' HD13 ' A' ' 70' ' ' LEU . 35.4 pt -71.71 -39.67 69.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.376 178.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -54.69 -51.6 65.02 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.501 1.12 . . . . 0.0 111.347 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.38 -28.86 67.48 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -76.03 -49.94 16.19 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.746 0.784 . . . . 0.0 110.225 177.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.1 tp -62.03 -59.94 4.34 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.581 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 59.22 -83.27 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.382 1.073 . . . . 0.0 111.189 -175.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.29 20.04 2.63 Favored Glycine 0 N--CA 1.441 -0.984 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.3 m -80.1 174.61 11.42 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.566 ' HA ' ' OH ' ' A' ' 74' ' ' TYR . 6.6 p-10 -105.66 -14.64 15.2 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 121.821 -0.549 . . . . 0.0 111.62 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -85.28 53.07 2.62 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.515 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.5 tt -62.47 -34.81 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-O 121.29 0.567 . . . . 0.0 110.358 178.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.53 ' O ' HG13 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.18 -28.19 68.95 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.967 177.019 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.4 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 11.9 m -79.01 -37.58 38.8 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.46 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 16.1 m -59.96 -40.71 89.97 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 41' ' ' ILE . 44.2 mm -55.64 -49.72 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.245 175.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 42' ' ' LYS . 78.1 mt -53.59 -49.02 58.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.369 -177.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.46 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 22.9 m-85 -60.03 -52.83 63.72 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.734 0.778 . . . . 0.0 110.141 -177.053 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.6 t -63.83 -43.76 97.96 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.796 -174.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -68.88 -34.38 75.34 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.358 -179.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.6 m -75.99 -21.51 56.85 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.194 0.521 . . . . 0.0 110.978 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 37.5 t -86.09 -41.12 15.04 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.009 0.433 . . . . 0.0 110.701 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.515 ' O ' HG12 ' A' ' 56' ' ' ILE . 84.1 m-70 -107.22 43.31 1.19 Allowed 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -176.134 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 81.0 mt -47.01 -41.93 17.28 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -175.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.669 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 34.0 t70 -58.93 -50.39 74.22 Favored 'General case' 0 C--O 1.209 -1.039 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -172.023 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -72.0 -28.41 63.38 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.998 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.7 mm -64.92 -45.04 95.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 0.5 OUTLIER -73.67 -25.2 60.14 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.428 178.513 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.669 ' HG2' ' O ' ' A' ' 54' ' ' ASP . 74.2 mmtt -65.37 -51.39 60.79 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 176.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -123.34 65.62 1.0 Allowed 'General case' 0 CA--C 1.496 -1.121 0 CA-C-O 121.433 0.635 . . . . 0.0 111.655 -178.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.432 ' HD3' ' H ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -66.93 -17.3 64.84 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.174 179.552 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.3 mp0 -64.71 -58.19 6.96 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 173.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -60.08 -49.7 76.6 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.122 -1.399 . . . . 0.0 111.014 -176.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.458 ' HA ' HG12 ' A' ' 66' ' ' ILE . 75.1 m-85 -67.68 -30.26 69.74 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -176.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -73.87 -41.47 62.14 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 119.452 -0.899 . . . . 0.0 109.825 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 84.8 mtp -63.72 -49.24 73.86 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.162 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.9 pt -66.2 -38.6 82.29 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.316 0 C-N-CA 119.729 -0.789 . . . . 0.0 111.741 -179.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.515 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -55.62 -39.7 71.15 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.616 0.246 . . . . 0.0 111.147 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -67.85 -51.7 45.28 Favored 'General case' 0 C--O 1.251 1.155 0 CA-C-O 121.598 0.713 . . . . 0.0 109.694 178.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.3 mt -57.84 -45.01 87.36 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.317 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.567 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 85.4 mt -55.22 -46.37 75.95 Favored 'General case' 0 C--O 1.212 -0.874 0 C-N-CA 123.173 0.589 . . . . 0.0 110.97 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 75.5 mt-30 -61.53 -52.12 65.76 Favored 'General case' 0 C--O 1.256 1.418 0 CA-C-O 121.372 0.606 . . . . 0.0 110.363 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -57.7 -54.74 43.43 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.631 -176.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.532 ' CE2' ' HA ' ' A' ' 3' ' ' ILE . 88.5 m-85 -82.65 -16.36 48.56 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -173.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.567 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -63.79 -39.06 93.33 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 176.16 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -81.32 -37.05 28.97 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.422 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -72.21 -50.63 26.07 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.991 -176.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.8 pt -118.69 -29.99 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -178.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.583 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 129.67 136.02 4.0 Favored Glycine 0 C--N 1.31 -0.878 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.458 ' HB ' ' HB2' ' A' ' 74' ' ' TYR . 9.0 tp -60.01 -38.78 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 CA-C-N 117.298 0.549 . . . . 0.0 111.978 -174.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.94 -45.99 82.38 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.274 0.559 . . . . 0.0 110.197 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.45 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 94.4 m-20 -62.65 -45.92 90.61 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.962 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.5 t -63.41 -47.78 90.22 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.576 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -55.12 -45.54 75.55 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.346 0.593 . . . . 0.0 110.881 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.29 -44.48 87.83 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 115.359 -0.837 . . . . 0.0 108.866 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.2 mt -64.9 -36.24 83.72 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 82' ' ' VAL . 45.3 mm -63.09 -44.7 99.65 Favored 'Isoleucine or valine' 0 C--O 1.244 0.769 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.511 ' O ' ' HB2' ' A' ' 91' ' ' LYS . 94.2 mt -61.28 -41.56 97.16 Favored 'General case' 0 C--O 1.214 -0.794 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.303 177.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.2 m -60.37 -38.86 85.2 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.226 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.6 m -71.79 -39.6 69.8 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.281 -176.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 41.2 pt -83.78 -21.07 8.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.982 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.511 ' HB2' ' O ' ' A' ' 87' ' ' LEU . 18.8 tptm -66.02 -48.32 71.52 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 51.49 54.69 10.61 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.416 ' HB2' ' HG3' ' A' ' 91' ' ' LYS . 37.2 tt0 -110.66 123.73 50.56 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.399 -174.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -112.52 -18.82 12.32 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -123.51 -75.1 0.6 Allowed 'General case' 0 N--CA 1.442 -0.875 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -167.43 129.19 1.58 Allowed 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 125.427 1.491 . . . . 0.0 108.339 176.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -93.54 76.18 4.4 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.076 -177.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 38.6 t60 72.05 -12.76 0.65 Allowed 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 125.7 1.6 . . . . 0.0 113.044 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 1.7 m170 . . . . . 0 C--N 1.295 -1.8 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.11 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtm . . . . . 0 CA--C 1.499 -1.002 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 m -141.46 -69.55 0.37 Allowed 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.424 ' CG2' HD13 ' A' ' 85' ' ' LEU . 20.4 tt -171.12 -10.99 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.24 -175.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 73.9 mt -68.97 -11.39 60.67 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.528 0.68 . . . . 0.0 110.858 -177.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.82 -30.55 70.9 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 124.757 1.223 . . . . 0.0 109.987 173.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.481 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 22.8 t70 -78.42 132.5 65.69 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 114.017 1.118 . . . . 0.0 114.017 -171.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.49 ' O ' HG12 ' A' ' 10' ' ' VAL . 15.0 Cg_exo -70.77 -31.37 16.13 Favored 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 123.024 2.483 . . . . 0.0 113.422 177.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -75.17 -38.26 60.94 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.697 0.761 . . . . 0.0 109.021 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 67.7 t80 -63.93 -38.28 90.52 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.699 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.49 HG12 ' O ' ' A' ' 7' ' ' PRO . 4.3 p -67.29 -33.53 63.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 120.87 0.367 . . . . 0.0 110.305 178.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -58.19 -43.03 87.35 Favored 'General case' 0 C--N 1.342 0.262 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.74 -38.32 84.77 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.038 177.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.685 ' HD2' HG23 ' A' ' 89' ' ' THR . 19.8 mmm180 -60.12 -42.22 94.28 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -72.85 -38.03 67.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.023 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -63.42 -41.58 98.72 Favored 'General case' 0 C--O 1.246 0.887 0 C-N-CA 123.364 0.665 . . . . 0.0 109.406 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.528 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 0.4 OUTLIER 72.03 -84.86 0.03 OUTLIER 'General case' 0 C--O 1.204 -1.298 0 C-N-CA 124.919 1.288 . . . . 0.0 111.885 178.627 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -176.15 97.1 0.11 Allowed Glycine 0 N--CA 1.429 -1.771 0 C-N-CA 119.409 -1.376 . . . . 0.0 112.481 -176.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -105.35 26.56 9.26 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.6 m -129.28 167.96 23.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.951 -174.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 24' ' ' VAL . 55.6 t-20 -75.27 121.58 22.39 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -54.02 -39.16 65.89 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.314 0.578 . . . . 0.0 111.41 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -75.05 -33.1 61.69 Favored 'General case' 0 CA--C 1.485 -1.535 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.077 -171.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.608 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.9 tp -76.57 -36.64 57.47 Favored 'General case' 0 N--CA 1.419 -2.002 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.265 -177.047 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.421 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 61.0 t -65.02 -42.44 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.678 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 56.3 ttp -58.46 -41.2 84.65 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.325 177.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -68.86 -39.88 79.61 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.461 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.608 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.8 mm -57.06 -51.22 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 176.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.5 mt -63.04 -37.89 89.01 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.633 -179.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -66.49 -49.06 67.86 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 123.99 0.916 . . . . 0.0 110.449 179.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.3 -41.05 97.05 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.165 -175.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.401 ' CD1' HD13 ' A' ' 70' ' ' LEU . 38.7 pt -72.86 -35.16 48.61 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.587 0 C-N-CA 120.112 -0.635 . . . . 0.0 109.499 176.442 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.585 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 36.0 tt0 -60.95 -54.57 43.4 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 123.018 0.527 . . . . 0.0 110.421 -179.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.428 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.5 pp -62.24 -34.76 77.13 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.922 -178.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.428 ' N ' HD12 ' A' ' 33' ' ' LEU . 25.9 t70 -75.36 -48.55 22.5 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.914 -178.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 54.1 tp -55.62 -34.93 65.33 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.662 0.785 . . . . 0.0 112.118 -179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.585 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 37.6 mtp180 -66.6 -11.92 55.57 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 111.884 0.328 . . . . 0.0 111.884 -179.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -133.01 23.18 3.94 Favored Glycine 0 N--CA 1.441 -0.982 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.9 t -129.22 172.32 11.57 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 -178.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -95.11 -42.04 8.79 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.02 126.96 49.67 Favored 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.281 -171.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.532 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.7 tt -68.64 -31.79 52.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.265 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.498 ' O ' HG13 ' A' ' 46' ' ' ILE . 21.1 pttm -62.69 -32.9 74.07 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 119.951 -0.7 . . . . 0.0 110.794 178.006 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.0 m -69.11 -43.45 74.42 Favored 'General case' 0 N--CA 1.428 -1.526 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.321 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.488 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 25.0 m -60.4 -37.96 82.47 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.438 176.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.1 mm -55.95 -49.19 76.71 Favored 'Isoleucine or valine' 0 C--N 1.344 0.338 0 C-N-CA 123.397 0.679 . . . . 0.0 110.035 176.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 42' ' ' LYS . 75.6 mt -52.29 -47.47 45.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 C-N-CA 123.528 0.731 . . . . 0.0 112.161 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.488 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 25.9 m-85 -61.8 -53.13 60.19 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-O 121.43 0.633 . . . . 0.0 110.453 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.3 -43.6 95.04 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 CA-C-N 114.638 -1.164 . . . . 0.0 111.662 -173.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -67.31 -34.42 77.34 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.419 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 37.2 m -77.57 -21.96 51.69 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.283 0.563 . . . . 0.0 111.099 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.4 t -77.85 -49.11 14.91 Favored 'General case' 0 N--CA 1.434 -1.248 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.501 ' O ' HG12 ' A' ' 56' ' ' ILE . 79.9 m-70 -104.99 45.55 0.96 Allowed 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -175.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 50' ' ' SER . 81.1 mt -46.81 -43.75 18.65 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -175.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.419 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 7.9 t70 -53.58 -51.67 62.24 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -174.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -74.0 -32.68 63.51 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.461 -177.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 52' ' ' HIS . 41.8 mm -62.95 -35.65 72.33 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.477 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 177.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -77.66 -43.95 29.65 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.166 -179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 52.9 mtpt -60.96 -46.25 91.48 Favored 'General case' 0 CA--C 1.505 -0.771 0 C-N-CA 122.975 0.51 . . . . 0.0 110.754 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -122.34 60.33 1.0 Allowed 'General case' 0 C--N 1.302 -1.472 0 CA-C-O 121.562 0.696 . . . . 0.0 111.432 -177.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -22.94 66.13 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.762 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -63.09 -49.76 73.19 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 123.503 0.502 . . . . 0.0 109.661 175.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -63.09 -49.6 73.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.874 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.484 ' HA ' HG12 ' A' ' 66' ' ' ILE . 81.2 m-85 -68.49 -33.42 74.12 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -178.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.54 -50.04 72.93 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.164 0.507 . . . . 0.0 109.802 174.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.2 mtm -61.16 -48.88 79.55 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.364 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.556 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 46.4 pt -67.78 -39.89 82.78 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.826 -177.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.541 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.53 -39.81 68.03 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 118.348 0.522 . . . . 0.0 111.587 -178.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -63.39 -55.73 22.06 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.575 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.0 mt -60.63 -40.41 84.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.747 -176.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.584 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 93.0 mt -55.61 -50.32 70.44 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 122.929 0.492 . . . . 0.0 111.636 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.541 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 43.2 mt-30 -70.36 -46.79 63.4 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 122.297 1.046 . . . . 0.0 109.858 -176.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 72' ' ' ARG . 33.0 ttt180 -60.91 -44.55 97.02 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 113.51 -1.677 . . . . 0.0 111.43 -175.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -91.98 -15.28 28.17 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.584 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.94 -30.26 70.34 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 119.929 -0.708 . . . . 0.0 109.098 175.127 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -79.78 -17.46 53.37 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.099 176.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -97.42 -51.3 4.21 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.028 -176.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.5 pt -118.17 -25.9 2.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -176.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.534 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 120.42 143.83 6.94 Favored Glycine 0 C--N 1.308 -0.978 0 C-N-CA 120.064 -1.065 . . . . 0.0 111.213 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tp -60.68 -42.78 93.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -175.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.76 -41.84 87.53 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.554 0.692 . . . . 0.0 110.417 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.557 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 2.4 m-20 -63.07 -48.4 78.82 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.592 -1.186 . . . . 0.0 109.823 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 78' ' ' GLY . 33.9 t -62.29 -46.82 95.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.586 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -53.62 -46.7 70.54 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.203 0.525 . . . . 0.0 111.345 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -42.01 95.34 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 115.476 -0.784 . . . . 0.0 108.916 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 88.7 mt -65.44 -35.46 80.99 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.32 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 82' ' ' VAL . 49.0 mm -66.22 -45.82 89.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.56 ' O ' ' HG2' ' A' ' 91' ' ' LYS . 93.7 mt -59.53 -42.29 91.95 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.588 178.439 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 50.9 m -64.14 -33.69 76.36 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.127 0.489 . . . . 0.0 111.047 177.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.685 HG23 ' HD2' ' A' ' 13' ' ' ARG . 91.5 m -68.79 -37.44 79.28 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.779 179.133 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.528 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 39.6 pt -86.21 -5.61 10.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 87' ' ' LEU . 73.6 mmtt -62.15 103.54 0.39 Allowed 'General case' 0 C--O 1.241 0.643 0 CA-C-O 120.896 0.379 . . . . 0.0 110.97 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.2 tt -81.79 121.02 25.9 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 175.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -67.27 116.92 8.58 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.367 0.603 . . . . 0.0 110.667 -176.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -86.23 -16.27 38.22 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.639 -178.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 35.6 m80 -73.57 150.98 41.08 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 171.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -75.37 76.47 2.45 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-O 121.587 0.708 . . . . 0.0 110.832 -176.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -149.26 113.06 5.1 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.902 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -77.11 -38.04 53.0 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 105.021 -2.214 . . . . 0.0 105.021 169.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 19.3 t-80 . . . . . 0 N--CA 1.425 -1.684 0 N-CA-C 105.275 -2.12 . . . . 0.0 105.275 174.614 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.2 mmt . . . . . 0 CA--C 1.5 -0.976 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.3 m -70.0 124.65 24.6 Favored 'General case' 0 N--CA 1.437 -1.099 0 O-C-N 123.229 0.331 . . . . 0.0 111.342 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.1 tp -163.67 -34.48 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 176.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.8 mt -79.94 6.11 12.15 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 121.573 0.702 . . . . 0.0 110.885 178.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -91.9 -2.87 56.61 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.155 176.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.415 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 6.2 t70 -105.35 127.65 28.17 Favored Pre-proline 0 C--N 1.312 -1.043 0 C-N-CA 119.395 -0.922 . . . . 0.0 111.643 -173.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 16.6 Cg_exo -67.07 -27.31 42.27 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.882 2.388 . . . . 0.0 112.438 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.465 ' HB2' HD11 ' A' ' 69' ' ' ILE . 3.8 mm-40 -75.01 -25.27 58.67 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -177.081 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -70.46 -39.56 74.21 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.357 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.412 HG12 ' O ' ' A' ' 7' ' ' PRO . 9.4 p -68.4 -34.48 66.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.213 0.53 . . . . 0.0 109.574 178.074 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.68 -42.01 99.4 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 174.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.563 ' HB3' ' HE3' ' A' ' 16' ' ' LYS . 74.5 mt -57.45 -44.51 84.83 Favored 'General case' 0 C--O 1.195 -1.789 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.276 176.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -58.11 -32.84 68.49 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 118.659 0.663 . . . . 0.0 112.566 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -75.58 -32.89 60.53 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.903 0.859 . . . . 0.0 110.117 177.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -95.57 5.1 52.37 Favored 'General case' 0 CA--C 1.563 1.468 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.293 -176.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.616 ' HZ2' ' HB ' ' A' ' 89' ' ' THR . 17.4 mmtp -80.13 170.95 15.73 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 121.007 -1.058 . . . . 0.0 110.379 177.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 93.96 -34.83 4.45 Favored Glycine 0 C--O 1.221 -0.682 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.857 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.8 mtmm -80.73 11.24 3.99 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 124.092 0.957 . . . . 0.0 112.838 -178.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.0 m -134.09 168.31 24.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -177.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.418 ' O ' HG23 ' A' ' 24' ' ' VAL . 14.5 t-20 -94.23 138.94 31.67 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.451 ' HA ' HD12 ' A' ' 90' ' ' ILE . 76.0 t80 -61.37 -44.07 97.8 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 122.569 0.348 . . . . 0.0 111.761 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 -71.56 -31.22 66.75 Favored 'General case' 0 CA--C 1.492 -1.257 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -173.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.495 ' O ' HG12 ' A' ' 27' ' ' ILE . 30.8 tp -69.69 -47.86 61.7 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.453 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.509 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 94.6 t -63.52 -42.2 95.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -56.8 -43.73 81.25 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -65.54 -43.18 90.72 Favored 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.944 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.5 mm -58.74 -50.26 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-O 121.274 0.559 . . . . 0.0 109.811 177.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 82.7 mt -61.72 -36.24 80.37 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.325 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -71.84 -47.69 51.37 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.38 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -59.2 -41.08 87.71 Favored 'General case' 0 C--O 1.248 1.025 0 C-N-CA 124.307 1.043 . . . . 0.0 110.292 -177.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.423 ' CD1' HD13 ' A' ' 70' ' ' LEU . 45.8 pt -73.03 -40.31 58.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 120.596 -0.442 . . . . 0.0 109.996 176.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.423 ' O ' ' HB2' ' A' ' 36' ' ' ARG . 39.1 tt0 -60.95 -47.64 85.48 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 123.516 0.726 . . . . 0.0 111.051 -178.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.83 -30.1 71.23 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -75.0 -50.56 16.14 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 119.147 -1.021 . . . . 0.0 110.04 174.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 69.2 tp -60.49 -29.38 69.04 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.966 0.906 . . . . 0.0 111.692 -177.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 32' ' ' GLU . 3.0 tpt180 -58.86 -28.31 65.99 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 124.425 1.09 . . . . 0.0 109.964 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -130.82 19.98 4.9 Favored Glycine 0 N--CA 1.432 -1.598 0 C-N-CA 120.833 -0.699 . . . . 0.0 113.149 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 75.4 p -119.44 -103.26 0.41 Allowed 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.771 177.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.9 t70 178.23 -52.6 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -177.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.608 ' OD1' ' HG2' ' A' ' 42' ' ' LYS . 28.9 t-20 -101.95 112.99 25.82 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.226 -174.352 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.559 ' O ' HG12 ' A' ' 45' ' ' ILE . 10.9 tt -64.48 -31.94 55.66 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.102 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.608 ' HG2' ' OD1' ' A' ' 40' ' ' ASN . 64.6 pttt -71.86 -28.23 63.4 Favored 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 119.126 -1.029 . . . . 0.0 110.084 -177.214 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.2 m -73.91 -40.59 63.04 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.248 -0.887 . . . . 0.0 108.871 175.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.429 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 18.4 m -57.52 -40.7 79.32 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 121.021 0.439 . . . . 0.0 110.094 174.062 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.559 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.8 mm -54.51 -47.19 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 123.814 0.846 . . . . 0.0 109.897 175.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 42' ' ' LYS . 63.4 mt -52.93 -50.7 42.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.364 -0.834 . . . . 0.0 112.538 -177.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.429 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 31.0 m-85 -57.91 -49.84 75.38 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 121.164 0.507 . . . . 0.0 110.436 -175.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.4 t -66.78 -47.75 81.96 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 CA-C-N 114.508 -1.224 . . . . 0.0 111.671 -174.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -65.84 -39.01 90.37 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.823 0.344 . . . . 0.0 110.85 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.9 t -69.32 -22.06 63.8 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.306 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.9 t -97.16 -0.92 46.1 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-O 121.346 0.593 . . . . 0.0 109.944 -178.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.573 ' O ' HG12 ' A' ' 56' ' ' ILE . 26.8 m-70 -134.42 32.79 3.33 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 95.2 mt -47.37 -51.35 19.92 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -172.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -62.53 -44.21 96.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.041 0.448 . . . . 0.0 111.104 -175.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.489 ' OE2' HD11 ' A' ' 27' ' ' ILE . 24.4 tt0 -60.76 -49.83 75.9 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 124.534 1.134 . . . . 0.0 110.17 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.573 HG12 ' O ' ' A' ' 52' ' ' HIS . 43.6 mm -55.75 -43.01 72.26 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.147 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.018 176.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 69.2 mtm180 -64.25 -34.46 78.16 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -61.35 -51.43 68.84 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 120.863 0.363 . . . . 0.0 110.947 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.424 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 48.7 m-80 -121.77 60.7 0.96 Allowed 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 121.346 0.593 . . . . 0.0 110.434 -177.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.653 ' HG2' ' OE1' ' A' ' 61' ' ' GLU . 4.3 ptpp? -65.07 -33.86 77.05 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.128 -177.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.653 ' OE1' ' HG2' ' A' ' 60' ' ' LYS . 3.1 mp0 -63.81 -45.87 87.67 Favored 'General case' 0 N--CA 1.414 -2.226 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.424 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.424 ' HB3' ' HB3' ' A' ' 59' ' ' ASN . 78.0 t80 -63.83 -52.39 60.35 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.124 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.442 ' HA ' HG12 ' A' ' 66' ' ' ILE . 51.3 m-85 -68.46 -34.61 76.25 Favored 'General case' 0 N--CA 1.432 -1.347 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -175.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.66 -43.77 65.46 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.343 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.3 mtm -67.67 -39.78 84.5 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.665 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.527 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.8 pt -67.2 -41.59 86.99 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.993 0 C-N-CA 118.342 -1.343 . . . . 0.0 110.732 177.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.526 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.2 -36.57 68.55 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 121.141 0.496 . . . . 0.0 111.144 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -68.55 -55.29 12.16 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.738 177.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.465 HD11 ' HB2' ' A' ' 8' ' ' GLU . 86.8 mt -61.53 -38.96 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.837 -178.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.597 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 93.1 mt -56.65 -48.05 78.42 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 123.069 0.548 . . . . 0.0 111.347 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 69.8 mt-30 -66.21 -46.63 76.6 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -55.51 -52.46 63.62 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.817 1.647 . . . . 0.0 112.386 -176.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -90.13 -14.83 32.82 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -175.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.597 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.36 -28.32 67.85 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.354 0.597 . . . . 0.0 109.4 174.729 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -73.56 -22.14 60.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.106 176.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -96.3 -51.15 4.5 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.6 pt -119.79 -30.83 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.495 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 136.53 173.66 13.02 Favored Glycine 0 C--O 1.212 -1.24 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -178.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.5 tp -91.91 -40.59 12.45 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.105 0 CA-C-N 118.362 1.081 . . . . 0.0 110.506 -174.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -59.66 -33.97 72.23 Favored 'General case' 0 N--CA 1.421 -1.876 0 C-N-CA 123.975 0.91 . . . . 0.0 110.218 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.527 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 12.2 m120 -69.39 -48.14 62.07 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.396 -1.275 . . . . 0.0 109.366 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 78' ' ' GLY . 44.2 t -66.57 -38.55 81.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.3 -178.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -56.4 -45.61 80.54 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.257 0.551 . . . . 0.0 110.392 177.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -44.92 94.63 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.031 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 87.0 mt -59.43 -42.31 91.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.452 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.6 mm -64.08 -38.76 83.27 Favored 'Isoleucine or valine' 0 C--O 1.269 2.114 0 C-N-CA 122.637 0.375 . . . . 0.0 110.685 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.75 -40.5 95.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.562 0.696 . . . . 0.0 110.131 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 49.7 m -62.07 -33.27 74.11 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.322 177.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.616 ' HB ' ' HZ2' ' A' ' 16' ' ' LYS . 1.3 m -69.7 -34.57 74.1 Favored 'General case' 0 CA--C 1.562 1.415 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.492 HG23 ' NZ ' ' A' ' 16' ' ' LYS . 23.8 pt -87.54 -39.37 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -176.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -95.62 116.23 28.56 Favored 'General case' 0 C--N 1.292 -1.929 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 -173.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 85.3 mt 64.36 85.35 0.14 Allowed 'General case' 0 C--O 1.242 0.665 0 O-C-N 124.511 1.132 . . . . 0.0 109.772 -176.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.423 ' C ' ' H ' ' A' ' 95' ' ' HIS . 31.5 tt0 -55.92 146.34 22.42 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.983 -177.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -81.2 21.84 0.7 Allowed 'General case' 0 CA--C 1.548 0.9 0 CA-C-O 122.15 0.976 . . . . 0.0 109.538 -178.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.483 ' HA ' ' OXT' ' A' ' 99' ' ' HIS . 49.1 t-80 -159.06 145.34 16.72 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.024 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -151.06 -86.86 0.07 Allowed 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 170.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -157.21 24.33 0.3 Allowed 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.426 1.107 . . . . 0.0 108.173 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -140.24 -43.71 0.42 Allowed 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.278 -178.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.483 ' OXT' ' HA ' ' A' ' 95' ' ' HIS . 9.8 t-160 . . . . . 0 N--CA 1.431 -1.393 0 N-CA-C 106.441 -1.689 . . . . 0.0 106.441 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.452 ' HB2' ' CG ' ' A' ' 5' ' ' GLU . 1.9 mpt? . . . . . 0 CA--C 1.5 -0.965 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.473 ' O ' HG22 ' A' ' 3' ' ' ILE . 50.7 m -138.13 114.88 10.63 Favored 'General case' 0 N--CA 1.424 -1.764 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.473 HG22 ' O ' ' A' ' 2' ' ' SER . 4.0 tp 76.1 -32.86 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 C-N-CA 127.014 2.126 . . . . 0.0 113.086 175.524 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 99.1 mt -79.27 13.87 1.73 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.027 0.531 . . . . 0.0 111.933 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.452 ' CG ' ' HB2' ' A' ' 1' ' ' MET . 19.2 mt-10 -102.5 -9.28 20.35 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 13.1 t70 -99.74 126.24 37.77 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.59 -171.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 6.2 Cg_exo -71.23 -24.59 23.06 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.99 2.46 . . . . 0.0 112.721 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.458 ' HB2' HD11 ' A' ' 69' ' ' ILE . 6.0 mm-40 -75.52 -37.83 59.83 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -59.46 -44.51 92.98 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.955 178.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.6 p -65.77 -37.36 79.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.19 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -70.68 -29.17 65.41 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.175 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 64.1 mt -61.11 -39.32 89.53 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.212 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.576 ' HG2' HG23 ' A' ' 89' ' ' THR . 59.4 mtm180 -72.05 -27.19 62.53 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.082 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -77.25 -24.17 51.16 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.455 0.645 . . . . 0.0 109.736 176.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.401 ' CE1' ' HB2' ' A' ' 62' ' ' PHE . 39.1 t80 -84.22 -37.59 21.6 Favored 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 39.2 ttmt 76.55 -33.42 0.21 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 126.742 2.017 . . . . 0.0 112.25 178.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.29 -55.94 0.7 Allowed Glycine 0 N--CA 1.42 -2.406 0 C-N-CA 120.416 -0.897 . . . . 0.0 110.964 177.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt 57.08 27.69 13.75 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.327 1.051 . . . . 0.0 110.921 -178.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.9 m -131.55 168.9 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 C-N-CA 125.169 1.387 . . . . 0.0 110.249 -175.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -76.84 123.88 26.89 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -53.6 -38.37 63.92 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 123.607 0.763 . . . . 0.0 110.824 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -70.97 -31.22 67.71 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.57 -173.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.566 ' O ' HG12 ' A' ' 27' ' ' ILE . 34.8 tp -76.42 -41.71 46.68 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.695 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.454 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 62.1 t -63.11 -44.09 99.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 177.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 62.3 ttp -57.32 -35.13 69.47 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.118 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -74.64 -41.93 59.47 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.999 177.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.566 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.62 -49.93 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-O 121.488 0.661 . . . . 0.0 109.314 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 78.6 mt -61.96 -40.5 95.78 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.548 -1.205 . . . . 0.0 110.406 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -64.3 -47.38 79.7 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.781 0.801 . . . . 0.0 110.827 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -62.28 -42.69 99.56 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.992 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.404 HG21 HD13 ' A' ' 45' ' ' ILE . 32.8 pt -71.87 -38.38 64.86 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.481 175.395 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.87 -50.73 72.92 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.069 0.948 . . . . 0.0 111.239 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -65.21 -32.41 74.07 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.38 -179.013 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.42 ' N ' HD12 ' A' ' 33' ' ' LEU . 20.3 t70 -75.73 -48.5 21.61 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.141 0.496 . . . . 0.0 111.08 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.612 ' HG ' ' H ' ' A' ' 37' ' ' GLY . 57.1 tp -62.81 -47.72 82.2 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.29 -178.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 63.55 10.85 5.22 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.051 0.941 . . . . 0.0 112.235 -177.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.612 ' H ' ' HG ' ' A' ' 35' ' ' LEU . . . 76.21 12.82 83.85 Favored Glycine 0 N--CA 1.434 -1.467 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.243 -177.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.4 p -126.61 -47.25 1.56 Allowed 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 -174.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -79.62 -102.66 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 -171.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -141.41 106.6 4.99 Favored 'General case' 0 CA--C 1.498 -1.049 0 O-C-N 122.025 -0.422 . . . . 0.0 110.487 -176.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.545 ' HB ' HD22 ' A' ' 35' ' ' LEU . 12.7 tt -70.04 -29.05 38.52 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 CA-C-O 121.073 0.463 . . . . 0.0 109.892 -177.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.473 ' O ' HG13 ' A' ' 46' ' ' ILE . 10.2 ptmm? -59.35 -36.45 75.74 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.195 176.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 19.0 m -79.62 -35.61 39.2 Favored 'General case' 0 N--CA 1.417 -2.09 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.286 -178.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.8 m -59.22 -43.48 92.31 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 41' ' ' ILE . 29.8 mm -55.44 -41.29 62.17 Favored 'Isoleucine or valine' 0 C--N 1.346 0.419 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.008 177.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 42' ' ' LYS . 70.4 mt -57.37 -51.06 74.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.557 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -62.35 -52.44 63.62 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.564 0.697 . . . . 0.0 110.258 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.9 t -62.0 -46.95 95.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 114.585 -1.189 . . . . 0.0 112.084 -174.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -66.46 -36.44 82.78 Favored 'General case' 0 C--O 1.212 -0.888 0 C-N-CA 121.173 -0.211 . . . . 0.0 111.545 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.1 m -72.73 -25.4 61.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.979 0.418 . . . . 0.0 111.444 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.6 t -83.65 -40.39 19.04 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-O 121.167 0.508 . . . . 0.0 110.561 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.474 ' O ' HG12 ' A' ' 56' ' ' ILE . 64.1 m-70 -103.21 35.52 2.53 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.445 -175.112 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.1 mt -47.14 -43.17 20.62 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -175.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -53.99 -51.12 64.93 Favored 'General case' 0 C--N 1.318 -0.781 0 O-C-N 123.557 0.536 . . . . 0.0 112.226 -175.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 58' ' ' LYS . 12.8 tp10 -73.9 -34.36 64.36 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.044 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.474 HG12 ' O ' ' A' ' 52' ' ' HIS . 46.3 mm -61.19 -37.44 77.49 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -73.56 -43.15 60.57 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.682 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 55' ' ' GLU . 53.6 mtpt -58.33 -50.24 74.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.248 0.547 . . . . 0.0 111.565 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -120.02 54.14 1.04 Allowed 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 122.035 0.921 . . . . 0.0 110.39 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -53.47 -37.53 62.76 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 113.764 -1.562 . . . . 0.0 112.932 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -60.98 -46.82 89.2 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 120.954 0.406 . . . . 0.0 110.59 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.401 ' HB2' ' CE1' ' A' ' 15' ' ' PHE . 89.6 t80 -63.36 -51.02 67.63 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.056 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.508 ' HA ' HG12 ' A' ' 66' ' ' ILE . 85.9 m-85 -70.4 -28.16 64.86 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -175.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -75.68 -44.34 42.74 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.134 177.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.7 mtm -62.76 -45.77 91.13 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.038 178.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.508 HG12 ' HA ' ' A' ' 63' ' ' TYR . 44.0 pt -64.82 -36.9 78.82 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.217 0 C-N-CA 119.354 -0.938 . . . . 0.0 111.276 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.545 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -53.53 -46.63 70.22 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.351 0.407 . . . . 0.0 112.006 -177.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -76.3 -35.61 58.77 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.144 -0.622 . . . . 0.0 112.014 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.458 HD11 ' HB2' ' A' ' 8' ' ' GLU . 82.3 mt -64.05 -45.29 97.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 177.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.582 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.9 mt -52.88 -45.95 67.71 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 123.461 0.704 . . . . 0.0 110.988 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.545 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.0 mt-30 -66.29 -48.39 70.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.472 0.653 . . . . 0.0 110.52 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 39.5 ttm180 -59.19 -50.95 72.05 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.245 1.418 . . . . 0.0 111.436 -177.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.415 ' OH ' ' HB2' ' A' ' 5' ' ' GLU . 48.5 m-85 -86.56 -15.44 39.93 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -176.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.582 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.37 -34.8 78.04 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.2 174.419 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -74.88 -39.58 61.42 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.008 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -75.26 -47.06 29.82 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -174.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.8 pt -123.39 -30.72 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 O-C-N 121.721 -0.612 . . . . 0.0 112.569 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.504 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.95 142.5 5.89 Favored Glycine 0 C--N 1.309 -0.929 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.409 ' HB ' ' HB2' ' A' ' 74' ' ' TYR . 8.2 tp -61.14 -38.45 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 117.096 0.448 . . . . 0.0 111.876 -174.038 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -53.47 -45.75 69.68 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.713 0.768 . . . . 0.0 110.475 179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.469 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 42.6 m-80 -65.59 -45.68 82.28 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.189 -1.368 . . . . 0.0 110.195 -178.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 78' ' ' GLY . 15.0 t -65.01 -45.66 93.92 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.12 -176.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -55.56 -43.75 76.18 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.335 0.588 . . . . 0.0 110.844 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -45.49 83.7 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 98.7 mt -62.39 -39.67 93.97 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.669 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.473 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.5 mm -62.89 -40.48 88.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-O 120.847 0.356 . . . . 0.0 110.073 177.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 98.6 mt -63.71 -38.62 91.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.867 0.842 . . . . 0.0 110.32 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.7 m -67.07 -34.36 77.5 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.033 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.576 HG23 ' HG2' ' A' ' 13' ' ' ARG . 56.4 m -64.95 -46.21 82.53 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 124.324 1.05 . . . . 0.0 110.805 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.433 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 24.9 pt -75.36 -12.71 14.91 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -177.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -101.94 22.08 13.63 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.171 0.51 . . . . 0.0 109.758 174.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.414 HD11 ' HB2' ' A' ' 95' ' ' HIS . 33.0 tp -146.32 167.34 23.78 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.422 ' HB2' ' HE2' ' A' ' 16' ' ' LYS . 32.1 tt0 -145.77 -76.4 0.2 Allowed 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 176.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -150.77 81.86 1.34 Allowed 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -174.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.414 ' HB2' HD11 ' A' ' 92' ' ' LEU . 9.4 t-80 -84.41 72.21 10.62 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -177.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -71.07 -33.87 70.65 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.047 -178.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -77.48 95.66 4.53 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 175.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.8 p-80 -138.91 140.17 38.27 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-O 121.01 0.433 . . . . 0.0 111.038 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 15.1 p80 . . . . . 0 C--N 1.29 -1.996 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.632 -174.491 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.2 mtt . . . . . 0 CA--C 1.51 -0.587 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.2 t -77.85 151.5 33.87 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 121.375 0.607 . . . . 0.0 110.023 -179.096 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 16.3 tt -142.57 19.58 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 123.414 1.578 . . . . 0.0 107.36 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.1 mt -82.66 4.42 24.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.929 -176.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.413 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 21.8 mt-10 -79.89 -24.88 40.85 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 -178.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.449 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 7.1 t70 -86.18 131.1 47.47 Favored Pre-proline 0 C--O 1.247 0.964 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.351 -170.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 2.9 Cg_exo -72.1 -30.36 13.52 Favored 'Trans proline' 0 C--O 1.241 0.638 0 C-N-CA 122.848 2.366 . . . . 0.0 113.108 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -76.2 -28.73 57.35 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -64.43 -41.82 96.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.389 178.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 7' ' ' PRO . 10.3 p -63.44 -34.86 69.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -59.18 -43.85 92.17 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.358 171.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.71 -35.48 78.17 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 122.907 0.483 . . . . 0.0 110.962 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -61.5 -36.78 81.45 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.185 0.594 . . . . 0.0 110.641 177.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -79.76 -38.09 33.95 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.996 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.428 ' CZ ' ' HB2' ' A' ' 18' ' ' LYS . 51.1 t80 -59.56 -49.36 78.08 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.073 -0.967 . . . . 0.0 108.953 177.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.574 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 87.6 tttt 64.73 -93.74 0.04 OUTLIER 'General case' 0 C--O 1.212 -0.912 0 C-N-CA 125.654 1.582 . . . . 0.0 111.378 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -144.03 108.37 0.49 Allowed Glycine 0 N--CA 1.432 -1.609 0 C-N-CA 119.549 -1.31 . . . . 0.0 112.336 -176.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.428 ' HB2' ' CZ ' ' A' ' 15' ' ' PHE . 59.3 mtpt -136.46 19.47 3.13 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.402 HG21 HG21 ' A' ' 24' ' ' VAL . 31.0 m -128.13 168.26 21.66 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 CA-C-N 114.442 -1.254 . . . . 0.0 108.835 -174.052 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.417 ' O ' HG23 ' A' ' 24' ' ' VAL . 79.5 m-20 -84.32 110.54 18.67 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 120.072 -0.651 . . . . 0.0 109.671 173.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.522 ' CE1' ' HD2' ' A' ' 91' ' ' LYS . 52.5 t80 -48.82 -47.94 41.98 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.319 1.048 . . . . 0.0 112.888 -178.095 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -64.65 -31.88 73.29 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -176.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.628 ' O ' HG12 ' A' ' 27' ' ' ILE . 31.1 tp -76.79 -40.63 47.48 Favored 'General case' 0 N--CA 1.426 -1.648 0 C-N-CA 119.819 -0.752 . . . . 0.0 110.067 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 20' ' ' ASN . 53.9 t -60.55 -42.3 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 177.28 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -57.2 -44.38 83.58 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.356 176.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -68.24 -38.13 81.53 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.943 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.628 HG12 ' O ' ' A' ' 23' ' ' LEU . 49.6 mm -56.81 -51.71 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.02 -40.98 97.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.493 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -66.02 -47.52 74.17 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.509 0.671 . . . . 0.0 111.35 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -62.02 -39.71 93.2 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.703 -176.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.473 HG23 HG21 ' A' ' 48' ' ' VAL . 31.0 pt -73.01 -39.21 57.33 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.234 175.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.99 -52.93 63.31 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.7 0.8 . . . . 0.0 111.406 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -66.6 -28.78 68.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -178.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -76.09 -49.71 16.7 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.633 0.73 . . . . 0.0 109.816 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 63.8 tp -63.15 -24.2 67.78 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.276 -178.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -48.58 -38.24 20.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.478 1.111 . . . . 0.0 111.105 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -173.12 59.08 0.15 Allowed Glycine 0 N--CA 1.435 -1.367 0 C-N-CA 119.992 -1.099 . . . . 0.0 112.334 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 53.9 m -146.95 -80.48 0.15 Allowed 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -126.6 -160.16 0.97 Allowed 'General case' 0 C--O 1.245 0.833 0 C-N-CA 119.557 -0.857 . . . . 0.0 110.379 -172.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -82.86 146.69 28.75 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.509 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.8 tt -58.0 -38.37 66.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 O-C-N 123.144 0.278 . . . . 0.0 111.506 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -66.46 -31.72 72.64 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.834 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.2 m -73.12 -41.61 63.81 Favored 'General case' 0 N--CA 1.426 -1.67 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 177.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.458 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 15.6 m -59.63 -39.71 85.21 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.783 177.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 41' ' ' ILE . 23.8 mm -52.39 -46.74 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 124.054 0.942 . . . . 0.0 110.278 175.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 60.2 mt -57.69 -47.66 85.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.986 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.458 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 19.5 m-85 -59.75 -42.59 93.58 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.812 0.815 . . . . 0.0 110.299 -177.093 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.473 HG21 HG23 ' A' ' 31' ' ' ILE . 46.5 t -71.85 -49.22 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.75 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.364 -176.165 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.417 ' HA ' HG13 ' A' ' 56' ' ' ILE . 4.1 m-30 -62.98 -40.39 97.58 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.764 -178.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.5 t -66.78 -31.25 71.76 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 122.58 0.352 . . . . 0.0 111.665 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.7 t -84.68 -27.57 26.96 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.136 0.493 . . . . 0.0 111.008 -178.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.56 ' O ' HG12 ' A' ' 56' ' ' ILE . 83.1 m-70 -117.15 35.36 4.68 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -174.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 81.6 mt -47.13 -40.0 14.65 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 -174.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -56.78 -51.27 69.58 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -174.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -72.99 -32.61 65.29 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.185 0.517 . . . . 0.0 109.648 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.56 HG12 ' O ' ' A' ' 52' ' ' HIS . 44.9 mm -62.7 -45.4 98.93 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.786 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.623 -178.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.3 ptp85 -77.22 -28.06 53.67 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.224 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.504 ' HD2' ' ND2' ' A' ' 59' ' ' ASN . 0.0 OUTLIER -69.33 -32.6 71.81 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -175.956 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.504 ' ND2' ' HD2' ' A' ' 58' ' ' LYS . 55.8 m-80 -128.47 55.34 1.7 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.357 174.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -63.7 -24.08 67.63 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.522 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -63.86 -57.53 9.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 175.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -59.53 -51.21 70.83 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.692 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.455 ' HA ' HG12 ' A' ' 66' ' ' ILE . 72.6 m-85 -67.59 -26.12 66.11 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -176.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -77.07 -46.05 24.96 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.611 176.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.5 mtm -59.09 -50.59 73.48 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.664 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.7 pt -63.31 -41.69 93.66 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.698 0 C-N-CA 119.617 -0.833 . . . . 0.0 112.038 -178.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.54 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.85 -39.65 74.65 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.046 0.45 . . . . 0.0 110.91 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.56 -52.49 31.26 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.578 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.8 mt -60.34 -42.91 92.45 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.6 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 98.0 mt -52.66 -46.72 67.29 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 123.277 0.631 . . . . 0.0 111.265 178.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 63.7 mt-30 -68.57 -43.31 76.86 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.015 0.436 . . . . 0.0 110.565 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -62.07 -47.56 84.12 Favored 'General case' 0 N--CA 1.428 -1.534 0 C-N-CA 123.755 0.822 . . . . 0.0 111.556 -178.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.413 ' OH ' ' HB2' ' A' ' 5' ' ' GLU . 57.6 m-85 -85.75 -15.48 42.01 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 -177.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.551 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.01 -33.3 75.27 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 174.931 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -73.46 -34.71 65.51 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.483 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -85.35 -51.46 6.55 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.161 0.801 . . . . 0.0 113.161 -175.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.0 pt -118.48 -29.11 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -173.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.543 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.95 143.91 6.21 Favored Glycine 0 N--CA 1.438 -1.186 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.0 tp -61.33 -37.16 76.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 122.44 0.296 . . . . 0.0 111.243 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -65.02 -35.5 81.38 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.627 -177.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.627 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.4 t-20 -67.73 -45.53 74.74 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.824 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.1 t -66.77 -38.22 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.626 -177.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.462 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 47.3 t-20 -50.78 -50.0 56.99 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.126 0.97 . . . . 0.0 108.898 177.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.22 -40.84 81.96 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.109 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 81.5 mt -61.16 -42.01 97.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.528 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.6 mm -64.42 -44.47 97.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 177.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 80.9 mt -61.38 -34.71 75.78 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.267 0.556 . . . . 0.0 110.948 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.8 m -66.47 -46.33 76.72 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.235 177.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.6 m -64.27 -35.28 80.32 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.436 0.694 . . . . 0.0 111.864 -175.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.574 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 26.5 pt -82.51 -19.08 10.56 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.522 ' HD2' ' CE1' ' A' ' 21' ' ' PHE . 56.1 mtpt -104.36 -59.95 1.66 Allowed 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.271 -0.572 . . . . 0.0 112.02 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 96.9 mt 63.94 20.99 12.46 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.055 0.942 . . . . 0.0 111.203 -174.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -64.78 -56.71 11.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.618 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -134.02 143.86 48.35 Favored 'General case' 0 CA--C 1.503 -0.865 0 C-N-CA 120.466 -0.494 . . . . 0.0 109.684 176.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -85.96 130.9 34.4 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 123.469 0.481 . . . . 0.0 110.151 178.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -78.93 57.42 2.15 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -175.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -159.07 -60.57 0.07 Allowed 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.766 -0.774 . . . . 0.0 109.946 177.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -77.46 82.9 3.89 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.04 0.924 . . . . 0.0 111.741 179.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 . . . . . 0 C--N 1.291 -1.952 0 N-CA-C 104.98 -2.23 . . . . 0.0 104.98 178.588 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.1 mtt . . . . . 0 C--O 1.239 0.551 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.5 t -136.8 81.65 1.89 Allowed 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 tp -132.79 -19.15 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.634 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 98.3 mt -77.94 13.43 1.4 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.295 0.569 . . . . 0.0 111.914 -178.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -86.39 -5.57 59.14 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.84 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.433 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 18.2 t70 -113.95 131.43 23.14 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 112.727 0.639 . . . . 0.0 112.727 -177.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.485 ' O ' HG12 ' A' ' 10' ' ' VAL . 7.2 Cg_exo -71.85 -24.6 21.0 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.462 2.774 . . . . 0.0 113.866 176.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.34 -38.52 74.87 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -178.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -59.81 -38.84 83.13 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.581 176.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 7' ' ' PRO . 8.6 p -69.49 -33.85 59.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.171 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.12 -36.42 79.67 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 175.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.421 HD21 ' HB2' ' A' ' 65' ' ' MET . 98.0 mt -63.71 -41.93 98.02 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.139 0.495 . . . . 0.0 110.424 176.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -64.04 -30.65 71.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.7 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -79.62 -25.96 41.3 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.71 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -69.05 -42.95 75.62 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 178.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm 74.26 -174.36 0.14 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.928 1.291 . . . . 0.0 111.81 176.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.97 59.05 4.28 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 116.233 -0.44 . . . . 0.0 114.107 -176.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -82.87 -13.38 56.24 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.794 0.807 . . . . 0.0 109.382 174.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.518 HG11 ' CD2' ' A' ' 62' ' ' PHE . 24.7 m -90.75 164.18 2.17 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.97 -178.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.465 ' O ' HG23 ' A' ' 24' ' ' VAL . 18.3 t-20 -87.86 115.87 25.62 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.111 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.466 ' CE2' ' HD2' ' A' ' 91' ' ' LYS . 60.4 t80 -51.76 -38.44 55.47 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.462 0.476 . . . . 0.0 111.665 -178.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -72.88 -36.06 67.26 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.406 -172.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.618 ' O ' HG12 ' A' ' 27' ' ' ILE . 25.8 tp -76.64 -39.1 53.4 Favored 'General case' 0 N--CA 1.415 -2.196 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.987 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.469 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 72.8 t -57.84 -46.65 87.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 174.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 54.6 ttp -58.13 -40.0 80.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.055 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 -68.91 -41.06 78.73 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.229 175.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.618 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.3 mm -57.02 -51.93 62.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 177.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.7 mt -62.39 -38.09 88.28 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 114.515 -1.221 . . . . 0.0 110.541 -179.099 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -69.09 -46.16 68.45 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.136 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -61.86 -43.29 99.15 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.159 -176.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.416 ' CD1' HD13 ' A' ' 70' ' ' LEU . 39.4 pt -71.5 -38.73 69.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.599 177.103 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.479 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 37.3 tt0 -59.03 -52.97 63.45 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 123.082 0.553 . . . . 0.0 111.363 -179.175 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.426 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.6 pp -58.36 -37.35 75.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 120.823 0.344 . . . . 0.0 111.527 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.426 ' N ' HD12 ' A' ' 33' ' ' LEU . 27.8 t70 -73.78 -45.96 48.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.208 0.528 . . . . 0.0 110.328 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 55.1 tp -66.44 -23.5 66.3 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.513 -177.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 77.3 mtp180 -69.21 -7.74 39.38 Favored 'General case' 0 C--N 1.308 -1.231 0 O-C-N 121.312 -0.867 . . . . 0.0 112.338 177.163 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -126.89 23.28 5.61 Favored Glycine 0 N--CA 1.442 -0.908 0 N-CA-C 111.597 -0.601 . . . . 0.0 111.597 174.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 t -158.81 175.1 14.01 Favored 'General case' 0 C--O 1.216 -0.673 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -175.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -121.91 -11.69 8.5 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 121.905 0.859 . . . . 0.0 108.925 173.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -81.37 67.22 7.23 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.283 -178.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.513 HD13 ' HA ' ' A' ' 71' ' ' GLN . 9.7 tt -61.5 -30.95 49.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.274 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.536 ' O ' HG13 ' A' ' 46' ' ' ILE . 20.5 ptmt -67.94 -33.66 75.1 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 119.464 -0.895 . . . . 0.0 110.372 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.6 m -72.9 -33.69 66.18 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.463 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 14.0 m -62.05 -44.95 95.58 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 173.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.495 ' HB ' ' O ' ' A' ' 42' ' ' LYS . 27.6 mm -52.94 -48.45 51.6 Favored 'Isoleucine or valine' 0 C--N 1.344 0.351 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.468 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 42' ' ' LYS . 72.0 mt -55.38 -49.73 70.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.726 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.463 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 13.1 m-85 -58.43 -45.16 89.03 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 122.256 1.027 . . . . 0.0 110.481 -178.104 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 44' ' ' SER . 57.8 t -73.12 -49.26 39.66 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.771 0 CA-C-N 114.248 -1.342 . . . . 0.0 111.308 -173.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -63.5 -35.91 82.02 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.522 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.7 p -73.59 -22.18 60.12 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.068 0.461 . . . . 0.0 111.718 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.6 t -90.45 -25.95 20.08 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.651 0.739 . . . . 0.0 110.134 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.5 ' O ' HG12 ' A' ' 56' ' ' ILE . 81.2 m-70 -118.7 36.61 4.35 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 121.911 -0.493 . . . . 0.0 109.894 -175.178 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.5 mt -48.7 -44.11 37.74 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -175.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -56.61 -45.35 81.49 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 123.27 0.356 . . . . 0.0 111.936 -175.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -67.36 -44.77 78.18 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.621 0.724 . . . . 0.0 109.625 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 52' ' ' HIS . 45.6 mm -59.59 -46.57 92.99 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.862 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.294 -176.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -72.61 -24.56 61.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.898 0.38 . . . . 0.0 111.095 -178.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -72.78 -46.52 52.9 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.553 0.692 . . . . 0.0 109.47 -177.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.497 ' HB2' ' CE2' ' A' ' 63' ' ' TYR . 4.6 m120 -117.37 46.33 1.73 Allowed 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 -177.105 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.66 -34.59 18.84 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.114 1.366 . . . . 0.0 114.56 -173.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -67.09 -48.28 68.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.394 0.616 . . . . 0.0 110.311 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.518 ' CD2' HG11 ' A' ' 19' ' ' VAL . 85.4 t80 -64.03 -51.3 64.85 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.811 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.509 ' HA ' HG12 ' A' ' 66' ' ' ILE . 82.1 m-85 -66.22 -26.15 67.25 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -175.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.42 -47.24 17.95 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 119.442 -0.903 . . . . 0.0 111.051 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.421 ' HB2' HD21 ' A' ' 12' ' ' LEU . 76.3 mtm -65.74 -36.09 82.58 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.073 -178.053 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.509 HG12 ' HA ' ' A' ' 63' ' ' TYR . 41.2 pt -67.19 -38.33 80.87 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.669 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.33 175.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -57.27 -42.02 80.83 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.918 0.39 . . . . 0.0 110.139 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -62.04 -56.47 18.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.013 176.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 99.2 mt -60.97 -40.87 86.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.686 0.795 . . . . 0.0 112.403 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.505 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 88.2 mt -55.1 -49.64 71.21 Favored 'General case' 0 C--O 1.212 -0.906 0 C-N-CA 123.208 0.603 . . . . 0.0 112.015 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.523 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 49.4 mt-30 -69.02 -50.25 50.45 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 122.101 0.953 . . . . 0.0 109.361 -178.067 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -55.88 -47.13 77.94 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.137 -1.847 . . . . 0.0 111.901 -176.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -88.87 -15.93 33.21 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.505 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.79 -32.95 73.88 Favored 'General case' 0 N--CA 1.439 -0.989 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.775 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -69.15 -28.21 66.23 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.427 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -90.81 -52.17 5.0 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.9 pt -119.2 -27.67 2.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.51 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 120.62 144.12 6.98 Favored Glycine 0 C--N 1.305 -1.161 0 C-N-CA 120.411 -0.899 . . . . 0.0 110.872 178.2 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.3 tp -61.56 -38.5 80.36 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 C-N-CA 122.44 0.296 . . . . 0.0 111.739 -174.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -55.84 -44.28 77.83 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 122.541 1.162 . . . . 0.0 109.706 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.52 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 51.0 m-80 -67.64 -44.34 78.18 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 113.557 -1.656 . . . . 0.0 110.982 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.9 t -67.69 -39.87 82.92 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.175 -177.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -55.76 -45.37 78.09 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.276 0.56 . . . . 0.0 110.779 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -41.75 95.5 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 89.1 mt -62.13 -42.14 98.95 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.423 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 82' ' ' VAL . 51.1 mm -63.96 -39.12 84.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.887 0.375 . . . . 0.0 110.094 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.88 -39.44 94.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.404 0.621 . . . . 0.0 110.109 176.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 27.3 m -66.89 -33.82 76.44 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.103 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 47.3 m -60.76 -42.88 98.34 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.905 0.882 . . . . 0.0 111.12 -178.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 23.7 pt -86.51 -15.04 10.18 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.088 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.466 ' HD2' ' CE2' ' A' ' 21' ' ' PHE . 9.3 mtpm? -89.66 76.34 7.31 Favored 'General case' 0 N--CA 1.437 -1.113 0 C-N-CA 120.026 -0.67 . . . . 0.0 112.286 179.673 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.56 87.88 5.72 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 104.978 -2.23 . . . . 0.0 104.978 169.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -138.64 161.44 37.11 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-N 115.039 -0.982 . . . . 0.0 108.755 -169.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 58.4 m-70 66.15 44.8 2.49 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 124.223 1.009 . . . . 0.0 109.865 -177.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -66.68 -31.77 72.65 Favored 'General case' 0 CA--C 1.501 -0.907 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 176.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -84.8 102.7 13.25 Favored 'General case' 0 N--CA 1.422 -1.87 0 N-CA-C 103.253 -2.869 . . . . 0.0 103.253 168.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -67.9 85.91 0.23 Allowed 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 122.131 0.967 . . . . 0.0 112.255 -173.405 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -127.2 117.9 23.23 Favored 'General case' 0 N--CA 1.409 -2.502 0 CA-C-N 113.818 -1.537 . . . . 0.0 107.408 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 6.9 p80 . . . . . 0 C--N 1.285 -2.216 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 178.767 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.437 ' HB3' ' HG ' ' A' ' 4' ' ' LEU . 25.1 mmt . . . . . 0 CA--C 1.521 -0.165 0 CA-C-O 120.932 0.396 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.2 m -97.41 -14.51 21.16 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.543 0.687 . . . . 0.0 110.051 177.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 18.7 tt -86.42 13.82 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.562 1.407 0 CA-C-O 122.159 0.98 . . . . 0.0 111.308 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.437 ' HG ' ' HB3' ' A' ' 1' ' ' MET . 95.4 mt -75.76 -4.06 38.4 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.232 -0.918 . . . . 0.0 110.472 178.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -74.95 -7.79 54.6 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.634 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -94.43 120.16 65.5 Favored Pre-proline 0 N--CA 1.439 -1.001 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.538 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 26.5 Cg_exo -63.12 -30.6 75.45 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 123.067 2.512 . . . . 0.0 113.23 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.39 -41.75 46.76 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -178.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -57.29 -46.21 83.38 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.684 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.0 p -64.42 -34.57 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.67 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 64.1 mttp -62.63 -44.66 95.72 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 175.746 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.7 mt -58.45 -42.11 86.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.804 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -59.67 -37.19 78.08 Favored 'General case' 0 N--CA 1.476 0.838 0 O-C-N 123.444 0.465 . . . . 0.0 111.21 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -79.68 -40.64 28.57 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.817 -179.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -73.86 -54.46 7.94 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.04 -0.982 . . . . 0.0 112.973 -174.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 88.0 tttt 66.77 124.52 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.577 1.151 . . . . 0.0 109.157 -171.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.81 -9.26 25.98 Favored Glycine 0 C--O 1.215 -1.052 0 N-CA-C 118.074 1.99 . . . . 0.0 118.074 -168.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 16' ' ' LYS . 42.8 mtpt 65.62 7.36 4.39 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 118.193 0.996 . . . . 0.0 111.805 176.038 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 6.5 m -109.98 168.97 3.81 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 C-N-CA 124.337 1.055 . . . . 0.0 110.39 -178.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -67.85 133.53 49.33 Favored 'General case' 0 C--N 1.309 -1.194 0 O-C-N 124.109 0.881 . . . . 0.0 109.1 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -57.16 -39.76 75.9 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.417 0.627 . . . . 0.0 110.63 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -72.09 -29.19 63.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.552 -175.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.52 HD21 ' CD ' ' A' ' 55' ' ' GLU . 61.0 tp -70.24 -45.26 66.84 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.676 178.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.86 -40.84 88.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.407 ' HA ' HD21 ' A' ' 87' ' ' LEU . 41.5 ttm -57.31 -41.54 80.09 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.23 174.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -66.85 -43.05 84.65 Favored 'General case' 0 C--O 1.208 -1.126 0 O-C-N 123.217 0.323 . . . . 0.0 110.92 177.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.463 HD11 ' OE2' ' A' ' 55' ' ' GLU . 47.3 mm -56.97 -50.04 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.319 0.58 . . . . 0.0 109.839 178.504 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.8 mt -63.56 -42.07 98.38 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.893 -1.048 . . . . 0.0 110.534 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -62.96 -46.23 88.73 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 123.719 0.808 . . . . 0.0 110.458 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -63.68 -47.79 79.82 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.77 -177.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.418 ' CD1' HD13 ' A' ' 70' ' ' LEU . 38.2 pt -66.67 -40.4 86.07 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.077 178.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.04 -46.45 89.5 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 123.585 0.754 . . . . 0.0 111.641 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.413 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.3 pp -60.07 -37.32 79.54 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -177.484 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.413 ' N ' HD12 ' A' ' 33' ' ' LEU . 20.1 t70 -76.06 -51.09 13.01 Favored 'General case' 0 CA--C 1.508 -0.646 0 O-C-N 123.412 0.445 . . . . 0.0 110.306 177.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.445 HD21 ' CD2' ' A' ' 74' ' ' TYR . 57.0 tp -57.84 -31.97 67.16 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.683 1.193 . . . . 0.0 113.322 -175.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -74.62 -12.53 60.47 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 121.185 0.516 . . . . 0.0 110.564 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -106.96 -33.61 3.2 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 110.807 -0.917 . . . . 0.0 110.807 176.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 p -95.07 -151.13 0.32 Allowed 'General case' 0 CA--C 1.558 1.278 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 178.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -142.66 -40.42 0.33 Allowed 'General case' 0 C--O 1.243 0.724 0 O-C-N 121.757 -0.59 . . . . 0.0 111.59 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -81.62 95.15 7.09 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 -178.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.528 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.7 tt -58.86 -30.91 43.85 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.786 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.764 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.501 ' O ' HG13 ' A' ' 46' ' ' ILE . 21.0 ptmt -63.44 -34.45 77.77 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.182 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.1 m -76.65 -33.09 58.32 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.498 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 13.2 m -63.52 -40.38 96.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.298 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 41' ' ' ILE . 36.1 mm -54.87 -48.37 74.33 Favored 'Isoleucine or valine' 0 C--N 1.346 0.446 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.199 174.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 42' ' ' LYS . 72.7 mt -53.89 -48.69 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.438 -178.289 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.498 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 18.5 m-85 -58.89 -53.01 63.27 Favored 'General case' 0 C--O 1.244 0.788 0 CA-C-O 121.225 0.536 . . . . 0.0 109.844 -177.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.4 t -62.44 -49.81 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.543 -176.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -65.55 -33.96 77.15 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 39.9 m -75.42 -21.93 57.81 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.918 0.389 . . . . 0.0 111.917 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.9 t -93.53 -8.81 40.31 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.973 0.892 . . . . 0.0 109.429 179.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.562 ' O ' HG12 ' A' ' 56' ' ' ILE . 35.6 m-70 -126.46 30.96 5.46 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.158 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.2 mt -48.85 -56.55 8.4 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -170.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.623 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 17.3 t70 -62.27 -44.08 97.36 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.42 -175.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.535 ' HB3' ' O ' ' A' ' 52' ' ' HIS . 26.7 tt0 -53.81 -51.22 64.2 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 124.819 1.248 . . . . 0.0 110.111 175.265 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 52' ' ' HIS . 51.7 mm -58.57 -44.25 88.97 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.721 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.241 177.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 -65.12 -33.66 76.54 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 178.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.623 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 66.4 mttm -56.85 -47.52 80.18 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.074 0.464 . . . . 0.0 109.778 178.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -127.67 65.42 1.34 Allowed 'General case' 0 C--N 1.317 -0.848 0 CA-C-O 121.982 0.896 . . . . 0.0 110.429 -178.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -66.09 -33.66 76.3 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 114.534 -1.212 . . . . 0.0 112.605 -176.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -65.03 -47.1 78.61 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.279 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -62.5 -52.14 64.65 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.294 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 56' ' ' ILE . 45.0 m-85 -66.82 -30.54 70.75 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -176.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -78.6 -40.12 35.43 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.975 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.6 mtm -63.63 -43.16 97.65 Favored 'General case' 0 CA--C 1.502 -0.886 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.654 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 36.8 pt -64.68 -38.54 82.93 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.246 0 C-N-CA 119.39 -0.924 . . . . 0.0 111.369 178.362 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.55 -34.0 68.7 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 121.205 0.526 . . . . 0.0 111.368 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -69.1 -54.49 14.7 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.2 mt -59.95 -44.1 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.269 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.578 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.2 mt -53.31 -51.76 61.33 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 123.451 0.701 . . . . 0.0 111.588 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.494 ' HG2' HG23 ' A' ' 41' ' ' ILE . 46.4 mt-30 -65.41 -43.48 90.43 Favored 'General case' 0 C--O 1.257 1.458 0 CA-C-O 121.377 0.608 . . . . 0.0 110.802 -178.556 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -60.26 -49.03 79.21 Favored 'General case' 0 N--CA 1.426 -1.647 0 C-N-CA 124.538 1.135 . . . . 0.0 111.767 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -91.61 -15.1 29.08 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.578 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.07 -32.24 73.58 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.829 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -72.83 -24.26 60.87 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.531 175.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -98.01 -51.79 3.92 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -172.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.3 pt -110.75 -29.52 2.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.254 0 C-N-CA 119.898 -0.721 . . . . 0.0 112.478 -176.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.512 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 123.19 147.53 7.37 Favored Glycine 0 C--N 1.306 -1.106 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.5 tp -63.81 -35.62 73.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.949 0.374 . . . . 0.0 111.637 -176.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.98 -44.52 94.44 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 122.282 1.039 . . . . 0.0 109.966 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.476 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 18.1 m120 -64.47 -45.71 86.2 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.772 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.4 t -66.72 -38.1 80.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.404 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 43.1 t-20 -52.92 -50.17 64.5 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.416 1.087 . . . . 0.0 109.38 177.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -44.24 81.47 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.208 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.7 mt -61.41 -44.39 97.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.14 -178.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.0 mm -62.96 -37.84 80.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 120.853 0.359 . . . . 0.0 110.343 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.444 ' O ' ' HG2' ' A' ' 91' ' ' LYS . 81.8 mt -62.31 -44.95 95.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.525 0.679 . . . . 0.0 110.399 176.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.3 m -64.31 -33.34 75.6 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.073 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.7 m -58.77 -45.7 89.18 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.668 0.787 . . . . 0.0 111.581 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 33.9 pt -82.29 -9.36 11.75 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 CA-C-O 120.967 0.413 . . . . 0.0 111.869 -178.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 87' ' ' LEU . 32.0 mmmt -85.67 102.13 13.33 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 173.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -76.16 -41.48 49.68 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 46.13 99.92 0.01 OUTLIER 'General case' 0 C--O 1.239 0.502 0 C-N-CA 125.953 1.701 . . . . 0.0 115.141 173.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 37.6 m80 -74.11 164.05 27.1 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.525 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 86.2 t60 81.56 -13.96 0.84 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.621 1.168 . . . . 0.0 112.379 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -89.07 159.28 17.63 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 171.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 43.6 m-70 -79.27 99.86 7.27 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -87.92 -14.06 40.27 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 169.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 . . . . . 0 N--CA 1.43 -1.449 0 C-N-CA 127.206 2.202 . . . . 0.0 105.413 174.209 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.611 0 N-CA-C 111.388 0.144 . . . . 0.0 111.388 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m -89.51 167.42 12.99 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.1 tp -102.21 -25.01 3.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 C-N-CA 119.741 -0.783 . . . . 0.0 110.507 -178.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.5 mt -82.3 13.37 3.59 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.586 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -98.53 2.84 47.92 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 120.779 0.323 . . . . 0.0 110.818 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.545 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 10.2 t70 -111.1 131.92 21.95 Favored Pre-proline 0 C--N 1.315 -0.931 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.694 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.47 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 17.3 Cg_exo -64.34 -31.75 62.2 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.42 2.08 . . . . 0.0 113.094 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.83 -32.62 61.99 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.833 -175.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -69.59 -42.92 73.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.577 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.52 -34.19 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.322 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.7 mttt -60.23 -45.39 93.38 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.394 175.611 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.7 mt -56.55 -40.84 75.81 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.566 0.541 . . . . 0.0 111.871 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -71.0 -29.77 65.82 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.492 -177.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -79.99 -35.33 37.62 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -61.52 -44.1 97.66 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 125.178 1.391 . . . . 0.0 110.224 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.4 mttm 77.16 154.27 0.15 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.242 1.417 . . . . 0.0 111.774 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -87.87 89.96 1.64 Allowed Glycine 0 N--CA 1.426 -2.024 0 C-N-CA 120.357 -0.925 . . . . 0.0 110.973 178.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.66 -1.52 56.2 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.933 0.397 . . . . 0.0 110.849 177.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.4 m -98.24 163.86 2.5 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 175.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -63.5 130.26 43.62 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 122.632 0.373 . . . . 0.0 110.961 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -56.62 -39.45 73.63 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 123.461 0.704 . . . . 0.0 110.451 177.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -71.47 -28.82 64.2 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.193 -176.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.544 ' O ' HG12 ' A' ' 27' ' ' ILE . 59.3 tp -71.48 -49.43 41.33 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.33 178.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.445 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 47.5 t -63.03 -42.3 96.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.6 ttp -57.19 -39.85 76.18 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.056 177.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -69.82 -41.64 74.72 Favored 'General case' 0 C--O 1.215 -0.729 0 O-C-N 123.292 0.37 . . . . 0.0 111.11 177.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.7 mm -56.87 -47.6 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 177.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 79.5 mt -66.58 -42.49 86.88 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.469 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.05 -43.28 96.01 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 123.27 0.628 . . . . 0.0 110.639 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -61.64 -44.22 97.38 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.833 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.2 pt -72.79 -35.06 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.855 177.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -60.7 -49.11 78.81 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 123.648 0.779 . . . . 0.0 110.719 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 pp -69.41 -28.89 66.55 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.972 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -76.29 -49.55 16.7 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.015 0.436 . . . . 0.0 111.951 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 43.2 tp -75.03 -55.27 5.91 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.756 -176.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 70.37 -79.81 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 125.91 1.684 . . . . 0.0 111.545 -177.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -92.39 -66.42 1.11 Allowed Glycine 0 N--CA 1.433 -1.553 0 C-N-CA 119.984 -1.103 . . . . 0.0 112.635 -176.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.8 t 174.14 145.84 0.06 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.66 0.784 . . . . 0.0 109.571 -174.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.5 t70 179.64 -86.45 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.643 1.177 . . . . 0.0 108.7 177.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -138.55 92.65 2.65 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.551 HG23 ' HG2' ' A' ' 71' ' ' GLN . 13.3 tt -72.35 -27.87 27.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.291 -176.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.588 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.2 ptmt -60.74 -36.42 78.85 Favored 'General case' 0 C--O 1.211 -0.921 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.274 177.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.8 m -69.84 -37.81 76.28 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.095 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.483 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 34.7 m -64.83 -40.69 95.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 175.424 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 41' ' ' ILE . 38.6 mm -55.46 -49.1 75.69 Favored 'Isoleucine or valine' 0 C--N 1.345 0.373 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 174.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.588 HG13 ' O ' ' A' ' 42' ' ' LYS . 78.4 mt -53.5 -50.84 46.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.702 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.483 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 15.5 m-85 -57.82 -43.39 85.73 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.79 0.805 . . . . 0.0 111.078 -176.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.0 t -73.95 -46.88 44.88 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.877 -175.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -69.74 -27.43 64.95 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 122.775 0.43 . . . . 0.0 111.86 -178.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.5 p -79.48 -22.33 44.22 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.7 t -95.08 -36.54 11.48 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.781 0.8 . . . . 0.0 109.89 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.614 ' O ' HG12 ' A' ' 56' ' ' ILE . 78.9 m-70 -92.54 42.41 1.1 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.018 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -48.82 -48.02 41.87 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 125.353 1.461 . . . . 0.0 114.403 -175.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -61.3 -45.62 93.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 120.874 0.368 . . . . 0.0 111.417 -174.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.487 ' CG ' HD21 ' A' ' 23' ' ' LEU . 1.7 mp0 -55.4 -53.12 60.2 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 123.879 0.871 . . . . 0.0 110.22 176.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 52' ' ' HIS . 34.3 mm -60.91 -47.04 95.19 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-N 113.727 -1.579 . . . . 0.0 111.289 -176.104 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -69.95 -28.22 65.39 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -72.59 -49.25 33.57 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.24 0.543 . . . . 0.0 111.168 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -118.93 60.34 0.81 Allowed 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 122.071 0.938 . . . . 0.0 109.742 -176.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -55.35 -37.63 67.74 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 113.466 -1.697 . . . . 0.0 112.487 -176.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.481 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER -78.44 -31.73 48.21 Favored 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -176.307 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -68.04 -51.15 50.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.479 ' HA ' HG12 ' A' ' 66' ' ' ILE . 84.9 m-85 -69.08 -31.25 69.86 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.064 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.44 -51.11 64.81 Favored 'General case' 0 C--O 1.245 0.834 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.104 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 72.8 mtm -65.43 -39.6 92.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.41 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 36.8 pt -66.93 -43.21 89.47 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 C-N-CA 118.367 -1.333 . . . . 0.0 111.024 177.423 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.14 -39.7 75.69 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.817 0.341 . . . . 0.0 110.756 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 14.0 tp10 -58.69 -56.2 25.23 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.607 176.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.5 mt -65.88 -39.62 85.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 123.985 0.914 . . . . 0.0 112.946 -176.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.608 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 96.6 mt -53.36 -46.98 69.8 Favored 'General case' 0 C--O 1.217 -0.614 0 C-N-CA 122.615 0.366 . . . . 0.0 111.445 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.551 ' HG2' HG23 ' A' ' 41' ' ' ILE . 44.4 mt-30 -72.53 -49.16 34.61 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 122.304 1.049 . . . . 0.0 109.784 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 68' ' ' GLU . 19.6 ttt180 -53.45 -42.03 66.74 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 127.194 2.197 . . . . 0.0 111.725 -176.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.545 ' OH ' ' HB2' ' A' ' 6' ' ' ASP . 55.6 m-85 -100.48 -14.36 18.3 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -178.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.608 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.71 -28.4 68.4 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.636 -0.826 . . . . 0.0 109.781 178.64 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -74.96 -19.45 60.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.511 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -97.79 -50.31 4.49 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -174.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.8 pt -118.73 -29.81 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.541 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 125.61 146.69 6.78 Favored Glycine 0 CA--C 1.5 -0.852 0 C-N-CA 120.299 -0.953 . . . . 0.0 110.893 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.3 tp -64.61 -38.72 83.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.972 0.386 . . . . 0.0 111.798 -175.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -59.22 -38.96 81.21 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.943 0.878 . . . . 0.0 110.133 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.448 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 1.8 m-20 -69.35 -48.57 60.97 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.354 -1.294 . . . . 0.0 109.774 -179.104 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.9 t -62.9 -43.09 98.71 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.294 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.581 -177.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.432 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 95.5 m-20 -56.46 -44.9 80.97 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.094 0.474 . . . . 0.0 110.778 178.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -40.36 90.48 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.2 mt -65.26 -40.26 93.73 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.336 179.055 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.5 mm -62.81 -43.64 98.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 177.27 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.554 ' O ' ' HG2' ' A' ' 91' ' ' LYS . 87.7 mt -59.69 -44.52 93.61 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.62 176.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.4 m -62.08 -34.22 75.87 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 121.233 0.539 . . . . 0.0 110.877 178.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 76.7 m -70.82 -31.91 68.79 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 123.177 0.591 . . . . 0.0 111.905 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.5 pt -92.97 -2.41 10.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.383 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 87' ' ' LEU . 29.8 mmmt -73.06 68.15 0.93 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.92 0.867 . . . . 0.0 113.044 176.137 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -129.41 126.52 38.99 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 104.82 -2.289 . . . . 0.0 104.82 172.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.431 ' C ' ' H ' ' A' ' 95' ' ' HIS . 34.0 tt0 -65.5 145.36 56.2 Favored 'General case' 0 C--N 1.297 -1.681 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.031 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 97' ' ' HIS . 44.5 m170 -78.97 35.64 0.26 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.321 0.581 . . . . 0.0 110.404 178.664 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.431 ' H ' ' C ' ' A' ' 93' ' ' GLU . 3.7 t60 -68.76 109.86 4.05 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 105.912 -1.885 . . . . 0.0 105.912 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 64.77 89.09 0.1 Allowed 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -166.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 94' ' ' HIS . 8.8 p80 -105.45 123.65 48.24 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -171.237 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 23.9 t60 -79.12 -15.45 58.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.937 0.875 . . . . 0.0 108.703 176.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 41.5 t-80 . . . . . 0 C--N 1.303 -1.446 0 N-CA-C 104.905 -2.257 . . . . 0.0 104.905 173.988 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 120.271 0.082 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.5 m -77.09 108.05 9.9 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.431 ' CG2' HD13 ' A' ' 85' ' ' LEU . 20.4 tt -142.79 -12.6 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.161 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.785 -177.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.24 -9.53 24.53 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.193 0.521 . . . . 0.0 111.491 178.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -66.86 -25.8 66.59 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 123.938 0.895 . . . . 0.0 109.818 177.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 13.8 t70 -75.76 128.17 84.15 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.601 -175.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.537 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 38.8 Cg_exo -62.38 -34.69 76.17 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.76 2.307 . . . . 0.0 113.206 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -76.21 -34.5 59.26 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.666 0.746 . . . . 0.0 109.598 -178.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -64.47 -41.36 96.55 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.63 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.27 -33.77 65.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 C-N-CA 120.595 -0.442 . . . . 0.0 109.962 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.3 mttt -61.05 -43.27 99.14 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 174.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.0 mt -56.64 -42.58 79.14 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.014 0.525 . . . . 0.0 111.245 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.1 mmt180 -59.47 -39.37 83.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.155 178.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -80.19 -30.99 38.82 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.262 -179.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -79.9 -46.46 16.76 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 123.837 0.855 . . . . 0.0 112.38 -175.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt 68.84 134.55 0.03 OUTLIER 'General case' 0 C--O 1.248 1.005 0 C-N-CA 124.397 1.079 . . . . 0.0 111.502 -177.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.489 ' H ' HG22 ' A' ' 90' ' ' ILE . . . -94.2 114.87 4.88 Favored Glycine 0 N--CA 1.414 -2.812 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 177.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.414 ' HD3' ' N ' ' A' ' 18' ' ' LYS . 3.6 mppt? -91.02 30.5 1.21 Allowed 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 122.547 1.165 . . . . 0.0 109.201 178.446 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.424 HG11 ' CE2' ' A' ' 63' ' ' TYR . 16.5 m -98.75 158.4 3.52 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.23 0 CA-C-N 113.946 -1.479 . . . . 0.0 109.543 -178.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.422 ' O ' HG23 ' A' ' 24' ' ' VAL . 49.7 t-20 -66.71 125.27 25.3 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -54.1 -37.42 64.27 Favored 'General case' 0 C--N 1.321 -0.658 0 O-C-N 123.955 0.785 . . . . 0.0 111.091 178.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -68.11 -36.62 80.04 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.137 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.64 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.3 tp -76.45 -39.13 54.2 Favored 'General case' 0 N--CA 1.416 -2.148 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.186 -177.39 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 20' ' ' ASN . 61.8 t -58.17 -48.07 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 176.379 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 48.4 ttp -58.29 -40.47 82.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.331 177.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -70.65 -36.2 73.28 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.396 178.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.64 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -58.93 -51.74 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 176.556 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 78.1 mt -60.66 -38.14 83.89 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.613 -179.326 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -71.15 -47.14 59.53 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.925 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.419 ' OE2' HG22 ' A' ' 48' ' ' VAL . 15.4 tt0 -63.46 -42.9 98.63 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.375 -176.563 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.4 HG21 HD13 ' A' ' 45' ' ' ILE . 32.5 pt -68.67 -37.63 77.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.696 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.931 177.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.37 -52.5 65.38 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 123.203 0.601 . . . . 0.0 111.48 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.98 -29.26 69.62 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.208 -177.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -76.21 -46.91 26.05 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.004 0.43 . . . . 0.0 110.476 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 20.7 tp -60.99 -60.51 3.68 Favored 'General case' 0 C--O 1.253 1.243 0 C-N-CA 124.223 1.009 . . . . 0.0 112.451 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 66.22 -51.02 0.42 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.741 1.217 . . . . 0.0 112.171 -173.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 147.78 -26.75 1.47 Allowed Glycine 0 C--N 1.296 -1.656 0 N-CA-C 108.336 -1.906 . . . . 0.0 108.336 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.3 p -75.15 -43.33 53.03 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 114.243 -0.979 . . . . 0.0 112.624 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -91.61 -162.66 0.94 Allowed 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -176.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.484 ' HB3' ' OG1' ' A' ' 43' ' ' THR . 28.4 t-20 -107.9 127.54 53.83 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-N 118.807 0.73 . . . . 0.0 109.227 -175.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.52 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.4 tt -63.0 -35.59 72.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 O-C-N 123.481 0.488 . . . . 0.0 111.73 -178.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.476 ' O ' HG13 ' A' ' 46' ' ' ILE . 65.2 pttt -69.28 -28.41 66.27 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.836 -178.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.484 ' OG1' ' HB3' ' A' ' 40' ' ' ASN . 26.0 m -71.33 -43.8 66.33 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.353 -0.84 . . . . 0.0 108.966 177.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.4 m -59.52 -40.61 87.68 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.092 176.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 41' ' ' ILE . 26.7 mm -51.66 -45.66 37.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.948 0.899 . . . . 0.0 110.108 175.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 42' ' ' LYS . 70.2 mt -56.85 -51.8 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.441 -177.244 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -60.57 -43.86 96.83 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.432 0.634 . . . . 0.0 110.871 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.419 HG22 ' OE2' ' A' ' 30' ' ' GLU . 46.6 t -69.15 -45.96 78.79 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.023 -174.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -68.05 -37.94 81.9 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.259 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 75.7 p -70.51 -21.46 62.74 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.119 0.485 . . . . 0.0 112.033 -178.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.3 t -92.86 -48.14 6.69 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.972 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.477 ' O ' HG12 ' A' ' 56' ' ' ILE . 86.2 m-70 -96.15 41.07 1.11 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 -174.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 85.6 mt -47.66 -41.32 22.04 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.679 1.592 . . . . 0.0 114.386 -175.414 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -53.56 -52.93 58.16 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.556 0.535 . . . . 0.0 112.431 -172.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -73.56 -34.06 64.97 Favored 'General case' 0 C--O 1.249 1.063 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.263 -176.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.521 ' HA ' ' CD2' ' A' ' 63' ' ' TYR . 40.1 mm -59.4 -43.45 90.37 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.66 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 50.1 mtp180 -70.84 -28.09 64.34 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -60.71 -55.83 28.57 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-O 121.676 0.75 . . . . 0.0 110.447 174.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.3 m-80 -116.14 60.88 0.72 Allowed 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.514 -174.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -56.94 -36.65 70.49 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.544 -178.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -65.22 -39.47 92.81 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.682 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -64.6 -51.49 62.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.8 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.521 ' CD2' ' HA ' ' A' ' 56' ' ' ILE . 68.7 m-85 -68.72 -34.13 75.11 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -177.266 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -70.21 -45.49 66.48 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.858 0.361 . . . . 0.0 110.103 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.1 mtm -67.56 -41.74 83.74 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.244 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.513 HG12 ' HA ' ' A' ' 63' ' ' TYR . 43.7 pt -65.02 -35.96 76.69 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.013 0 C-N-CA 118.695 -1.202 . . . . 0.0 111.131 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.54 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -55.67 -44.56 77.38 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 123.409 0.443 . . . . 0.0 111.734 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -74.06 -37.96 64.09 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.375 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 90.3 mt -65.4 -42.42 93.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.543 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.609 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.6 mt -54.59 -46.13 73.73 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.728 178.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 64.2 mt-30 -62.34 -52.22 64.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.629 0.728 . . . . 0.0 109.828 179.232 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -58.9 -52.75 64.38 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.364 1.465 . . . . 0.0 112.403 -174.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -83.99 -22.54 31.34 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -175.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.609 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.98 -30.79 71.0 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 118.993 -1.083 . . . . 0.0 109.709 176.814 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -73.89 -19.84 60.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.943 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -99.66 -51.28 3.79 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.0 pt -113.95 -29.66 2.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.053 0.454 . . . . 0.0 111.803 -174.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.497 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 122.71 146.97 7.32 Favored Glycine 0 CA--C 1.491 -1.419 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 178.111 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tp -63.09 -35.91 73.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.938 0.369 . . . . 0.0 111.063 -175.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -55.36 -46.8 76.43 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-O 121.255 0.55 . . . . 0.0 110.729 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.466 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.0 t-20 -63.71 -49.49 72.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.237 -177.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 78' ' ' GLY . 20.6 t -62.59 -45.87 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.712 -175.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -53.83 -43.65 69.62 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.284 0.564 . . . . 0.0 111.26 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -44.46 78.59 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.245 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 84.6 mt -62.46 -38.07 88.39 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.637 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.475 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.4 mm -61.79 -41.94 92.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.09 -41.44 99.41 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.175 178.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.9 m -61.13 -34.29 74.74 Favored 'General case' 0 CA--C 1.555 1.161 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.985 176.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.441 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 36.5 m -63.4 -39.46 94.56 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 123.205 0.602 . . . . 0.0 111.453 -176.298 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.489 HG22 ' H ' ' A' ' 17' ' ' GLY . 27.1 pt -91.35 -8.6 10.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-O 121.259 0.552 . . . . 0.0 111.748 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -98.44 27.74 4.57 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.723 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 89' ' ' THR . 0.7 OUTLIER -74.84 67.5 1.64 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 122.838 1.304 . . . . 0.0 111.142 172.608 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -85.03 123.23 30.33 Favored 'General case' 0 C--N 1.292 -1.892 0 CA-C-N 114.051 -1.431 . . . . 0.0 110.684 -175.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -58.49 120.29 8.55 Favored 'General case' 0 CA--C 1.517 -0.316 0 O-C-N 124.146 0.904 . . . . 0.0 110.605 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -101.14 81.62 2.25 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.423 -175.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 51.2 m80 -155.66 144.76 20.73 Favored 'General case' 0 CA--C 1.487 -1.48 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 172.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -140.35 78.04 1.64 Allowed 'General case' 0 C--N 1.285 -2.222 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -169.78 128.26 0.93 Allowed 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 . . . . . 0 C--N 1.305 -1.35 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 174.966 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.3 mmm . . . . . 0 CA--C 1.498 -1.036 0 CA-C-O 121.39 0.614 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.4 m -122.82 117.71 26.28 Favored 'General case' 0 C--N 1.287 -2.152 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 175.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.445 ' O ' HG12 ' A' ' 3' ' ' ILE . 14.2 tt -83.64 33.36 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.355 0 CA-C-O 123.548 1.642 . . . . 0.0 111.11 -173.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 93.4 mt -88.13 13.34 11.48 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.356 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -69.61 -22.21 63.52 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.638 1.575 . . . . 0.0 109.406 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.462 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 18.2 t70 -113.61 131.04 23.21 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.088 -0.96 . . . . 0.0 113.03 -174.332 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.493 ' HA ' HG12 ' A' ' 10' ' ' VAL . 31.8 Cg_exo -61.97 -29.92 82.64 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.72 2.947 . . . . 0.0 113.95 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.98 -45.63 63.72 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -177.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -61.1 -44.83 96.76 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.313 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' A' ' 7' ' ' PRO . 9.2 p -62.62 -34.32 64.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 120.936 0.398 . . . . 0.0 110.65 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HE3' ' SD ' ' A' ' 65' ' ' MET . 55.8 mtmt -65.66 -43.26 89.9 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 122.221 -0.299 . . . . 0.0 110.697 173.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 94.9 mt -57.73 -38.63 75.63 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.117 0.484 . . . . 0.0 110.893 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -59.46 -40.52 87.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.426 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -80.2 -31.38 38.74 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.192 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.411 ' CE2' ' HB2' ' A' ' 62' ' ' PHE . 61.8 t80 -64.53 -26.82 68.59 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 125.145 1.378 . . . . 0.0 111.167 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 73.36 -47.92 0.67 Allowed 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.172 1.389 . . . . 0.0 112.209 177.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 132.71 -71.95 0.49 Allowed Glycine 0 N--CA 1.425 -2.054 0 C-N-CA 121.352 -0.451 . . . . 0.0 112.118 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.614 ' NZ ' ' HB2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER 60.11 32.28 20.9 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.533 1.133 . . . . 0.0 109.389 -173.085 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.407 HG21 HG21 ' A' ' 24' ' ' VAL . 29.3 m -120.55 168.55 12.82 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 CA-C-N 114.431 -1.259 . . . . 0.0 108.608 -178.15 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -86.06 128.4 34.86 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -57.08 -39.93 75.93 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 123.041 0.536 . . . . 0.0 111.998 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -72.56 -34.61 67.62 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -174.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.635 ' O ' HG12 ' A' ' 27' ' ' ILE . 38.5 tp -71.75 -41.92 67.86 Favored 'General case' 0 N--CA 1.425 -1.696 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.233 -177.392 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.447 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 91.0 t -66.18 -41.62 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 120.829 0.347 . . . . 0.0 110.098 178.317 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 50.7 ttp -61.23 -37.08 81.79 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.891 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -69.48 -40.62 76.95 Favored 'General case' 0 C--O 1.205 -1.239 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.545 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.635 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.6 mm -56.66 -47.17 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 94.1 mt -62.22 -44.79 95.77 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.996 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.92 -46.92 73.33 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.304 0.573 . . . . 0.0 110.503 -178.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -62.04 -40.84 97.09 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.102 -175.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.435 ' CD1' HD13 ' A' ' 70' ' ' LEU . 45.2 pt -72.98 -40.71 59.61 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.676 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.045 176.148 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.14 -49.7 76.17 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 122.98 0.512 . . . . 0.0 111.423 -178.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.47 -31.85 72.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.989 0.423 . . . . 0.0 111.154 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -75.35 -44.47 45.0 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 57.0 tp -50.21 -34.43 22.8 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.636 1.174 . . . . 0.0 112.807 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -69.63 -11.18 60.64 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -135.02 -8.02 1.92 Allowed Glycine 0 C--O 1.243 0.682 0 C-N-CA 120.169 -1.015 . . . . 0.0 113.201 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.6 t -87.55 -174.03 4.61 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 123.643 0.777 . . . . 0.0 109.141 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -94.05 -34.39 13.02 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -151.39 155.57 38.91 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -176.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.536 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.5 tt -67.98 -30.46 48.26 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 O-C-N 123.633 0.583 . . . . 0.0 110.628 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.459 ' O ' HG13 ' A' ' 46' ' ' ILE . 64.8 pttt -66.49 -34.61 78.31 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.668 178.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.2 m -64.25 -44.87 90.43 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 176.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.6 m -57.53 -41.66 81.33 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.643 176.098 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.0 mm -55.64 -44.78 78.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 123.476 0.71 . . . . 0.0 110.104 177.086 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 42' ' ' LYS . 68.3 mt -52.27 -51.05 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.372 0.669 . . . . 0.0 111.875 -178.178 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -63.72 -52.74 59.17 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.438 0.637 . . . . 0.0 110.716 -176.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.8 t -62.53 -43.4 98.35 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.039 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.414 ' CE2' ' HB3' ' A' ' 63' ' ' TYR . 2.1 m-85 -72.19 -31.51 65.96 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.286 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.425 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 29.2 t -73.78 -31.27 63.21 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.384 0.612 . . . . 0.0 109.377 177.182 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.6 t -73.51 -53.39 10.7 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.424 178.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.521 ' O ' HG12 ' A' ' 56' ' ' ILE . 78.8 m-70 -100.68 42.62 1.1 Allowed 'General case' 0 C--N 1.304 -1.394 0 O-C-N 122.034 -0.416 . . . . 0.0 110.642 -172.469 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 50' ' ' SER . 82.1 mt -48.61 -38.75 21.72 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.529 1.132 . . . . 0.0 113.022 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -53.24 -50.81 64.01 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.402 ' HG3' ' CE2' ' A' ' 63' ' ' TYR . 14.3 tp10 -75.2 -34.04 61.46 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.209 177.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 52' ' ' HIS . 42.5 mm -60.34 -42.46 90.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-O 120.969 0.414 . . . . 0.0 110.39 -178.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.475 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 34.2 ptt180 -71.63 -33.65 69.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.07 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.3 tttm -66.56 -50.41 63.21 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 123.208 0.603 . . . . 0.0 109.615 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -114.71 60.38 0.68 Allowed 'General case' 0 CA--C 1.48 -1.725 0 CA-C-O 122.168 0.985 . . . . 0.0 111.279 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.475 ' HE3' ' O ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -55.59 -37.63 68.33 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 113.627 -1.624 . . . . 0.0 112.267 -177.088 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -70.93 -41.26 71.4 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 120.698 0.285 . . . . 0.0 110.78 -178.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.436 ' O ' HG12 ' A' ' 66' ' ' ILE . 83.3 t80 -62.91 -51.48 66.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.125 -178.397 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.533 ' HA ' HG12 ' A' ' 66' ' ' ILE . 93.4 m-85 -73.47 -24.69 60.23 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -177.097 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -72.93 -50.09 25.6 Favored 'General case' 0 C--O 1.265 1.902 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.475 ' SD ' ' HE3' ' A' ' 11' ' ' LYS . 79.2 mtm -65.37 -47.93 74.69 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.421 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.533 HG12 ' HA ' ' A' ' 63' ' ' TYR . 48.5 pt -63.95 -34.5 68.81 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.525 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.69 -178.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.536 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.01 -45.47 79.08 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 123.125 0.266 . . . . 0.0 111.614 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.71 -34.3 58.16 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 118.67 -1.212 . . . . 0.0 111.789 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 65' ' ' MET . 85.0 mt -60.59 -45.08 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.214 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.619 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 87.3 mt -55.65 -45.64 77.61 Favored 'General case' 0 C--O 1.21 -1.021 0 C-N-CA 123.535 0.734 . . . . 0.0 110.89 179.741 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.536 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.7 mt-30 -68.86 -49.34 59.14 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 121.31 0.576 . . . . 0.0 110.566 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -61.86 -49.17 77.32 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 124.161 0.984 . . . . 0.0 111.817 -177.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.469 ' CE2' ' HD3' ' A' ' 76' ' ' LYS . 63.6 m-85 -82.38 -16.9 47.45 Favored 'General case' 0 N--CA 1.427 -1.581 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -177.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.619 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.46 -29.79 69.33 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 172.651 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -79.63 -44.11 21.57 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.904 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.469 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 65.7 tttm -72.85 -44.82 60.91 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.76 -25.92 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.589 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 122.05 141.36 6.02 Favored Glycine 0 C--N 1.311 -0.824 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 178.552 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.3 tp -61.06 -37.66 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 117.202 0.501 . . . . 0.0 112.061 -173.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -60.41 -43.73 96.41 Favored 'General case' 0 C--O 1.244 0.796 0 CA-C-O 122.136 0.969 . . . . 0.0 109.667 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.422 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 94.0 m-20 -67.66 -40.39 84.49 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.729 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.5 t -66.52 -41.42 88.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.428 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.9 OUTLIER -52.43 -49.58 64.27 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 121.218 0.532 . . . . 0.0 110.199 177.559 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -44.9 92.09 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.401 -177.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.7 mt -66.18 -35.96 81.83 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.8 mm -65.53 -41.64 91.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 175.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 94.8 mt -63.34 -40.1 96.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.98 176.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 94.3 m -59.07 -33.61 71.0 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 123.859 0.864 . . . . 0.0 110.914 176.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.4 m -69.14 -48.29 62.77 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.94 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.2 pt -76.1 -24.21 16.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-O 121.037 0.446 . . . . 0.0 112.061 -178.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.646 ' HE2' ' HA ' ' A' ' 91' ' ' LYS . 9.3 mmpt? -83.13 -6.94 59.67 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 175.184 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.486 ' CD1' ' H ' ' A' ' 93' ' ' GLU 0.451 1.0 OUTLIER 42.43 -101.96 0.04 OUTLIER 'General case' 0 C--O 1.247 0.944 0 N-CA-C 117.115 2.265 . . . . 0.0 117.115 178.465 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.486 ' H ' ' CD1' ' A' ' 92' ' ' LEU . 71.6 mm-40 -80.84 89.85 5.85 Favored 'General case' 0 N--CA 1.425 -1.716 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -176.078 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -169.53 25.87 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 177.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 22.9 t-80 -132.77 102.3 5.61 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.69 0.757 . . . . 0.0 111.874 -177.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -129.08 143.44 50.86 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 175.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -104.92 -40.96 5.75 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.014 -1.074 . . . . 0.0 111.84 -174.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -152.1 107.52 3.31 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.155 0.502 . . . . 0.0 112.232 177.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 . . . . . 0 C--N 1.305 -1.367 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 175.034 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtm . . . . . 0 C--O 1.25 1.079 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.3 t 66.84 -84.94 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 124.713 1.205 . . . . 0.0 111.922 174.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.468 HG21 HD13 ' A' ' 85' ' ' LEU . 18.8 tt -138.43 -12.01 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-O 120.818 0.342 . . . . 0.0 111.862 -175.762 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.0 mt -74.05 -1.64 20.91 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.459 0.647 . . . . 0.0 111.563 -177.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -84.27 -11.16 56.92 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.765 -178.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.401 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 4.8 t70 -92.67 133.32 29.57 Favored Pre-proline 0 C--N 1.313 -1.016 0 C-N-CA 119.901 -0.72 . . . . 0.0 112.725 -170.664 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -65.57 -28.92 52.84 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.624 2.216 . . . . 0.0 112.522 175.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -74.84 -39.32 61.67 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 121.765 -0.584 . . . . 0.0 109.425 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -65.51 -44.04 88.22 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.143 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.07 -34.71 70.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 121.195 0.521 . . . . 0.0 110.14 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.4 mtmp? -67.83 -36.95 81.26 Favored 'General case' 0 C--O 1.198 -1.64 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.165 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.9 mt -59.29 -40.46 86.22 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.778 0.263 . . . . 0.0 111.337 176.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -61.37 -41.18 96.66 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.273 0.559 . . . . 0.0 111.644 177.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -79.71 -27.24 40.67 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.961 -178.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -82.31 -59.28 2.6 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.871 -176.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.1 mttt 68.26 155.31 0.11 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.835 0.854 . . . . 0.0 111.609 -174.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -114.18 144.84 18.4 Favored Glycine 0 N--CA 1.424 -2.148 0 C-N-CA 119.377 -1.392 . . . . 0.0 112.523 -175.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -94.53 32.15 1.64 Allowed 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 122.089 0.947 . . . . 0.0 108.561 176.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.465 HG21 HG21 ' A' ' 24' ' ' VAL . 19.7 m -88.49 164.5 2.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.049 0 CA-C-N 113.631 -1.622 . . . . 0.0 111.059 -176.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -85.76 119.72 26.4 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 171.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -54.62 -35.96 63.99 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 123.486 0.491 . . . . 0.0 111.552 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -70.22 -35.0 73.57 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-O 121.252 0.548 . . . . 0.0 109.964 -176.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.602 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.1 tp -76.83 -42.32 40.75 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.16 -177.495 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.526 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 62.9 t -61.2 -43.6 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.8 ttp -60.52 -33.68 72.99 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.236 178.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -75.4 -38.86 59.64 Favored 'General case' 0 C--O 1.206 -1.212 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.613 176.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.2 mm -56.99 -52.39 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 121.331 0.586 . . . . 0.0 110.161 -179.74 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.552 ' HB2' ' OD1' ' A' ' 83' ' ' ASN . 3.2 pp -71.4 -30.57 66.25 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.582 -178.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -68.38 -44.37 75.3 Favored 'General case' 0 C--N 1.299 -1.587 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.019 176.075 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.19 -38.19 90.16 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.75 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.6 pt -70.15 -41.43 78.97 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.188 176.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.451 ' OE1' ' HG2' ' A' ' 80' ' ' GLU . 37.2 tt0 -59.13 -54.45 46.82 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.013 0.925 . . . . 0.0 111.383 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -63.63 -34.52 78.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -178.271 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.48 ' N ' HD12 ' A' ' 33' ' ' LEU . 18.4 t0 -76.28 -40.73 50.94 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.139 -178.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.9 tp -61.04 -23.6 65.56 Favored 'General case' 0 C--O 1.249 1.059 0 C-N-CA 124.776 1.231 . . . . 0.0 111.792 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -53.11 -24.87 11.33 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.996 0.518 . . . . 0.0 111.338 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.49 -87.16 0.1 Allowed Glycine 0 N--CA 1.434 -1.482 0 O-C-N 123.533 0.521 . . . . 0.0 112.599 179.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 51.8 m -162.17 -5.23 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -175.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -79.24 -163.22 0.47 Allowed 'General case' 0 C--O 1.251 1.144 0 CA-C-N 119.432 1.015 . . . . 0.0 112.616 -174.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.514 ' ND2' ' HE2' ' A' ' 42' ' ' LYS . 29.4 t-20 -113.68 144.48 42.87 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -173.286 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.568 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.5 tt -57.78 -36.7 56.18 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.037 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.514 ' HE2' ' ND2' ' A' ' 40' ' ' ASN . 58.6 pttt -61.75 -33.7 74.52 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.19 0.519 . . . . 0.0 110.445 175.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.4 m -74.55 -41.65 60.21 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.235 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.401 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 12.8 m -58.45 -40.77 83.5 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.835 175.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.568 HG12 ' O ' ' A' ' 41' ' ' ILE . 32.8 mm -54.34 -46.92 69.71 Favored 'Isoleucine or valine' 0 C--N 1.349 0.555 0 C-N-CA 123.815 0.846 . . . . 0.0 110.256 176.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 42' ' ' LYS . 71.8 mt -52.13 -51.43 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 123.481 0.712 . . . . 0.0 111.789 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.401 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 25.1 m-85 -59.73 -53.26 60.09 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.676 0.75 . . . . 0.0 110.971 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.1 t -66.83 -41.91 88.42 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.665 -174.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -68.86 -38.98 80.1 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.314 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.4 t -69.96 -26.71 64.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.417 0.627 . . . . 0.0 110.292 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.8 t -82.31 -48.21 11.46 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-O 121.341 0.591 . . . . 0.0 110.696 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.487 ' O ' HG12 ' A' ' 56' ' ' ILE . 73.9 m-70 -101.19 40.9 1.23 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.73 -174.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 89.5 mt -47.04 -39.87 13.71 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.332 1.453 . . . . 0.0 113.893 -177.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -54.14 -50.79 66.12 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -175.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -73.07 -35.79 66.74 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 120.991 0.424 . . . . 0.0 109.861 -178.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 52' ' ' HIS . 43.6 mm -58.58 -51.16 75.08 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.165 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.915 -179.138 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -77.47 -16.09 58.95 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -74.99 -48.56 23.57 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -116.83 53.55 0.89 Allowed 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.073 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -57.23 -39.96 76.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.012 -0.995 . . . . 0.0 113.408 -174.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -62.03 -37.27 84.31 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.268 0.556 . . . . 0.0 110.957 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -69.01 -49.3 58.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.897 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.544 ' HA ' HG12 ' A' ' 66' ' ' ILE . 72.9 m-85 -68.31 -33.45 74.34 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.298 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.19 -48.12 82.99 Favored 'General case' 0 C--O 1.254 1.339 0 CA-C-O 121.209 0.528 . . . . 0.0 109.882 177.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.421 ' O ' ' HB3' ' A' ' 68' ' ' GLU . 79.2 mtm -68.9 -45.8 69.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.82 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.545 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.6 pt -69.23 -37.86 76.79 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.448 0 C-N-CA 119.014 -1.075 . . . . 0.0 112.968 -177.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.12 -38.39 76.41 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.427 0.632 . . . . 0.0 109.815 177.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 65' ' ' MET . 19.3 tp10 -63.51 -56.38 16.48 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.27 176.191 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.6 mt -59.47 -39.08 78.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.208 0.603 . . . . 0.0 112.498 -178.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.8 mt -53.98 -50.95 65.4 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 122.658 0.383 . . . . 0.0 111.771 178.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -70.84 -49.4 46.65 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 122.241 1.02 . . . . 0.0 109.385 -178.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.417 ' HD2' ' OE2' ' A' ' 68' ' ' GLU . 29.0 ttt180 -54.93 -38.95 68.34 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 127.655 2.382 . . . . 0.0 111.797 -177.047 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.401 ' OH ' ' HB2' ' A' ' 6' ' ' ASP 0.257 28.6 m-85 -99.83 -14.69 18.69 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -178.652 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.436 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.26 -26.58 66.64 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 174.374 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -78.13 -17.87 56.36 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.653 176.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.418 ' HE2' ' HB3' ' A' ' 76' ' ' LYS . 52.8 mtpt -99.93 -51.57 3.67 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.389 0.614 . . . . 0.0 112.307 179.209 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.4 pt -117.37 -27.23 2.45 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.072 -173.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 116.83 148.66 8.95 Favored Glycine 0 N--CA 1.434 -1.46 0 C-N-CA 120.297 -0.954 . . . . 0.0 111.076 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.41 HD13 ' CD1' ' A' ' 41' ' ' ILE . 5.5 tp -59.71 -42.41 88.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -175.305 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.451 ' HG2' ' OE1' ' A' ' 32' ' ' GLU . 41.6 mt-10 -64.59 -35.85 82.34 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 121.151 0.5 . . . . 0.0 111.56 -176.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -64.51 -47.3 79.4 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.552 174.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.7 t -63.83 -42.32 95.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.08 -178.438 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.552 ' OD1' ' HB2' ' A' ' 28' ' ' LEU . 95.3 m-20 -51.92 -47.93 64.44 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.513 0.725 . . . . 0.0 111.307 177.457 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -45.02 76.92 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.295 -0.866 . . . . 0.0 108.868 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.468 HD13 HG21 ' A' ' 3' ' ' ILE . 95.7 mt -61.98 -39.59 92.72 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.9 mm -63.56 -40.2 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 120.915 0.388 . . . . 0.0 109.958 177.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 92.6 mt -64.35 -37.09 86.28 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.801 0.81 . . . . 0.0 109.467 177.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.449 HG23 HD23 ' A' ' 92' ' ' LEU . 86.4 m -66.05 -34.31 77.78 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.59 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 m -64.48 -40.9 96.55 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 120.822 0.344 . . . . 0.0 110.508 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.0 pt -92.75 -34.34 5.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -177.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -126.42 38.99 4.02 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 118.978 -1.089 . . . . 0.0 112.488 -174.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.449 HD23 HG23 ' A' ' 88' ' ' THR . 37.2 tp -165.19 79.54 0.33 Allowed 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 170.432 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -116.95 131.7 56.89 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.02 -173.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -126.81 3.59 6.66 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.025 0.916 . . . . 0.0 108.912 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.2 m80 -145.06 104.36 3.96 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -177.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 22.4 p80 -121.32 102.3 8.19 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -176.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 71.95 -39.28 0.44 Allowed 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.432 1.893 . . . . 0.0 113.465 172.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 63.2 t60 72.43 -55.99 0.66 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.857 1.663 . . . . 0.0 111.308 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 . . . . . 0 C--N 1.284 -2.25 0 N-CA-C 106.223 -1.769 . . . . 0.0 106.223 179.751 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.5 mtt . . . . . 0 CA--C 1.511 -0.552 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.6 p -154.31 -85.55 0.06 Allowed 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 121.041 0.448 . . . . 0.0 111.284 -179.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.519 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 20.3 tt 179.34 -21.56 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 124.39 1.076 . . . . 0.0 108.525 -178.144 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -67.82 -6.98 24.07 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-O 121.805 0.812 . . . . 0.0 110.589 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -72.36 -30.96 65.19 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 125.037 1.335 . . . . 0.0 109.773 178.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -87.19 127.56 58.74 Favored Pre-proline 0 C--O 1.249 1.057 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.773 -173.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.492 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 39.4 Cg_exo -61.87 -28.03 80.86 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.165 2.576 . . . . 0.0 113.664 -179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 9.4 mm-40 -72.23 -32.21 66.53 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.586 -176.403 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -66.86 -44.11 81.83 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.349 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.8 p -67.44 -34.21 67.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-O 121.269 0.557 . . . . 0.0 109.859 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.506 ' O ' ' HD1' ' A' ' 15' ' ' PHE . 68.5 mttm -62.37 -42.65 99.58 Favored 'General case' 0 C--O 1.207 -1.17 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.731 174.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 92.9 mt -58.62 -34.97 71.76 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.586 0.231 . . . . 0.0 111.564 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.4 mmm180 -63.86 -32.02 73.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.117 0.484 . . . . 0.0 110.416 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -79.65 -36.97 36.98 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.356 177.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.506 ' HD1' ' O ' ' A' ' 11' ' ' LYS . 24.3 m-85 -62.49 -36.33 82.17 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 173.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt 74.0 -34.51 0.28 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.876 1.671 . . . . 0.0 112.479 175.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.41 -80.46 0.3 Allowed Glycine 0 N--CA 1.423 -2.232 0 C-N-CA 120.438 -0.887 . . . . 0.0 113.598 175.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? 59.71 31.58 20.94 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.148 0.975 . . . . 0.0 108.842 -171.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 m -117.29 169.46 7.71 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 CA-C-N 113.685 -1.598 . . . . 0.0 108.991 -175.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.43 ' O ' HG23 ' A' ' 24' ' ' VAL . 48.7 t-20 -86.91 113.14 22.44 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 106.533 -1.654 . . . . 0.0 106.533 173.004 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -53.09 -36.88 61.18 Favored 'General case' 0 C--N 1.314 -0.958 0 O-C-N 123.657 0.598 . . . . 0.0 111.166 179.393 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -74.49 -35.17 63.23 Favored 'General case' 0 CA--C 1.487 -1.478 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.646 -172.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.622 ' O ' HG12 ' A' ' 27' ' ' ILE . 25.0 tp -76.64 -39.08 53.44 Favored 'General case' 0 N--CA 1.418 -2.051 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.162 -178.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 20' ' ' ASN . 61.2 t -62.44 -40.91 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.1 ttp -59.65 -43.18 94.0 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.722 176.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -67.2 -38.28 85.06 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.911 177.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.75 -52.08 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 176.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.5 mt -62.02 -41.42 98.07 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.961 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -66.93 -47.29 72.14 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-O 121.436 0.636 . . . . 0.0 110.472 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -64.16 -40.79 96.88 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.907 -176.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.1 pt -70.09 -40.05 77.9 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.933 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.808 176.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.63 -50.21 74.68 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.076 0.95 . . . . 0.0 111.407 -178.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.424 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.3 pp -62.59 -34.09 76.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.184 -178.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 38' ' ' SER . 29.4 t70 -76.75 -50.26 14.01 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.728 176.071 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.0 tp -50.21 -38.85 42.17 Favored 'General case' 0 C--O 1.247 0.964 0 C-N-CA 125.258 1.423 . . . . 0.0 113.05 -176.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -48.61 -37.32 17.83 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 124.509 1.131 . . . . 0.0 111.377 -177.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -127.92 29.08 4.25 Favored Glycine 0 N--CA 1.439 -1.1 0 N-CA-C 111.54 -0.624 . . . . 0.0 111.54 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 34' ' ' ASP . 6.8 t -120.97 -29.9 4.5 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 -178.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.7 t70 69.8 -51.22 0.63 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 125.704 1.601 . . . . 0.0 113.397 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -84.51 93.5 8.35 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-O 121.523 0.678 . . . . 0.0 110.757 177.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.53 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.8 tt -60.16 -24.05 29.27 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.231 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.328 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.415 ' O ' HG13 ' A' ' 46' ' ' ILE . 40.4 mtmt -56.68 -46.96 80.85 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.524 0.729 . . . . 0.0 109.764 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.6 m -71.65 -36.62 70.75 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 114.667 -1.151 . . . . 0.0 109.754 -179.027 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.5 m -61.4 -39.68 91.59 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.917 176.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 41' ' ' ILE . 35.7 mm -56.9 -48.75 80.9 Favored 'Isoleucine or valine' 0 C--N 1.351 0.637 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 42' ' ' LYS . 68.1 mt -52.93 -48.72 51.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 115.333 -0.848 . . . . 0.0 112.473 -177.404 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -60.96 -53.36 58.16 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.769 0.795 . . . . 0.0 110.312 -176.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.04 -46.04 94.96 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.634 -174.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -66.49 -37.7 85.65 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.32 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.9 t -71.81 -26.93 62.6 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-O 120.983 0.421 . . . . 0.0 110.775 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.2 t -81.79 -44.73 16.58 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.376 0.608 . . . . 0.0 109.97 178.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.494 ' O ' HG12 ' A' ' 56' ' ' ILE . 82.7 m-70 -102.14 38.97 1.55 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.349 -175.034 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 77.8 mt -47.64 -36.79 11.5 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 -177.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.547 ' O ' ' HD3' ' A' ' 58' ' ' LYS . 26.1 t70 -54.43 -51.55 64.58 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -176.526 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -73.55 -29.72 62.61 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.65 -177.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 52' ' ' HIS . 37.8 mm -64.19 -45.74 95.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.054 179.336 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -74.3 -32.71 62.98 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.537 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' A' ' 54' ' ' ASP . 2.1 mptm? -63.8 -43.44 96.27 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 120.769 0.319 . . . . 0.0 110.87 177.145 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -123.92 60.99 1.1 Allowed 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.864 0.84 . . . . 0.0 111.076 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -64.06 -25.88 68.31 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.156 -176.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -69.41 -52.16 29.5 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -59.41 -50.66 73.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.778 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.531 ' HA ' HG12 ' A' ' 66' ' ' ILE . 74.2 m-85 -67.05 -32.29 73.38 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.007 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -67.74 -44.94 76.38 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.17 0.51 . . . . 0.0 110.297 177.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 88.2 mtp -67.55 -45.8 74.61 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.694 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.533 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 48.0 pt -66.64 -36.36 77.06 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.566 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.681 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.78 -40.7 80.43 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.112 0.415 . . . . 0.0 110.424 178.012 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -62.71 -51.38 67.39 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.268 177.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 82.0 mt -63.64 -41.29 92.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.956 -178.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 86.5 mt -58.51 -48.71 79.92 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.85 0.46 . . . . 0.0 111.554 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.47 ' HG2' HG23 ' A' ' 41' ' ' ILE . 46.6 mt-30 -64.43 -48.7 74.33 Favored 'General case' 0 C--O 1.251 1.17 0 CA-C-O 122.192 0.996 . . . . 0.0 109.815 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -60.0 -45.7 91.88 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 113.833 -1.531 . . . . 0.0 110.905 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.519 ' CE2' ' HA ' ' A' ' 3' ' ' ILE 0.252 31.5 m-85 -91.81 -21.28 20.75 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -174.921 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -67.5 -31.19 71.15 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 118.37 -1.332 . . . . 0.0 108.543 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -74.26 -38.16 63.53 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.177 0.513 . . . . 0.0 110.141 176.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.5 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 87.1 tttt -75.66 -51.02 13.72 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.711 -175.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.5 pt -122.27 -30.7 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.154 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.542 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 127.58 143.8 5.8 Favored Glycine 0 C--N 1.315 -0.602 0 C-N-CA 120.347 -0.93 . . . . 0.0 111.997 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tp -60.87 -40.55 85.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -175.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -59.58 -39.6 84.66 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.678 0.752 . . . . 0.0 110.225 -178.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.498 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.3 m-20 -66.24 -50.26 64.38 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.291 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 78' ' ' GLY . 25.3 t -63.88 -38.34 82.1 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.885 -176.531 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 -52.94 -50.11 64.68 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.024 0.929 . . . . 0.0 109.715 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -39.47 80.6 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.009 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 91.7 mt -66.22 -38.4 87.86 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -178.117 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.7 mm -66.11 -39.44 84.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.06 -39.25 93.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.325 176.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 86.0 m -58.87 -34.03 71.15 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.426 0.69 . . . . 0.0 110.193 176.179 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 65.1 m -65.18 -45.94 82.83 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.825 -178.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.1 pt -84.99 -9.39 11.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.288 0.566 . . . . 0.0 112.095 -177.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -88.16 130.7 34.97 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.8 mt -69.15 -54.27 15.78 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 177.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 62.4 77.5 0.33 Allowed 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.858 -1.519 . . . . 0.0 112.201 178.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -124.59 126.52 45.92 Favored 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 173.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -79.36 150.02 31.52 Favored 'General case' 0 C--N 1.287 -2.148 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -176.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -81.07 91.82 6.15 Favored 'General case' 0 N--CA 1.432 -1.365 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 179.467 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 31.7 t-80 -60.41 124.45 20.37 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -178.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -144.1 139.45 28.89 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -175.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 . . . . . 0 C--N 1.3 -1.557 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 174.754 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.506 -0.749 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.9 m -79.64 105.51 10.99 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 121.176 0.513 . . . . 0.0 110.026 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 16.9 pt -64.04 88.4 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.453 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.26 12.98 27.08 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 116.011 -0.541 . . . . 0.0 112.177 -175.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -69.04 -39.46 79.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.708 0.765 . . . . 0.0 109.392 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.482 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 13.8 t70 -83.49 132.14 50.51 Favored Pre-proline 0 C--N 1.305 -1.333 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.324 -171.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 9.1 Cg_exo -72.16 -28.73 15.31 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.042 2.494 . . . . 0.0 113.19 178.298 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -76.23 -31.33 58.31 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 122.038 0.923 . . . . 0.0 109.052 -177.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -59.4 -43.06 93.05 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.512 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 7' ' ' PRO . 7.5 p -68.05 -33.8 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 C-N-CA 120.171 -0.611 . . . . 0.0 110.19 178.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.27 -38.09 79.24 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.868 0.365 . . . . 0.0 110.08 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.67 -38.72 90.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.689 176.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -61.9 -38.57 88.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.576 177.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -75.61 -28.19 58.76 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.915 178.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -68.69 -45.18 72.33 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.521 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt 73.61 169.67 0.31 Allowed 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.471 1.108 . . . . 0.0 110.725 177.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.91 72.78 0.68 Allowed Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 114.058 0.383 . . . . 0.0 114.058 -179.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -85.25 -12.04 53.44 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.936 0.874 . . . . 0.0 109.581 174.118 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.447 HG21 HG21 ' A' ' 24' ' ' VAL . 27.2 m -92.93 163.42 2.24 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.296 -176.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.474 ' O ' HG23 ' A' ' 24' ' ' VAL . 19.9 m120 -72.95 107.09 5.14 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.848 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -51.91 -48.29 64.25 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -68.56 -29.45 68.0 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-O 121.155 0.502 . . . . 0.0 110.341 -175.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.56 ' O ' HG12 ' A' ' 27' ' ' ILE . 32.7 tp -77.34 -41.83 38.97 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.934 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 20' ' ' ASN . 60.8 t -61.81 -43.96 98.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.539 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.4 ttp -56.37 -36.64 69.05 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.682 177.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -75.62 -38.44 58.98 Favored 'General case' 0 C--O 1.211 -0.942 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.221 177.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.56 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.8 mm -57.0 -50.62 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.359 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.459 ' HB3' ' CG ' ' A' ' 83' ' ' ASN . 86.3 mt -61.61 -42.92 99.57 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.325 -1.307 . . . . 0.0 110.273 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -62.05 -48.29 80.89 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.65 178.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -62.53 -39.89 95.02 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.516 -175.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.439 HG21 HD13 ' A' ' 45' ' ' ILE . 38.7 pt -73.54 -37.9 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.807 176.226 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.459 ' HG2' ' NH2' ' A' ' 36' ' ' ARG . 32.2 tt0 -59.54 -52.7 64.44 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.943 0.897 . . . . 0.0 110.844 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.414 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.4 pp -68.12 -28.6 67.47 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.086 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.414 ' N ' HD12 ' A' ' 33' ' ' LEU . 26.9 t70 -70.74 -44.02 67.65 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.011 0.434 . . . . 0.0 110.357 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.0 tt -70.24 -58.23 4.0 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 176.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.459 ' NH2' ' HG2' ' A' ' 32' ' ' GLU . 4.1 tpm_? 59.78 -71.75 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.58 1.952 . . . . 0.0 110.603 -177.304 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -161.37 -0.42 0.06 OUTLIER Glycine 0 N--CA 1.441 -0.974 0 C-N-CA 121.125 -0.56 . . . . 0.0 113.403 176.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.4 m -125.62 7.81 7.59 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 118.344 1.072 . . . . 0.0 113.384 -173.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -135.04 -166.19 1.79 Allowed 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 118.328 -1.349 . . . . 0.0 110.702 -176.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.445 ' HB3' ' OG1' ' A' ' 43' ' ' THR . 33.1 t-20 -110.66 138.69 46.73 Favored 'General case' 0 CA--C 1.498 -1.022 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 -174.239 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.514 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.0 tt -65.56 -38.41 82.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.472 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.536 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.5 ptmt -64.48 -32.64 74.36 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.356 -179.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.445 ' OG1' ' HB3' ' A' ' 40' ' ' ASN . 20.6 m -67.31 -45.77 75.51 Favored 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.7 m -61.24 -40.64 94.8 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.608 177.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.514 HG12 ' O ' ' A' ' 41' ' ' ILE . 30.1 mm -53.67 -44.3 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.904 0.881 . . . . 0.0 109.948 176.087 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 42' ' ' LYS . 77.2 mt -54.75 -52.46 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.87 -177.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.38 -46.07 90.3 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-O 121.35 0.595 . . . . 0.0 111.349 -176.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.54 -46.21 71.14 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.581 -172.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.404 ' HA ' HG13 ' A' ' 56' ' ' ILE . 4.2 m-30 -65.18 -38.81 91.71 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.232 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 82.9 p -73.81 -21.77 60.03 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.379 0.609 . . . . 0.0 111.692 -177.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.7 t -93.58 -20.33 20.32 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-O 121.1 0.476 . . . . 0.0 110.99 -178.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.522 ' O ' HG12 ' A' ' 56' ' ' ILE . 62.5 m-70 -123.8 39.27 4.0 Favored 'General case' 0 C--N 1.317 -0.805 0 O-C-N 121.804 -0.56 . . . . 0.0 109.738 -176.359 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 93.8 mt -49.32 -36.79 22.19 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -174.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -56.59 -51.51 68.34 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -176.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -73.14 -36.91 66.75 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 52' ' ' HIS . 42.4 mm -62.36 -49.3 84.48 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.648 -177.062 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -77.18 -26.58 53.07 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.254 0.55 . . . . 0.0 111.398 -175.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -71.41 -43.49 66.67 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.561 0.696 . . . . 0.0 109.681 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -116.32 46.54 1.57 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 114.909 -1.041 . . . . 0.0 108.479 -177.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -59.97 -32.64 71.01 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.561 -174.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -64.14 -43.36 95.44 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -66.07 -51.57 56.9 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.999 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.496 ' HA ' HG12 ' A' ' 66' ' ' ILE . 68.3 m-85 -67.82 -28.95 68.01 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -74.05 -44.47 54.11 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.467 177.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.8 mtm -65.07 -45.85 83.6 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.664 179.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.7 pt -63.38 -41.96 94.6 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.028 0 C-N-CA 119.519 -0.872 . . . . 0.0 111.912 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.524 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.88 -36.69 65.39 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.193 0.52 . . . . 0.0 111.433 -178.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.51 -54.9 10.37 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.602 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 78.9 mt -60.57 -40.73 85.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.146 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.1 mt -55.22 -46.89 75.95 Favored 'General case' 0 C--O 1.213 -0.854 0 C-N-CA 123.129 0.571 . . . . 0.0 111.436 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.524 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 63.2 mt-30 -69.33 -41.37 76.75 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.314 0.578 . . . . 0.0 110.15 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -59.97 -47.04 87.44 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.214 1.006 . . . . 0.0 110.308 -178.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -87.14 -15.51 38.18 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.494 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.81 -29.65 69.64 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 176.369 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -78.76 -28.11 44.76 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.404 176.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -90.18 -51.31 5.51 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -174.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.3 pt -121.47 -19.07 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -176.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.592 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 109.0 140.6 9.08 Favored Glycine 0 C--N 1.305 -1.188 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 178.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.404 HD13 HD12 ' A' ' 41' ' ' ILE . 7.2 tp -57.26 -40.47 73.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -174.023 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -57.69 -41.77 82.33 Favored 'General case' 0 C--O 1.251 1.142 0 CA-C-O 122.252 1.025 . . . . 0.0 109.993 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.524 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 49.0 m-80 -70.51 -43.53 69.45 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 113.971 -1.468 . . . . 0.0 111.379 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 78' ' ' GLY . 12.6 t -63.51 -46.21 95.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 O-C-N 123.231 0.332 . . . . 0.0 110.293 -177.709 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.459 ' CG ' ' HB3' ' A' ' 28' ' ' LEU . 95.1 m-20 -52.31 -47.06 66.17 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.818 0.699 . . . . 0.0 110.83 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -60.84 -41.33 95.61 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.378 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 65.7 mt -74.34 -31.24 62.36 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.368 -177.166 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.7 mm -63.2 -37.49 79.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 84.9 mt -63.31 -39.52 94.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.549 176.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 17.3 m -66.39 -33.67 76.23 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.556 0.693 . . . . 0.0 110.056 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 78.6 m -64.72 -48.62 73.98 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.102 -178.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 36.6 pt -80.0 -45.26 22.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.44 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -107.76 69.7 0.75 Allowed 'General case' 0 N--CA 1.407 -2.597 0 CA-C-O 122.205 1.002 . . . . 0.0 109.976 -178.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.88 -32.63 65.53 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 105.269 -2.122 . . . . 0.0 105.269 173.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 67.04 96.02 0.06 Allowed 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 112.858 -1.973 . . . . 0.0 111.925 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -121.71 83.75 2.14 Favored 'General case' 0 C--N 1.285 -2.201 0 N-CA-C 103.384 -2.821 . . . . 0.0 103.384 175.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -48.12 118.54 2.44 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -167.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 32.2 t60 -74.95 120.47 20.53 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 176.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 33.8 p-80 -73.39 120.02 18.43 Favored 'General case' 0 C--N 1.315 -0.925 0 O-C-N 123.401 0.438 . . . . 0.0 111.815 -177.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 80.0 t60 68.48 103.09 0.05 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.173 1.389 . . . . 0.0 112.699 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 . . . . . 0 C--N 1.305 -1.363 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 177.278 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 CA--C 1.507 -0.693 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 m -87.12 -176.29 5.64 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 19.7 pt -74.83 76.73 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.998 0.904 . . . . 0.0 112.01 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.5 mt -80.79 -5.05 56.68 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.594 -177.33 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.441 ' H ' ' CD ' ' A' ' 5' ' ' GLU . 1.9 mp0 -62.45 -24.69 67.58 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 124.281 1.032 . . . . 0.0 110.538 175.439 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -93.0 125.12 56.19 Favored Pre-proline 0 N--CA 1.435 -1.221 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.157 -175.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.526 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 26.8 Cg_exo -63.02 -34.67 69.65 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.652 2.235 . . . . 0.0 113.018 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 5.6 mm-40 -77.64 -30.13 52.05 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.309 0.576 . . . . 0.0 111.528 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -66.35 -38.71 88.23 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.762 176.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG12 ' O ' ' A' ' 7' ' ' PRO . 9.3 p -68.6 -33.43 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.817 177.11 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 7' ' ' PRO . 40.1 mmtm -55.04 -36.03 65.09 Favored 'General case' 0 C--N 1.361 1.104 0 CA-C-O 121.054 0.454 . . . . 0.0 110.038 173.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.34 -38.41 81.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.068 179.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -65.28 -32.89 74.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.569 0.699 . . . . 0.0 109.708 176.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -79.83 -23.93 41.68 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.079 177.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.482 ' CE1' ' HB2' ' A' ' 62' ' ' PHE . 47.9 t80 -79.14 -41.37 28.71 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 74.01 -174.3 0.14 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.863 1.265 . . . . 0.0 112.224 177.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -86.19 83.79 1.6 Allowed Glycine 0 N--CA 1.432 -1.6 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.804 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -97.47 13.98 28.01 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.717 0.77 . . . . 0.0 109.603 175.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.42 HG21 HG21 ' A' ' 24' ' ' VAL . 15.7 m -124.14 164.55 22.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-N 114.258 -1.337 . . . . 0.0 109.304 -174.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -78.78 118.64 21.03 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 173.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -55.37 -35.51 65.35 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 123.643 0.777 . . . . 0.0 111.657 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -74.24 -31.52 62.62 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.12 -174.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.607 ' O ' HG12 ' A' ' 27' ' ' ILE . 31.4 tp -76.48 -41.95 45.3 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.434 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.42 HG21 HG21 ' A' ' 19' ' ' VAL . 59.3 t -61.54 -42.17 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 176.725 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 38.1 ttm -55.61 -44.65 77.24 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 175.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -67.12 -40.84 86.9 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.133 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.2 mm -56.74 -52.03 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.402 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.05 -40.88 99.03 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.683 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -65.22 -49.02 71.3 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.418 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -60.95 -42.5 98.36 Favored 'General case' 0 C--O 1.246 0.891 0 C-N-CA 124.643 1.177 . . . . 0.0 110.471 -176.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.41 ' CD1' HD13 ' A' ' 70' ' ' LEU . 41.2 pt -72.69 -38.99 59.77 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.96 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.542 177.152 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -61.94 -48.72 79.12 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 123.523 0.729 . . . . 0.0 112.022 -176.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.408 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -69.89 -27.0 64.44 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.996 0.427 . . . . 0.0 111.711 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.408 ' N ' HD12 ' A' ' 33' ' ' LEU . 19.0 t70 -75.78 -43.4 46.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.286 0.565 . . . . 0.0 109.6 177.269 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.514 ' CD1' ' HA ' ' A' ' 38' ' ' SER . 58.6 tp -66.56 -59.94 3.18 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.885 -179.606 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 43.04 -83.5 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 127.198 2.199 . . . . 0.0 114.136 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.81 -25.83 64.33 Favored Glycine 0 C--N 1.346 1.113 0 N-CA-C 111.479 -0.648 . . . . 0.0 111.479 178.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.514 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 22.6 m 71.55 89.36 0.1 Allowed 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 172.596 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -122.61 -60.1 1.56 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.726 173.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -126.81 88.76 2.87 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.927 0.87 . . . . 0.0 111.056 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.633 HG23 ' HG2' ' A' ' 71' ' ' GLN . 6.7 tt -69.9 -28.5 36.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.065 -178.331 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.529 ' O ' HG13 ' A' ' 46' ' ' ILE . 60.4 pttt -56.49 -38.62 72.0 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-O 120.712 0.291 . . . . 0.0 111.142 176.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.0 m -69.55 -42.05 75.09 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.684 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.433 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 22.8 m -62.15 -38.19 88.06 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.496 176.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 41' ' ' ILE . 33.5 mm -56.55 -48.96 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.53 0.732 . . . . 0.0 110.055 176.303 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 42' ' ' LYS . 77.1 mt -52.89 -47.58 52.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.537 -177.068 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.433 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 23.9 m-85 -61.07 -53.36 58.1 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.661 0.744 . . . . 0.0 109.939 -175.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -64.77 -44.77 96.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-N 114.295 -1.321 . . . . 0.0 111.481 -174.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -63.41 -39.28 94.06 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.265 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.42 ' HA ' ' CD2' ' A' ' 53' ' ' LEU . 21.9 t -73.52 -21.82 60.28 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 120.677 0.275 . . . . 0.0 111.165 -179.392 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.1 t -94.1 -3.96 50.17 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.433 0.635 . . . . 0.0 110.333 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.544 ' O ' HG12 ' A' ' 56' ' ' ILE . 91.6 m-70 -140.48 37.47 1.86 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.42 ' CD2' ' HA ' ' A' ' 50' ' ' SER . 84.0 mt -47.62 -45.18 27.42 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -172.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -60.1 -48.94 79.62 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -172.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -67.38 -33.95 76.28 Favored 'General case' 0 C--O 1.245 0.819 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 52' ' ' HIS . 39.3 mm -63.94 -42.14 94.81 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.25 0 CA-C-N 115.19 -0.913 . . . . 0.0 108.969 178.181 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.476 ' NE ' ' HA ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -65.15 -50.05 67.51 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 123.351 0.661 . . . . 0.0 111.06 -177.386 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -57.75 -33.78 68.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.461 -178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.437 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 30.6 m-80 -127.3 46.52 2.51 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -175.595 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -53.45 -36.6 61.77 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.774 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -71.32 -42.04 69.09 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.482 ' HB2' ' CE1' ' A' ' 15' ' ' PHE . 85.8 t80 -62.18 -49.6 75.14 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.895 178.487 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.497 ' HA ' HG12 ' A' ' 66' ' ' ILE . 61.5 m-85 -67.7 -32.89 73.85 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -178.013 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -69.2 -47.41 64.91 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.142 -0.623 . . . . 0.0 109.966 174.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.8 mtm -59.18 -46.54 88.13 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.92 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.535 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 37.9 pt -66.71 -41.03 87.44 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.974 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.231 178.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.18 -41.63 93.3 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.102 0.477 . . . . 0.0 110.191 179.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -58.71 -55.99 27.94 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.002 177.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.5 mt -61.8 -40.62 87.6 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.838 0 C-N-CA 124.173 0.989 . . . . 0.0 112.301 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 89.7 mt -55.8 -46.02 78.12 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.556 0.343 . . . . 0.0 111.321 177.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.633 ' HG2' HG23 ' A' ' 41' ' ' ILE . 44.7 mt-30 -69.99 -51.67 30.59 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.934 0.873 . . . . 0.0 109.792 179.295 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.8 ttt85 -54.84 -43.82 73.39 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 125.709 1.604 . . . . 0.0 111.506 -179.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -95.92 -14.87 22.77 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 115.601 1.704 . . . . 0.0 115.601 -176.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.51 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -64.84 -31.45 72.69 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 174.058 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 71' ' ' GLN . 91.3 mttt -70.47 -46.25 64.13 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.05 177.203 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -76.66 -50.53 13.49 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -173.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.7 pt -121.23 -29.64 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -174.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.529 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.33 145.13 6.6 Favored Glycine 0 C--N 1.317 -0.488 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.8 tp -62.69 -39.26 84.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -175.218 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -62.83 -36.22 82.49 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-O 121.29 0.567 . . . . 0.0 111.808 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.576 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 16.3 m120 -65.54 -48.26 73.06 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.632 178.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 78' ' ' GLY . 19.5 t -64.42 -44.98 97.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.415 -177.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -50.82 -49.94 57.61 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.618 1.167 . . . . 0.0 110.137 179.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -43.31 79.48 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.604 -178.27 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 81.3 mt -64.85 -35.4 80.99 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.9 mm -64.97 -43.06 96.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.3 mt -62.0 -42.12 98.8 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.797 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.1 m -62.58 -32.16 73.1 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 123.911 0.885 . . . . 0.0 110.78 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.6 m -69.57 -43.95 71.82 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.279 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.7 pt -85.03 -41.6 15.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.518 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -98.87 115.04 27.95 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.14 79.06 2.96 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.898 0.856 . . . . 0.0 111.361 -179.339 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.47 ' CD ' ' HA ' ' A' ' 96' ' ' HIS . 8.2 tp10 -114.9 152.43 32.29 Favored 'General case' 0 N--CA 1.422 -1.842 0 CA-C-N 114.149 -1.387 . . . . 0.0 108.912 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -154.41 109.38 3.08 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -178.088 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 70.22 7.1 6.08 Favored 'General case' 0 N--CA 1.501 2.085 0 C-N-CA 124.246 1.018 . . . . 0.0 111.667 178.269 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.47 ' HA ' ' CD ' ' A' ' 93' ' ' GLU . 52.2 t-80 67.37 113.55 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.405 1.482 . . . . 0.0 111.513 -178.104 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -177.63 -25.63 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.222 -179.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -73.33 108.0 5.95 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.182 0.515 . . . . 0.0 112.115 -172.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 . . . . . 0 C--N 1.306 -1.319 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 177.849 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.3 t70 . . . . . 0 C--O 1.247 0.933 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.09 -23.69 62.37 Favored 'Trans proline' 0 CA--C 1.548 1.218 0 C-N-CA 123.804 3.002 . . . . 0.0 115.274 175.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.441 ' OE1' ' HG2' ' A' ' 65' ' ' MET . 32.8 mm-40 -65.14 -34.57 78.72 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.382 0.992 . . . . 0.0 109.917 179.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -67.36 -42.78 82.9 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.753 -177.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.487 ' O ' ' HG3' ' A' ' 14' ' ' GLN . 11.5 p -65.02 -34.59 71.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.123 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -65.69 -38.03 88.12 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.914 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.53 -44.58 93.15 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.503 0.668 . . . . 0.0 109.614 174.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -39.09 90.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.672 178.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.487 ' HG3' ' O ' ' A' ' 10' ' ' VAL . 26.4 mt-30 . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 122.73 0.412 . . . . 0.0 111.516 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.454 HG21 HG21 ' A' ' 24' ' ' VAL . 34.3 m . . . . . 0 N--CA 1.446 -0.64 0 CA-C-O 120.728 0.299 . . . . 0.0 110.773 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -76.69 113.25 14.12 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -58.31 -34.8 70.97 Favored 'General case' 0 C--N 1.308 -1.239 0 O-C-N 123.557 0.536 . . . . 0.0 110.607 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -74.94 -37.8 61.9 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.809 -173.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.554 ' O ' HG12 ' A' ' 27' ' ' ILE . 19.3 tp -77.44 -40.81 42.09 Favored 'General case' 0 N--CA 1.423 -1.817 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.747 -177.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.454 HG21 HG21 ' A' ' 19' ' ' VAL . 86.1 t -65.13 -39.1 84.44 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 59.9 ttp -57.86 -37.11 73.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.711 176.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -75.86 -40.13 55.27 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.431 177.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.554 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.4 mm -56.99 -51.75 64.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.05 -41.54 98.23 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-N 115.047 -0.978 . . . . 0.0 110.247 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -63.31 -45.12 92.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.412 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -62.9 -44.96 94.68 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.847 -175.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.515 ' CD1' HD13 ' A' ' 70' ' ' LEU . 46.0 pt -70.31 -37.01 69.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 119.875 -0.73 . . . . 0.0 109.74 176.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.19 -53.4 55.8 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 123.017 0.527 . . . . 0.0 111.223 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.47 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.1 pp -59.45 -33.69 71.59 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.47 ' N ' HD12 ' A' ' 33' ' ' LEU . 14.9 t70 -71.04 -47.89 55.94 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.3 tp . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 123.429 0.692 . . . . 0.0 112.266 -179.413 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.528 ' O ' HG12 ' A' ' 45' ' ' ILE . 14.4 tt . . . . . 0 N--CA 1.448 -0.546 0 CA-C-O 120.357 0.122 . . . . 0.0 110.892 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.522 ' HG2' ' OE1' ' A' ' 71' ' ' GLN . 42.7 mtmt -59.36 -48.67 80.75 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 177.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.1 m -65.21 -38.74 91.4 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.589 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.8 m -58.81 -41.09 85.96 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 120.863 0.363 . . . . 0.0 110.405 175.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.5 mm -58.77 -46.31 90.84 Favored 'Isoleucine or valine' 0 C--N 1.343 0.314 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 176.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 42' ' ' LYS . 67.6 mt -51.76 -49.61 35.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.208 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -61.14 -53.72 53.5 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.408 0.623 . . . . 0.0 110.71 -176.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 51.7 t -66.79 -42.82 89.82 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.891 -172.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -70.95 -37.63 72.82 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.44 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.533 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 36.2 t -73.47 -31.41 63.76 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.567 0.699 . . . . 0.0 109.798 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.3 t -73.54 -43.83 59.0 Favored 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.52 ' O ' HG12 ' A' ' 56' ' ' ILE . 68.9 m-70 -103.34 37.42 2.0 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 -176.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 50' ' ' SER . 80.0 mt -47.11 -41.66 17.7 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -57.46 -46.65 83.4 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.554 ' HA ' ' OE1' ' A' ' 55' ' ' GLU . 2.2 tp10 -74.58 -34.31 62.86 Favored 'General case' 0 N--CA 1.432 -1.325 0 C-N-CA 119.626 -0.83 . . . . 0.0 111.312 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 52' ' ' HIS . 47.1 mm -61.26 -45.28 98.92 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.174 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -71.76 -22.97 61.53 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.79 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.446 ' HB2' ' NZ ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -68.53 -52.72 28.95 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.641 ' HB2' ' CE2' ' A' ' 63' ' ' TYR . 16.9 m120 -112.53 52.66 0.77 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.8 pttp -60.7 -31.55 70.82 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -66.44 -47.53 72.86 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 121.457 0.646 . . . . 0.0 109.396 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -63.12 -51.5 66.27 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 114.412 -1.267 . . . . 0.0 110.714 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.641 ' CE2' ' HB2' ' A' ' 59' ' ' ASN . 79.0 m-85 -68.99 -26.44 65.02 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -176.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -71.23 -50.72 30.0 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.146 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.441 ' HG2' ' OE1' ' A' ' 8' ' ' GLU . 73.6 mtm -66.0 -43.27 88.2 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.54 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.555 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 46.2 pt -65.93 -41.71 90.44 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.634 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.195 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.26 -39.0 71.9 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 117.893 0.315 . . . . 0.0 110.909 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -64.33 -56.6 13.33 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 177.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 95.2 mt -56.63 -44.33 80.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.446 1.099 . . . . 0.0 112.514 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.561 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 82.5 mt -54.57 -50.45 67.95 Favored 'General case' 0 C--O 1.212 -0.876 0 C-N-CA 123.531 0.732 . . . . 0.0 111.826 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.522 ' OE1' ' HG2' ' A' ' 42' ' ' LYS . 46.3 mt-30 -70.16 -45.67 66.27 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 121.984 0.897 . . . . 0.0 109.917 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 46.4 ttt85 -57.91 -45.41 86.54 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 126.62 1.968 . . . . 0.0 111.319 -176.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -94.48 -16.54 23.26 Favored 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.561 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.23 -33.91 77.12 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.054 178.601 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -68.12 -25.61 65.38 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.384 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -99.38 -47.61 5.09 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.9 pt -115.88 -20.79 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -177.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 111.15 142.43 9.01 Favored Glycine 0 CA--C 1.501 -0.795 0 N-CA-C 110.999 -0.841 . . . . 0.0 110.999 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.416 HG13 ' ND2' ' A' ' 83' ' ' ASN . 10.2 tp -62.45 -37.43 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 117.203 0.502 . . . . 0.0 111.559 -174.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -53.19 -48.09 68.34 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.858 0.837 . . . . 0.0 109.455 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.436 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 85.4 m-20 -68.0 -42.97 79.91 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 113.787 -1.551 . . . . 0.0 112.204 -178.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 78' ' ' GLY . 16.8 t -65.49 -45.8 91.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.3 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.416 ' ND2' HG13 ' A' ' 79' ' ' ILE . 94.0 m-20 -56.64 -42.81 79.52 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.435 0.636 . . . . 0.0 111.075 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -45.7 86.84 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.9 mt -63.09 -36.28 83.06 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.632 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.6 mm -64.44 -41.08 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.7 mt -62.41 -38.74 90.84 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-O 121.363 0.601 . . . . 0.0 110.558 176.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.4 m -64.91 -33.44 76.02 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.473 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 29.5 m -72.1 -31.7 66.3 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.488 0.715 . . . . 0.0 111.479 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.6 pt . . . . . 0 C--N 1.316 -0.858 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.621 -178.829 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.401 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 14.3 t70 . . . . . 0 C--O 1.243 0.745 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.441 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 13.9 Cg_exo -70.82 -31.53 15.65 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.665 2.243 . . . . 0.0 113.088 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.67 -35.95 57.61 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -61.32 -42.72 99.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.434 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.73 -34.26 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 CA-C-O 121.055 0.455 . . . . 0.0 109.988 178.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 63.5 mttp -63.08 -37.02 85.54 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 174.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.5 mt -63.31 -37.33 86.82 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.115 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.465 HH11 ' HA ' ' A' ' 89' ' ' THR . 24.9 tpt180 -67.5 -35.25 78.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.362 0.601 . . . . 0.0 109.76 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.084 178.474 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 30.1 m . . . . . 0 N--CA 1.44 -0.927 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -81.16 119.63 23.83 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 174.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CE1' HD22 ' A' ' 87' ' ' LEU . 86.2 t80 -53.25 -47.89 68.68 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.683 0.615 . . . . 0.0 111.692 -179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -59.15 -36.01 74.51 Favored 'General case' 0 CA--C 1.497 -1.09 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.173 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.599 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.2 tp -76.51 -42.62 42.68 Favored 'General case' 0 N--CA 1.419 -2.006 0 C-N-CA 119.441 -0.904 . . . . 0.0 111.248 -178.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.603 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 65.0 t -59.22 -44.71 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 118.205 0.457 . . . . 0.0 109.874 177.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 52.1 ttp -58.76 -38.03 77.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.991 177.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -72.69 -38.59 67.52 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.123 176.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.599 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.1 mm -57.25 -49.61 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 66.8 mt -63.96 -35.23 79.99 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.743 -1.117 . . . . 0.0 110.496 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.73 -44.64 63.77 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 124.139 0.976 . . . . 0.0 110.092 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.568 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 17.3 tt0 -69.7 -39.5 76.88 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.759 -177.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.432 HG21 HD13 ' A' ' 45' ' ' ILE . 41.7 pt -68.34 -37.05 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 119.832 -0.747 . . . . 0.0 109.185 176.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -58.73 -46.28 87.75 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.589 0.555 . . . . 0.0 111.086 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 30' ' ' GLU . 4.4 pp -63.88 -32.85 74.52 Favored 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -177.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.53 -48.74 18.41 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.364 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.42 HD13 ' HB ' ' A' ' 41' ' ' ILE . 51.8 tp . . . . . 0 CA--C 1.517 -0.309 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.748 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.552 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.8 tt . . . . . 0 C--O 1.224 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 111.333 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -63.21 -34.36 77.48 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.925 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.9 m -79.24 -33.86 43.22 Favored 'General case' 0 N--CA 1.419 -2.007 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.403 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 15.3 m -59.59 -41.26 89.89 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.571 176.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 41' ' ' ILE . 43.1 mm -53.76 -48.87 60.57 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.853 176.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 69.6 mt -53.5 -49.12 56.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.228 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.403 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 20.0 m-85 -63.63 -53.01 58.15 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.124 0.487 . . . . 0.0 110.417 -176.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.3 t -60.29 -46.03 95.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.449 -174.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -65.7 -37.54 86.74 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.06 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.0 m -72.85 -22.16 60.83 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.116 0.484 . . . . 0.0 111.092 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.1 t -90.09 -9.99 46.38 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.686 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.463 ' O ' HG12 ' A' ' 56' ' ' ILE . 87.2 m-70 -138.46 36.33 2.26 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 -178.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 80.9 mt -47.64 -38.62 15.15 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -174.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -53.79 -50.26 66.48 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.256 0.622 . . . . 0.0 112.275 -175.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.458 ' OE2' ' HD3' ' A' ' 58' ' ' LYS . 9.2 tp10 -73.69 -35.41 65.16 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.286 0.565 . . . . 0.0 109.654 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.5 mm -60.12 -50.0 81.9 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.301 -176.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 13.6 ptt180 -77.6 -24.73 49.6 Favored 'General case' 0 C--N 1.312 -1.041 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.533 -178.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.458 ' HD3' ' OE2' ' A' ' 55' ' ' GLU . 62.7 tttt -60.1 -43.28 95.66 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 123.204 0.601 . . . . 0.0 109.457 177.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -126.32 57.24 1.41 Allowed 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.898 178.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -60.77 -28.54 68.81 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.341 -175.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -61.52 -53.25 58.87 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.39 -50.6 73.33 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.08 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.507 ' HA ' HG12 ' A' ' 66' ' ' ILE . 71.2 m-85 -68.94 -30.4 68.84 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -176.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -75.03 -37.97 61.61 Favored 'General case' 0 C--O 1.248 1.0 0 C-N-CA 119.506 -0.877 . . . . 0.0 109.101 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.6 mtm -69.49 -48.08 61.8 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.142 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.515 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.6 pt -64.11 -38.84 83.49 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.713 0 C-N-CA 119.404 -0.919 . . . . 0.0 111.573 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.531 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.28 -39.74 67.21 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.884 0.373 . . . . 0.0 110.978 178.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.1 -55.69 11.57 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.377 178.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.4 mt -58.12 -41.3 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.805 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.623 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 94.5 mt -56.44 -47.93 78.08 Favored 'General case' 0 C--O 1.213 -0.837 0 C-N-CA 122.633 0.373 . . . . 0.0 111.11 179.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.531 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.0 mt-30 -65.08 -50.01 67.81 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.726 0.774 . . . . 0.0 109.714 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -57.9 -52.95 63.39 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-N 114.009 -1.45 . . . . 0.0 112.076 -177.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -83.41 -19.88 35.18 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.623 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.36 -34.41 77.24 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.509 -0.876 . . . . 0.0 109.708 175.714 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HG3' ' CE2' ' A' ' 74' ' ' TYR . 55.2 mttp -81.62 -16.76 50.46 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 174.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -86.84 -51.33 6.13 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.564 177.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.8 pt -121.23 -30.5 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.535 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 128.65 138.83 4.61 Favored Glycine 0 C--N 1.314 -0.676 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.237 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.5 tp -58.39 -39.34 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 122.968 0.507 . . . . 0.0 112.112 -174.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -57.9 -43.99 86.5 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.581 0.705 . . . . 0.0 110.609 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.444 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 40.4 m-80 -67.26 -46.83 72.52 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.34 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 78' ' ' GLY . 23.5 t -61.96 -47.69 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.129 -176.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.4 ' CG ' ' HB3' ' A' ' 28' ' ' LEU . 96.4 m-20 -56.86 -42.06 79.06 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 123.58 0.55 . . . . 0.0 111.339 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -47.7 79.48 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 179.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 88.3 mt -62.74 -29.6 70.8 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.8 mm -64.82 -42.28 94.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.401 HD22 ' CE1' ' A' ' 21' ' ' PHE . 85.4 mt -64.01 -38.67 91.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.936 178.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.1 m -61.53 -33.92 74.64 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.146 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.465 ' HA ' HH11 ' A' ' 13' ' ' ARG . 23.0 m -73.61 -40.17 64.03 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 120.592 0.235 . . . . 0.0 111.425 -178.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 42.3 pt . . . . . 0 C--N 1.319 -0.739 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.504 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.445 ' OD2' ' HD2' ' A' ' 72' ' ' ARG . 12.1 t70 . . . . . 0 C--O 1.245 0.838 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -68.19 -30.66 30.87 Favored 'Trans proline' 0 C--O 1.24 0.593 0 C-N-CA 122.707 2.271 . . . . 0.0 113.466 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -76.11 -38.17 57.19 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -59.29 -43.57 92.57 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.151 -1.386 . . . . 0.0 111.366 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.6 p -65.38 -34.96 73.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.606 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.428 ' HE3' ' SD ' ' A' ' 65' ' ' MET . 56.6 mtmt -66.8 -36.45 82.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.744 176.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.8 -39.54 94.57 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -57.95 -37.79 74.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.318 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 . . . . . 0 C--N 1.315 -0.931 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.779 -179.152 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.4 HG21 HG21 ' A' ' 24' ' ' VAL . 27.6 m . . . . . 0 C--O 1.252 1.223 0 CA-C-O 120.87 0.367 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -91.68 129.93 37.57 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -51.99 -41.41 62.16 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 124.034 0.934 . . . . 0.0 111.195 177.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -67.7 -37.46 82.32 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.532 -175.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.525 ' O ' HG12 ' A' ' 27' ' ' ILE . 15.9 tp -77.19 -35.93 55.38 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.119 -176.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 88.6 t -68.88 -42.57 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 56.1 ttp -60.91 -33.61 73.4 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.931 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -70.63 -42.93 70.24 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 123.085 0.24 . . . . 0.0 110.747 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.83 -49.07 80.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.6 mt -63.76 -40.09 95.87 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.713 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -67.41 -47.39 70.39 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.148 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -62.01 -38.96 90.6 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.704 -176.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.472 ' CD1' HD13 ' A' ' 70' ' ' LEU . 35.0 pt -73.06 -38.25 55.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.705 176.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -58.22 -52.85 63.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 124.124 0.97 . . . . 0.0 111.029 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -63.52 -30.07 71.25 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.179 -178.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.7 -49.51 18.09 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.391 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.4 tp . . . . . 0 C--N 1.317 -0.838 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.356 -175.618 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.519 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.5 tt . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.487 ' O ' HG13 ' A' ' 46' ' ' ILE . 63.7 pttt -61.21 -36.03 78.82 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.159 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.4 m -74.01 -35.29 64.39 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.783 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.418 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 16.7 m -63.17 -39.63 95.2 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 175.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.519 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.7 mm -57.07 -46.36 84.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.698 176.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 42' ' ' LYS . 69.7 mt -53.22 -47.01 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.871 -178.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.418 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 14.4 m-85 -62.35 -52.15 64.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.555 0.693 . . . . 0.0 110.233 -177.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.0 t -66.19 -42.64 91.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.904 -173.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -67.94 -34.58 76.86 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.215 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.9 m -76.36 -24.24 54.17 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.323 0.582 . . . . 0.0 111.058 178.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.3 t -79.67 -29.31 40.82 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.037 0.446 . . . . 0.0 110.488 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.482 ' O ' HG12 ' A' ' 56' ' ' ILE . 67.4 m-70 -120.76 37.64 4.24 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -175.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 87.5 mt -47.02 -51.7 16.69 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 -175.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.592 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 3.8 p30 -59.68 -33.02 71.04 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -73.89 -46.3 45.41 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 121.193 0.52 . . . . 0.0 110.041 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 52' ' ' HIS . 47.3 mm -56.27 -40.96 68.91 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.15 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.627 179.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 82.8 mtp180 -63.38 -38.73 92.3 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 177.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.592 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 50.5 mttp -63.15 -48.37 78.74 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.861 0.838 . . . . 0.0 110.532 -176.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -123.43 51.72 1.46 Allowed 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.918 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -59.7 -19.62 50.98 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.955 -1.021 . . . . 0.0 111.986 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.401 ' H ' ' HG3' ' A' ' 61' ' ' GLU . 18.8 mt-10 -61.01 -57.81 11.05 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.374 1.083 . . . . 0.0 108.094 174.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -65.87 -51.25 60.38 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.194 -1.821 . . . . 0.0 109.969 -176.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.472 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.7 m-85 -66.99 -25.95 66.57 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -175.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -83.68 -39.43 20.21 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 118.728 -1.189 . . . . 0.0 109.896 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.468 ' O ' HG13 ' A' ' 69' ' ' ILE . 73.3 mtm -64.11 -44.27 92.77 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.476 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.6 pt -62.74 -38.59 82.1 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.302 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.938 178.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.415 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -52.68 -45.5 66.84 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.399 0.437 . . . . 0.0 111.797 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -74.5 -36.33 63.22 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 119.922 -0.711 . . . . 0.0 112.139 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 65' ' ' MET . 80.4 mt -63.99 -46.23 94.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-O 120.627 0.251 . . . . 0.0 110.347 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.544 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 79.6 mt -54.07 -45.33 71.69 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 123.461 0.704 . . . . 0.0 110.987 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.506 ' HG2' HG23 ' A' ' 41' ' ' ILE . 48.5 mt-30 -66.65 -49.38 66.38 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.574 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.445 ' HD2' ' OD2' ' A' ' 6' ' ' ASP . 41.4 ttm180 -61.31 -45.22 95.33 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 124.48 1.112 . . . . 0.0 111.74 -177.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -88.93 -18.09 28.19 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -176.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.544 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.49 -29.4 68.82 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 173.094 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -71.9 -31.58 66.55 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.871 175.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -86.44 -52.08 5.81 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -177.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.1 pt -121.25 -27.22 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -172.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.602 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 121.85 146.66 7.4 Favored Glycine 0 CA--C 1.496 -1.124 0 C-N-CA 119.513 -1.327 . . . . 0.0 111.804 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.1 tp -61.8 -40.14 85.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -56.16 -46.35 79.34 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-O 121.825 0.821 . . . . 0.0 110.137 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.428 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 91.4 m-20 -65.03 -44.16 90.01 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 114.051 -1.431 . . . . 0.0 111.623 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.9 t -65.45 -42.79 94.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.467 -177.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -57.33 -44.97 84.71 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.264 0.554 . . . . 0.0 110.655 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.75 -43.06 94.56 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 86.7 mt -65.95 -37.34 85.78 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.1 mm -63.87 -41.06 91.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 176.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.2 mt -62.98 -39.45 94.76 Favored 'General case' 0 C--O 1.21 -1.01 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.515 175.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 50.0 m -63.82 -33.31 75.4 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.65 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 41.2 m -70.49 -37.71 74.24 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.336 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.5 pt . . . . . 0 C--N 1.317 -0.833 0 C-N-CA 119.884 -0.726 . . . . 0.0 111.597 179.482 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.452 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.8 t70 . . . . . 0 N--CA 1.44 -0.97 0 N-CA-C 110.652 -0.129 . . . . 0.0 110.652 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 7.9 Cg_exo -69.84 -29.12 23.97 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.547 2.164 . . . . 0.0 113.131 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.471 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 20.0 mm-40 -75.38 -31.34 60.43 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -178.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -62.73 -40.75 98.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.902 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -71.28 -34.35 53.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.05 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -61.75 -36.07 79.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.037 173.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 95.5 mt -60.69 -35.84 77.29 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.602 176.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 mmt85 -65.04 -29.36 70.25 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.163 0.506 . . . . 0.0 110.318 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.515 179.435 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.6 m . . . . . 0 C--O 1.253 1.252 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -74.72 121.81 22.28 Favored 'General case' 0 CA--C 1.499 -0.995 0 C-N-CA 119.881 -0.728 . . . . 0.0 109.522 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -55.48 -41.54 73.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -56.68 -42.13 78.52 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.79 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.601 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.6 tp -75.64 -43.1 49.51 Favored 'General case' 0 N--CA 1.417 -2.119 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.658 -175.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.0 t -63.82 -38.97 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.2 ttp -59.81 -35.04 73.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.989 176.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -75.83 -41.7 51.85 Favored 'General case' 0 C--O 1.197 -1.667 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.449 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.601 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.5 mm -55.97 -51.2 63.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 121.456 0.646 . . . . 0.0 109.73 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 76.2 mt -64.69 -34.14 77.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.878 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -72.45 -44.87 61.76 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 122.024 0.916 . . . . 0.0 109.979 -179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -65.62 -37.84 87.73 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.893 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.403 HG21 HD13 ' A' ' 45' ' ' ILE . 33.7 pt -72.07 -37.87 61.6 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.852 176.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -61.5 -52.53 64.13 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 124.165 0.986 . . . . 0.0 110.908 -178.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.19 -30.9 71.95 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 116.322 -0.399 . . . . 0.0 112.06 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -75.43 -46.54 32.12 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.971 0.415 . . . . 0.0 110.231 178.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.497 HD21 ' CE1' ' A' ' 74' ' ' TYR . 58.7 tp . . . . . 0 C--O 1.243 0.758 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.889 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.582 ' O ' HG12 ' A' ' 45' ' ' ILE . 14.8 tt . . . . . 0 C--O 1.214 -0.788 0 CA-C-O 120.622 0.249 . . . . 0.0 110.454 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.492 ' O ' HG13 ' A' ' 46' ' ' ILE . 49.7 mtpt -55.31 -50.09 70.49 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-O 121.688 0.756 . . . . 0.0 110.008 174.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.0 m -59.05 -47.12 86.39 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 113.707 -1.588 . . . . 0.0 110.279 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 23.1 m -58.34 -39.55 79.77 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 123.771 0.669 . . . . 0.0 111.077 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.3 mm -58.2 -42.54 83.66 Favored 'Isoleucine or valine' 0 C--N 1.344 0.326 0 C-N-CA 123.145 0.578 . . . . 0.0 109.812 176.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 42' ' ' LYS . 63.9 mt -59.36 -47.45 90.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.59 -175.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -61.79 -50.79 70.92 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 121.671 0.748 . . . . 0.0 109.462 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.52 -47.22 93.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.573 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -64.99 -39.57 93.66 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.837 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.9 m -70.17 -27.57 64.64 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.135 0.493 . . . . 0.0 111.457 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -82.34 -32.11 29.52 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.306 0.574 . . . . 0.0 110.42 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.548 ' O ' HG12 ' A' ' 56' ' ' ILE . 90.0 m-70 -114.97 35.52 4.28 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.447 -174.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.6 mt -47.35 -39.0 14.01 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.65 1.18 . . . . 0.0 113.734 -177.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.516 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 12.3 t70 -54.17 -50.85 66.07 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -73.79 -38.08 64.75 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.624 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.548 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.8 mm -56.5 -52.14 56.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.668 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.949 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.06 -36.8 82.84 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -176.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 33.4 mtmm -71.78 -24.79 61.81 Favored 'General case' 0 CA--C 1.51 -0.572 0 C-N-CA 119.921 -0.712 . . . . 0.0 111.277 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -130.24 49.71 2.26 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -178.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.464 ' H ' ' HD3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -57.54 -31.07 65.73 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.58 -1.191 . . . . 0.0 112.773 -177.782 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.67 -50.23 67.84 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -59.84 -50.77 72.48 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.501 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.486 ' HA ' HG12 ' A' ' 66' ' ' ILE . 69.6 m-85 -69.7 -25.6 63.95 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -177.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -75.73 -44.63 40.91 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 176.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.1 mtm -61.13 -50.83 71.61 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.33 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.597 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.6 pt -64.43 -38.73 83.34 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.746 0 C-N-CA 119.47 -0.892 . . . . 0.0 111.801 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.457 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -59.31 -41.02 88.04 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 117.927 0.331 . . . . 0.0 110.642 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.28 -55.32 29.47 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 89.8 mt -58.03 -42.4 82.71 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 CA-C-N 115.212 -0.903 . . . . 0.0 111.929 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.4 mt -54.55 -47.87 72.69 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 122.812 0.445 . . . . 0.0 111.284 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 64.5 mt-30 -69.73 -47.95 61.24 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.74 0.781 . . . . 0.0 109.557 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -59.47 -43.06 93.31 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 113.989 -1.459 . . . . 0.0 110.782 -176.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.404 ' CE2' ' HD2' ' A' ' 76' ' ' LYS . 40.0 m-85 -93.68 -15.5 25.22 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -177.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.497 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.75 -29.71 69.0 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 174.291 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -77.61 -28.33 51.49 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.75 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.404 ' HD2' ' CE2' ' A' ' 73' ' ' TYR . 41.1 ttmt -87.1 -51.64 5.88 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.256 -0.577 . . . . 0.0 111.486 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.3 pt -119.52 -26.71 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -173.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.535 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 117.04 148.17 8.77 Favored Glycine 0 C--N 1.307 -1.057 0 C-N-CA 120.298 -0.953 . . . . 0.0 110.996 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.8 tp -64.87 -37.87 81.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 117.029 0.414 . . . . 0.0 111.999 -174.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -55.92 -42.84 76.7 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 122.125 0.965 . . . . 0.0 110.148 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.484 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 48.6 m-80 -67.05 -50.06 63.15 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.145 -1.388 . . . . 0.0 111.324 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.3 t -61.67 -39.55 83.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -177.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -51.05 -50.39 58.74 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.868 1.267 . . . . 0.0 110.129 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.11 -40.58 71.4 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.062 -177.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.7 mt -64.9 -34.8 79.25 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.125 -178.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.8 mm -68.38 -41.96 83.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.5 mt -62.11 -40.73 96.88 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.137 0.494 . . . . 0.0 110.889 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 48.9 m -63.96 -33.38 75.6 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.786 177.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.4 m -74.19 -48.26 30.24 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.989 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.4 pt . . . . . 0 C--N 1.326 -0.443 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -176.154 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 15.0 t70 . . . . . 0 N--CA 1.448 -0.562 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.518 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 17.3 Cg_exo -69.76 -28.26 25.48 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.947 2.432 . . . . 0.0 113.9 177.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -75.16 -33.27 61.48 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -60.17 -44.57 94.92 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.484 -1.234 . . . . 0.0 110.552 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -66.78 -34.09 67.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.235 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.2 mttt -62.77 -37.2 85.7 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.38 -38.17 88.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.151 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.6 mtp180 -72.4 -25.43 61.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.31 0.576 . . . . 0.0 110.339 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 . . . . . 0 CA--C 1.547 0.828 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.212 174.679 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 29.7 m . . . . . 0 N--CA 1.432 -1.347 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -74.92 121.85 22.54 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.316 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -53.43 -50.62 64.83 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.681 0.613 . . . . 0.0 111.658 -178.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -64.61 -29.54 70.55 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.359 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.617 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.2 tp -75.93 -39.6 55.85 Favored 'General case' 0 N--CA 1.425 -1.703 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.054 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 62.8 t -63.36 -43.21 98.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 175.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 60.7 ttp -57.94 -39.34 77.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.667 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.736 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 58.9 tt0 -67.63 -45.42 75.44 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.736 176.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.617 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.6 mm -55.93 -44.8 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 CA-C-O 121.403 0.621 . . . . 0.0 110.047 -179.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 68.5 mt -68.65 -33.87 74.74 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.7 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -71.63 -43.6 65.87 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.197 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.736 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.7 mm-40 -53.66 -53.99 44.19 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.664 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.461 HG21 HD13 ' A' ' 45' ' ' ILE . 31.7 pt -67.59 -34.28 67.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.37 -177.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -63.23 -51.46 66.17 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.317 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.423 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.4 pp -72.19 -30.29 64.81 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.462 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.423 ' N ' HD12 ' A' ' 33' ' ' LEU . 15.6 t70 -75.11 -45.43 41.18 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.245 -178.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.2 tt . . . . . 0 N--CA 1.444 -0.734 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -176.981 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.464 ' O ' HG12 ' A' ' 45' ' ' ILE . 13.9 tt . . . . . 0 N--CA 1.434 -1.236 0 N-CA-C 111.425 0.158 . . . . 0.0 111.425 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.559 ' O ' HG13 ' A' ' 46' ' ' ILE . 11.2 ptmm? -65.52 -32.33 73.87 Favored 'General case' 0 CA--C 1.509 -0.624 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.535 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.4 m -66.3 -44.61 82.99 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.065 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.42 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 48.4 m -63.68 -38.36 90.83 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.339 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 41' ' ' ILE . 25.7 mm -54.68 -43.57 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.55 0.74 . . . . 0.0 110.077 175.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 42' ' ' LYS . 74.6 mt -54.6 -50.26 60.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.597 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.42 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 20.2 m-85 -62.88 -53.1 59.34 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.511 0.672 . . . . 0.0 110.321 -177.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 44' ' ' SER . 60.2 t -58.78 -44.94 91.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.667 -176.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -71.21 -27.37 63.45 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.9 m -80.95 -25.48 37.36 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.372 0.606 . . . . 0.0 110.372 176.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.1 t -78.07 -52.94 7.98 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.489 177.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.566 ' O ' HG12 ' A' ' 56' ' ' ILE . 86.0 m-70 -98.46 48.53 0.99 Allowed 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.316 -172.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 98.2 mt -48.59 -48.04 39.34 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -175.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 3.1 t70 -54.11 -52.04 62.26 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -174.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -72.59 -32.18 65.78 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.759 -0.776 . . . . 0.0 110.031 -176.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.566 HG12 ' O ' ' A' ' 52' ' ' HIS . 44.7 mm -63.57 -49.74 81.18 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.033 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.101 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.3 ptt-85 -69.76 -29.81 67.24 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -175.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 54' ' ' ASP . 32.5 mmtp -70.98 -34.05 71.03 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.012 0.434 . . . . 0.0 110.661 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -131.36 53.91 1.95 Allowed 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -59.65 -35.04 73.63 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.208 -176.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -64.38 -40.47 95.89 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 120.955 0.407 . . . . 0.0 110.925 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -65.61 -50.13 66.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.382 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.557 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.3 m-85 -68.88 -34.26 75.14 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -177.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.61 -45.09 76.45 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.274 177.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.6 mtm -65.69 -44.0 87.54 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.998 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.596 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 45.0 pt -66.04 -39.08 83.54 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.824 0 C-N-CA 118.588 -1.245 . . . . 0.0 111.173 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.576 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.05 -40.67 73.87 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 117.99 0.359 . . . . 0.0 110.839 178.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.89 -54.15 35.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.749 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 98.1 mt -58.27 -41.47 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.289 -179.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 96.9 mt -55.97 -48.73 75.28 Favored 'General case' 0 C--O 1.216 -0.694 0 C-N-CA 122.989 0.516 . . . . 0.0 111.506 178.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 57.3 mt-30 -68.37 -45.82 71.76 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.483 0.658 . . . . 0.0 109.78 -178.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 45.3 ttm180 -57.81 -49.34 76.98 Favored 'General case' 0 N--CA 1.424 -1.76 0 C-N-CA 124.71 1.204 . . . . 0.0 111.831 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.41 ' CE2' ' HD3' ' A' ' 76' ' ' LYS . 66.1 m-85 -87.86 -15.06 37.8 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 -176.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.538 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.14 -32.37 73.44 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 174.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.43 ' NZ ' ' HB3' ' A' ' 75' ' ' LYS . 7.2 mtpm? -81.25 -18.02 47.44 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.144 176.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.41 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 64.7 tttm -94.48 -47.42 6.56 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.163 -176.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.1 pt -126.55 -30.09 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.583 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 123.77 142.89 6.13 Favored Glycine 0 CA--C 1.499 -0.908 0 C-N-CA 120.238 -0.982 . . . . 0.0 112.043 177.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.3 tp -62.03 -33.64 59.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 117.018 0.409 . . . . 0.0 111.372 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.45 ' CD ' ' H ' ' A' ' 80' ' ' GLU . 2.3 mp0 -53.59 -49.47 67.7 Favored 'General case' 0 C--O 1.248 0.979 0 CA-C-O 122.376 1.084 . . . . 0.0 109.156 177.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -68.47 -46.98 68.27 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 113.795 -1.548 . . . . 0.0 110.756 -177.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.3 t -62.99 -38.24 81.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.737 -177.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -52.92 -50.34 64.16 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.673 0.749 . . . . 0.0 109.429 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -39.33 73.71 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.234 -178.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.444 ' O ' ' HB ' ' A' ' 88' ' ' THR . 87.0 mt -68.12 -32.77 73.29 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -178.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 82' ' ' VAL . 43.7 mm -67.12 -37.69 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 CA-C-O 121.777 0.799 . . . . 0.0 108.983 175.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.36 -38.68 88.16 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.135 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 85' ' ' LEU . 90.5 m -61.3 -34.47 75.27 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.973 0.909 . . . . 0.0 110.562 175.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 28.7 m -57.32 -49.97 74.43 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.955 0.902 . . . . 0.0 110.47 -177.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.5 pt . . . . . 0 C--N 1.318 -0.787 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.985 -176.3 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.486 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 14.3 t70 . . . . . 0 N--CA 1.441 -0.923 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.498 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 5.5 Cg_exo -71.58 -25.62 20.76 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.59 2.193 . . . . 0.0 113.426 -178.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -76.84 -40.13 48.83 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -59.49 -41.54 90.07 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.085 178.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 7' ' ' PRO . 7.8 p -66.09 -34.55 70.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-O 121.347 0.594 . . . . 0.0 110.043 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 64.4 mttp -65.04 -35.48 81.29 Favored 'General case' 0 C--O 1.217 -0.655 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 176.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.69 -42.47 98.97 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.537 ' HG2' HG23 ' A' ' 89' ' ' THR . 38.0 mtm180 -66.79 -30.2 70.34 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 121.724 0.774 . . . . 0.0 110.027 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 . . . . . 0 C--N 1.311 -1.065 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.621 177.679 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 9.2 m . . . . . 0 N--CA 1.435 -1.196 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -75.79 125.38 28.96 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -56.04 -36.12 67.66 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 123.521 0.513 . . . . 0.0 110.916 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -73.49 -31.55 63.79 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.045 -177.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.609 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.5 tp -76.61 -39.69 51.68 Favored 'General case' 0 N--CA 1.42 -1.927 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.217 -177.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.502 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 60.3 t -64.26 -44.4 97.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 176.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 14.9 tmm? -58.85 -32.4 69.4 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.465 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.685 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 63.8 tt0 -74.49 -42.13 59.5 Favored 'General case' 0 C--O 1.192 -1.933 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.483 176.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.609 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.2 mm -56.24 -44.51 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 CA-C-O 121.672 0.749 . . . . 0.0 109.255 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 69.9 mt -67.33 -31.34 71.55 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.668 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -72.4 -48.61 40.05 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.014 0.926 . . . . 0.0 110.115 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.685 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.2 mm-40 -53.79 -53.85 46.6 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.414 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.6 pt -66.77 -38.53 81.7 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.546 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.224 -177.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -58.71 -49.21 78.42 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.269 0.628 . . . . 0.0 111.494 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -71.38 -32.66 68.74 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -75.52 -36.99 60.38 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.8 0.81 . . . . 0.0 109.653 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.413 HD21 ' CD1' ' A' ' 74' ' ' TYR . 46.0 tp . . . . . 0 C--N 1.316 -0.89 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.265 177.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.549 ' O ' HG12 ' A' ' 45' ' ' ILE . 12.0 tt . . . . . 0 C--O 1.227 -0.118 0 CA-C-O 120.558 0.218 . . . . 0.0 110.812 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.5 pttp -61.86 -33.6 74.47 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.324 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.5 m -72.2 -43.1 65.0 Favored 'General case' 0 C--O 1.25 1.119 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.5 m -58.58 -41.92 86.83 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.125 178.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 41' ' ' ILE . 37.0 mm -52.55 -46.69 48.76 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.388 177.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 42' ' ' LYS . 64.7 mt -56.05 -50.52 69.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.448 -176.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -58.18 -53.01 63.11 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.895 0.855 . . . . 0.0 109.9 -176.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.414 HG22 ' HB3' ' A' ' 30' ' ' GLU . 40.9 t -62.06 -47.56 92.58 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.712 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.718 -176.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -68.17 -35.93 78.81 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.665 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.1 t -77.4 -24.92 50.41 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.311 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.6 t -86.8 -19.47 28.98 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.16 0.505 . . . . 0.0 111.048 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.487 ' O ' HG12 ' A' ' 56' ' ' ILE . 76.7 m-70 -124.46 36.85 4.53 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 -177.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.496 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 82.9 mt -47.21 -41.8 18.94 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -174.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -53.66 -50.07 66.59 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -175.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.567 ' OE1' ' HD3' ' A' ' 58' ' ' LYS . 3.7 tp10 -72.99 -36.04 66.97 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.4 mm -63.21 -50.62 78.34 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.141 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.566 -177.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 6.9 ptm180 -70.49 -25.83 63.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.921 0.391 . . . . 0.0 111.762 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.567 ' HD3' ' OE1' ' A' ' 55' ' ' GLU . 78.7 tttt -65.33 -42.96 92.38 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 123.604 0.761 . . . . 0.0 109.984 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -127.22 58.79 1.44 Allowed 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 177.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.457 ' HG3' ' OE2' ' A' ' 61' ' ' GLU . 14.1 ptmm? -60.32 -32.32 71.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.828 -175.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.457 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 3.4 mp0 -65.57 -41.87 92.42 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.873 0.368 . . . . 0.0 110.213 177.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -64.01 -51.74 62.83 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.692 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.512 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.9 m-85 -67.01 -34.08 76.96 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -177.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -66.22 -45.36 80.96 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.585 177.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.8 mtm -66.22 -44.5 83.65 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.872 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.514 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 45.3 pt -67.37 -40.53 84.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.682 0 C-N-CA 118.939 -1.104 . . . . 0.0 112.348 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.92 -35.35 68.92 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 118.482 0.583 . . . . 0.0 110.876 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -67.09 -54.93 16.74 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.083 177.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.4 mt -62.7 -39.55 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.235 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 96.9 mt -54.55 -49.2 70.87 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.009 0.524 . . . . 0.0 111.433 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.507 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 55.1 mt-30 -65.17 -45.4 85.07 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.677 0.751 . . . . 0.0 109.646 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -57.57 -42.72 83.65 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 125.805 1.642 . . . . 0.0 112.07 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -97.21 -15.83 20.68 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -178.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.414 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.24 -34.42 77.41 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 118.881 0.764 . . . . 0.0 109.567 177.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -79.08 -17.68 54.74 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.533 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -99.83 -51.37 3.74 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.285 -172.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.3 pt -119.31 -20.71 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.573 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 117.32 140.25 6.58 Favored Glycine 0 C--N 1.308 -0.988 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.6 tp -64.72 -37.89 81.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.908 0.354 . . . . 0.0 111.922 -173.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.72 -45.28 82.0 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 122.021 0.915 . . . . 0.0 109.722 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.462 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 79.8 m-20 -61.55 -48.62 80.16 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 113.953 -1.476 . . . . 0.0 111.112 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.6 t -62.34 -44.77 99.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 O-C-N 123.59 0.556 . . . . 0.0 110.441 -177.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -55.1 -47.2 75.28 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.157 0.504 . . . . 0.0 111.973 -178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -40.24 86.69 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 99.0 mt -65.01 -36.92 85.93 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.665 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.3 mm -63.73 -40.25 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 121.136 0.493 . . . . 0.0 109.917 176.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 92.2 mt -65.2 -37.1 86.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.92 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 58.3 m -67.16 -33.62 75.81 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.81 0.814 . . . . 0.0 109.898 176.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.537 HG23 ' HG2' ' A' ' 13' ' ' ARG . 87.6 m -66.59 -44.54 81.88 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.927 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 41.6 pt . . . . . 0 C--N 1.323 -0.578 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -176.13 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.416 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.9 t70 . . . . . 0 N--CA 1.441 -0.887 0 N-CA-C 111.491 0.182 . . . . 0.0 111.491 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 4.0 Cg_exo -72.04 -28.67 15.76 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.608 2.206 . . . . 0.0 112.813 -178.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.415 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 18.0 mm-40 -75.03 -35.69 61.93 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -61.03 -47.47 86.26 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.238 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.5 p -63.37 -34.67 68.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.472 0.653 . . . . 0.0 110.908 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -71.01 -31.82 68.44 Favored 'General case' 0 C--O 1.198 -1.61 0 O-C-N 121.951 -0.468 . . . . 0.0 112.245 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 94.0 mt -62.5 -36.79 83.67 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.277 0.56 . . . . 0.0 110.509 176.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -62.03 -38.82 90.14 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.697 177.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 . . . . . 0 C--N 1.313 -1.004 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.336 179.445 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.4 m . . . . . 0 C--O 1.256 1.43 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.428 ' O ' HG23 ' A' ' 24' ' ' VAL . 45.7 t-20 -81.33 117.87 22.17 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 174.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -58.31 -32.52 68.54 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 123.321 0.388 . . . . 0.0 111.09 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -66.74 -41.73 87.36 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.03 -174.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.586 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.1 tp -77.02 -38.7 52.43 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.234 -176.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 20' ' ' ASN . 56.6 t -59.86 -41.88 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 CA-C-O 121.088 0.471 . . . . 0.0 110.094 178.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 15.9 tmm? -57.92 -40.9 81.54 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.071 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -74.76 -36.26 62.58 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.005 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.5 mm -56.61 -47.12 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 81.0 mt -65.1 -41.16 95.23 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.332 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -64.56 -47.3 79.27 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.755 0.788 . . . . 0.0 110.655 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -59.57 -45.37 92.04 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.322 -177.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.416 ' CD1' HD13 ' A' ' 70' ' ' LEU . 35.4 pt -71.71 -39.67 69.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.376 178.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -54.69 -51.6 65.02 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.501 1.12 . . . . 0.0 111.347 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.38 -28.86 67.48 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -76.03 -49.94 16.19 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.746 0.784 . . . . 0.0 110.225 177.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.1 tp . . . . . 0 C--N 1.314 -0.971 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.581 -177.654 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.515 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.5 tt . . . . . 0 N--CA 1.473 0.679 0 CA-C-O 121.29 0.567 . . . . 0.0 110.358 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.53 ' O ' HG13 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.18 -28.19 68.95 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.967 177.019 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.4 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 11.9 m -79.01 -37.58 38.8 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.46 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 16.1 m -59.96 -40.71 89.97 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 41' ' ' ILE . 44.2 mm -55.64 -49.72 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.245 175.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 42' ' ' LYS . 78.1 mt -53.59 -49.02 58.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.369 -177.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.46 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 22.9 m-85 -60.03 -52.83 63.72 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.734 0.778 . . . . 0.0 110.141 -177.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.6 t -63.83 -43.76 97.96 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.796 -174.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -68.88 -34.38 75.34 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.358 -179.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.6 m -75.99 -21.51 56.85 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.194 0.521 . . . . 0.0 110.978 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 37.5 t -86.09 -41.12 15.04 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.009 0.433 . . . . 0.0 110.701 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.515 ' O ' HG12 ' A' ' 56' ' ' ILE . 84.1 m-70 -107.22 43.31 1.19 Allowed 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -176.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 81.0 mt -47.01 -41.93 17.28 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -175.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.669 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 34.0 t70 -58.93 -50.39 74.22 Favored 'General case' 0 C--O 1.209 -1.039 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -172.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -72.0 -28.41 63.38 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.998 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.7 mm -64.92 -45.04 95.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 0.5 OUTLIER -73.67 -25.2 60.14 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.428 178.513 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.669 ' HG2' ' O ' ' A' ' 54' ' ' ASP . 74.2 mmtt -65.37 -51.39 60.79 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 176.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -123.34 65.62 1.0 Allowed 'General case' 0 CA--C 1.496 -1.121 0 CA-C-O 121.433 0.635 . . . . 0.0 111.655 -178.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.432 ' HD3' ' H ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -66.93 -17.3 64.84 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.174 179.552 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.3 mp0 -64.71 -58.19 6.96 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 173.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -60.08 -49.7 76.6 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.122 -1.399 . . . . 0.0 111.014 -176.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.458 ' HA ' HG12 ' A' ' 66' ' ' ILE . 75.1 m-85 -67.68 -30.26 69.74 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -176.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -73.87 -41.47 62.14 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 119.452 -0.899 . . . . 0.0 109.825 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 84.8 mtp -63.72 -49.24 73.86 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.162 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.9 pt -66.2 -38.6 82.29 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.316 0 C-N-CA 119.729 -0.789 . . . . 0.0 111.741 -179.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.515 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -55.62 -39.7 71.15 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.616 0.246 . . . . 0.0 111.147 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -67.85 -51.7 45.28 Favored 'General case' 0 C--O 1.251 1.155 0 CA-C-O 121.598 0.713 . . . . 0.0 109.694 178.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.3 mt -57.84 -45.01 87.36 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.317 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.567 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 85.4 mt -55.22 -46.37 75.95 Favored 'General case' 0 C--O 1.212 -0.874 0 C-N-CA 123.173 0.589 . . . . 0.0 110.97 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 75.5 mt-30 -61.53 -52.12 65.76 Favored 'General case' 0 C--O 1.256 1.418 0 CA-C-O 121.372 0.606 . . . . 0.0 110.363 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -57.7 -54.74 43.43 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.631 -176.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -82.65 -16.36 48.56 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -173.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.567 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -63.79 -39.06 93.33 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 176.16 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -81.32 -37.05 28.97 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.422 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -72.21 -50.63 26.07 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.991 -176.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.8 pt -118.69 -29.99 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -178.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.583 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 129.67 136.02 4.0 Favored Glycine 0 C--N 1.31 -0.878 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.458 ' HB ' ' HB2' ' A' ' 74' ' ' TYR . 9.0 tp -60.01 -38.78 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 CA-C-N 117.298 0.549 . . . . 0.0 111.978 -174.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.94 -45.99 82.38 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.274 0.559 . . . . 0.0 110.197 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.45 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 94.4 m-20 -62.65 -45.92 90.61 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.962 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.5 t -63.41 -47.78 90.22 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.576 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -55.12 -45.54 75.55 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.346 0.593 . . . . 0.0 110.881 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.29 -44.48 87.83 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 115.359 -0.837 . . . . 0.0 108.866 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.2 mt -64.9 -36.24 83.72 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 82' ' ' VAL . 45.3 mm -63.09 -44.7 99.65 Favored 'Isoleucine or valine' 0 C--O 1.244 0.769 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.28 -41.56 97.16 Favored 'General case' 0 C--O 1.214 -0.794 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.303 177.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.2 m -60.37 -38.86 85.2 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.226 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.6 m -71.79 -39.6 69.8 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.281 -176.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 41.2 pt . . . . . 0 C--N 1.321 -0.662 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.982 179.809 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.481 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 22.8 t70 . . . . . 0 C--O 1.242 0.662 0 N-CA-C 114.017 1.118 . . . . 0.0 114.017 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.49 ' O ' HG12 ' A' ' 10' ' ' VAL . 15.0 Cg_exo -70.77 -31.37 16.13 Favored 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 123.024 2.483 . . . . 0.0 113.422 177.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -75.17 -38.26 60.94 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.697 0.761 . . . . 0.0 109.021 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 67.7 t80 -63.93 -38.28 90.52 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.699 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.49 HG12 ' O ' ' A' ' 7' ' ' PRO . 4.3 p -67.29 -33.53 63.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 120.87 0.367 . . . . 0.0 110.305 178.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -58.19 -43.03 87.35 Favored 'General case' 0 C--N 1.342 0.262 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.74 -38.32 84.77 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.038 177.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.685 ' HD2' HG23 ' A' ' 89' ' ' THR . 19.8 mmm180 -60.12 -42.22 94.28 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.023 179.592 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.241 0.612 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 24' ' ' VAL . 55.6 t-20 -75.27 121.58 22.39 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -54.02 -39.16 65.89 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.314 0.578 . . . . 0.0 111.41 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -75.05 -33.1 61.69 Favored 'General case' 0 CA--C 1.485 -1.535 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.077 -171.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.608 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.9 tp -76.57 -36.64 57.47 Favored 'General case' 0 N--CA 1.419 -2.002 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.265 -177.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.421 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 61.0 t -65.02 -42.44 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.678 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 56.3 ttp -58.46 -41.2 84.65 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.325 177.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -68.86 -39.88 79.61 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.461 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.608 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.8 mm -57.06 -51.22 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 176.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.5 mt -63.04 -37.89 89.01 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.633 -179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -66.49 -49.06 67.86 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 123.99 0.916 . . . . 0.0 110.449 179.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.3 -41.05 97.05 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.165 -175.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.401 ' CD1' HD13 ' A' ' 70' ' ' LEU . 38.7 pt -72.86 -35.16 48.61 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.587 0 C-N-CA 120.112 -0.635 . . . . 0.0 109.499 176.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -60.95 -54.57 43.4 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 123.018 0.527 . . . . 0.0 110.421 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.428 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.5 pp -62.24 -34.76 77.13 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.922 -178.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.428 ' N ' HD12 ' A' ' 33' ' ' LEU . 25.9 t70 -75.36 -48.55 22.5 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.914 -178.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 54.1 tp . . . . . 0 N--CA 1.466 0.354 0 C-N-CA 123.662 0.785 . . . . 0.0 112.118 -179.186 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.532 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.7 tt . . . . . 0 C--O 1.222 -0.354 0 N-CA-C 111.265 0.098 . . . . 0.0 111.265 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.498 ' O ' HG13 ' A' ' 46' ' ' ILE . 21.1 pttm -62.69 -32.9 74.07 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 119.951 -0.7 . . . . 0.0 110.794 178.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.0 m -69.11 -43.45 74.42 Favored 'General case' 0 N--CA 1.428 -1.526 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.321 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.488 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 25.0 m -60.4 -37.96 82.47 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.438 176.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.1 mm -55.95 -49.19 76.71 Favored 'Isoleucine or valine' 0 C--N 1.344 0.338 0 C-N-CA 123.397 0.679 . . . . 0.0 110.035 176.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 42' ' ' LYS . 75.6 mt -52.29 -47.47 45.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 C-N-CA 123.528 0.731 . . . . 0.0 112.161 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.488 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 25.9 m-85 -61.8 -53.13 60.19 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-O 121.43 0.633 . . . . 0.0 110.453 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.3 -43.6 95.04 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 CA-C-N 114.638 -1.164 . . . . 0.0 111.662 -173.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -67.31 -34.42 77.34 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.419 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 37.2 m -77.57 -21.96 51.69 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.283 0.563 . . . . 0.0 111.099 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.4 t -77.85 -49.11 14.91 Favored 'General case' 0 N--CA 1.434 -1.248 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.501 ' O ' HG12 ' A' ' 56' ' ' ILE . 79.9 m-70 -104.99 45.55 0.96 Allowed 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -175.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 50' ' ' SER . 81.1 mt -46.81 -43.75 18.65 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -175.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.419 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 7.9 t70 -53.58 -51.67 62.24 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -174.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -74.0 -32.68 63.51 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.461 -177.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 52' ' ' HIS . 41.8 mm -62.95 -35.65 72.33 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.477 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 177.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -77.66 -43.95 29.65 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.166 -179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 52.9 mtpt -60.96 -46.25 91.48 Favored 'General case' 0 CA--C 1.505 -0.771 0 C-N-CA 122.975 0.51 . . . . 0.0 110.754 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -122.34 60.33 1.0 Allowed 'General case' 0 C--N 1.302 -1.472 0 CA-C-O 121.562 0.696 . . . . 0.0 111.432 -177.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -22.94 66.13 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.762 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -63.09 -49.76 73.19 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 123.503 0.502 . . . . 0.0 109.661 175.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -63.09 -49.6 73.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.874 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.484 ' HA ' HG12 ' A' ' 66' ' ' ILE . 81.2 m-85 -68.49 -33.42 74.12 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -178.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.54 -50.04 72.93 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.164 0.507 . . . . 0.0 109.802 174.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.2 mtm -61.16 -48.88 79.55 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.364 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.556 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 46.4 pt -67.78 -39.89 82.78 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.826 -177.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.541 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.53 -39.81 68.03 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 118.348 0.522 . . . . 0.0 111.587 -178.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -63.39 -55.73 22.06 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.575 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.0 mt -60.63 -40.41 84.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.747 -176.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.584 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 93.0 mt -55.61 -50.32 70.44 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 122.929 0.492 . . . . 0.0 111.636 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.541 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 43.2 mt-30 -70.36 -46.79 63.4 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 122.297 1.046 . . . . 0.0 109.858 -176.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 72' ' ' ARG . 33.0 ttt180 -60.91 -44.55 97.02 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 113.51 -1.677 . . . . 0.0 111.43 -175.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -91.98 -15.28 28.17 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.584 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.94 -30.26 70.34 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 119.929 -0.708 . . . . 0.0 109.098 175.127 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -79.78 -17.46 53.37 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.099 176.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -97.42 -51.3 4.21 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.028 -176.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.5 pt -118.17 -25.9 2.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -176.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.534 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 120.42 143.83 6.94 Favored Glycine 0 C--N 1.308 -0.978 0 C-N-CA 120.064 -1.065 . . . . 0.0 111.213 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tp -60.68 -42.78 93.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -175.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.76 -41.84 87.53 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.554 0.692 . . . . 0.0 110.417 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.557 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 2.4 m-20 -63.07 -48.4 78.82 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.592 -1.186 . . . . 0.0 109.823 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 78' ' ' GLY . 33.9 t -62.29 -46.82 95.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.586 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -53.62 -46.7 70.54 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.203 0.525 . . . . 0.0 111.345 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -42.01 95.34 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 115.476 -0.784 . . . . 0.0 108.916 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 88.7 mt -65.44 -35.46 80.99 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.32 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 82' ' ' VAL . 49.0 mm -66.22 -45.82 89.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.53 -42.29 91.95 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.588 178.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 50.9 m -64.14 -33.69 76.36 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.127 0.489 . . . . 0.0 111.047 177.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.685 HG23 ' HD2' ' A' ' 13' ' ' ARG . 91.5 m -68.79 -37.44 79.28 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.779 179.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.6 pt . . . . . 0 C--N 1.329 -0.315 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.712 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.415 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 6.2 t70 . . . . . 0 N--CA 1.44 -0.952 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 16.6 Cg_exo -67.07 -27.31 42.27 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.882 2.388 . . . . 0.0 112.438 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.465 ' HB2' HD11 ' A' ' 69' ' ' ILE . 3.8 mm-40 -75.01 -25.27 58.67 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -177.081 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -70.46 -39.56 74.21 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.357 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.412 HG12 ' O ' ' A' ' 7' ' ' PRO . 9.4 p -68.4 -34.48 66.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.213 0.53 . . . . 0.0 109.574 178.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.68 -42.01 99.4 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 174.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.45 -44.51 84.83 Favored 'General case' 0 C--O 1.195 -1.789 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.276 176.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -58.11 -32.84 68.49 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 118.659 0.663 . . . . 0.0 112.566 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 . . . . . 0 C--N 1.301 -1.512 0 CA-C-O 121.903 0.859 . . . . 0.0 110.117 177.71 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.0 m . . . . . 0 C--O 1.245 0.833 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.418 ' O ' HG23 ' A' ' 24' ' ' VAL . 14.5 t-20 -94.23 138.94 31.67 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.451 ' HA ' HD12 ' A' ' 90' ' ' ILE . 76.0 t80 -61.37 -44.07 97.8 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 122.569 0.348 . . . . 0.0 111.761 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 -71.56 -31.22 66.75 Favored 'General case' 0 CA--C 1.492 -1.257 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -173.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.495 ' O ' HG12 ' A' ' 27' ' ' ILE . 30.8 tp -69.69 -47.86 61.7 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.453 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.509 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 94.6 t -63.52 -42.2 95.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -56.8 -43.73 81.25 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -65.54 -43.18 90.72 Favored 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.944 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.5 mm -58.74 -50.26 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-O 121.274 0.559 . . . . 0.0 109.811 177.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 82.7 mt -61.72 -36.24 80.37 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.325 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -71.84 -47.69 51.37 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.38 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -59.2 -41.08 87.71 Favored 'General case' 0 C--O 1.248 1.025 0 C-N-CA 124.307 1.043 . . . . 0.0 110.292 -177.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.423 ' CD1' HD13 ' A' ' 70' ' ' LEU . 45.8 pt -73.03 -40.31 58.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 120.596 -0.442 . . . . 0.0 109.996 176.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -60.95 -47.64 85.48 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 123.516 0.726 . . . . 0.0 111.051 -178.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.83 -30.1 71.23 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -75.0 -50.56 16.14 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 119.147 -1.021 . . . . 0.0 110.04 174.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 69.2 tp . . . . . 0 C--O 1.241 0.63 0 C-N-CA 123.966 0.906 . . . . 0.0 111.692 -177.515 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.559 ' O ' HG12 ' A' ' 45' ' ' ILE . 10.9 tt . . . . . 0 N--CA 1.444 -0.742 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.453 ' O ' HG13 ' A' ' 46' ' ' ILE . 64.6 pttt -71.86 -28.23 63.4 Favored 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 119.126 -1.029 . . . . 0.0 110.084 -177.214 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.2 m -73.91 -40.59 63.04 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.248 -0.887 . . . . 0.0 108.871 175.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.429 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 18.4 m -57.52 -40.7 79.32 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 121.021 0.439 . . . . 0.0 110.094 174.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.559 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.8 mm -54.51 -47.19 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 123.814 0.846 . . . . 0.0 109.897 175.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 42' ' ' LYS . 63.4 mt -52.93 -50.7 42.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.364 -0.834 . . . . 0.0 112.538 -177.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.429 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 31.0 m-85 -57.91 -49.84 75.38 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 121.164 0.507 . . . . 0.0 110.436 -175.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.4 t -66.78 -47.75 81.96 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 CA-C-N 114.508 -1.224 . . . . 0.0 111.671 -174.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -65.84 -39.01 90.37 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.823 0.344 . . . . 0.0 110.85 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.9 t -69.32 -22.06 63.8 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.306 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.9 t -97.16 -0.92 46.1 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-O 121.346 0.593 . . . . 0.0 109.944 -178.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.573 ' O ' HG12 ' A' ' 56' ' ' ILE . 26.8 m-70 -134.42 32.79 3.33 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 95.2 mt -47.37 -51.35 19.92 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -172.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -62.53 -44.21 96.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.041 0.448 . . . . 0.0 111.104 -175.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.489 ' OE2' HD11 ' A' ' 27' ' ' ILE . 24.4 tt0 -60.76 -49.83 75.9 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 124.534 1.134 . . . . 0.0 110.17 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.573 HG12 ' O ' ' A' ' 52' ' ' HIS . 43.6 mm -55.75 -43.01 72.26 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.147 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.018 176.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 69.2 mtm180 -64.25 -34.46 78.16 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -61.35 -51.43 68.84 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 120.863 0.363 . . . . 0.0 110.947 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.424 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 48.7 m-80 -121.77 60.7 0.96 Allowed 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 121.346 0.593 . . . . 0.0 110.434 -177.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.653 ' HG2' ' OE1' ' A' ' 61' ' ' GLU . 4.3 ptpp? -65.07 -33.86 77.05 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.128 -177.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.653 ' OE1' ' HG2' ' A' ' 60' ' ' LYS . 3.1 mp0 -63.81 -45.87 87.67 Favored 'General case' 0 N--CA 1.414 -2.226 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.424 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.424 ' HB3' ' HB3' ' A' ' 59' ' ' ASN . 78.0 t80 -63.83 -52.39 60.35 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.124 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.442 ' HA ' HG12 ' A' ' 66' ' ' ILE . 51.3 m-85 -68.46 -34.61 76.25 Favored 'General case' 0 N--CA 1.432 -1.347 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -175.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.66 -43.77 65.46 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.343 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.3 mtm -67.67 -39.78 84.5 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.665 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.527 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.8 pt -67.2 -41.59 86.99 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.993 0 C-N-CA 118.342 -1.343 . . . . 0.0 110.732 177.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.526 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.2 -36.57 68.55 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 121.141 0.496 . . . . 0.0 111.144 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -68.55 -55.29 12.16 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.738 177.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.465 HD11 ' HB2' ' A' ' 8' ' ' GLU . 86.8 mt -61.53 -38.96 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.837 -178.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.597 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 93.1 mt -56.65 -48.05 78.42 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 123.069 0.548 . . . . 0.0 111.347 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 69.8 mt-30 -66.21 -46.63 76.6 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -55.51 -52.46 63.62 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.817 1.647 . . . . 0.0 112.386 -176.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -90.13 -14.83 32.82 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -175.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.597 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.36 -28.32 67.85 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.354 0.597 . . . . 0.0 109.4 174.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -73.56 -22.14 60.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.106 176.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -96.3 -51.15 4.5 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.6 pt -119.79 -30.83 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.495 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 136.53 173.66 13.02 Favored Glycine 0 C--O 1.212 -1.24 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -178.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.5 tp -91.91 -40.59 12.45 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.105 0 CA-C-N 118.362 1.081 . . . . 0.0 110.506 -174.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -59.66 -33.97 72.23 Favored 'General case' 0 N--CA 1.421 -1.876 0 C-N-CA 123.975 0.91 . . . . 0.0 110.218 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.527 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 12.2 m120 -69.39 -48.14 62.07 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.396 -1.275 . . . . 0.0 109.366 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 78' ' ' GLY . 44.2 t -66.57 -38.55 81.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.3 -178.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -56.4 -45.61 80.54 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.257 0.551 . . . . 0.0 110.392 177.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -44.92 94.63 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 87.0 mt -59.43 -42.31 91.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.452 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.6 mm -64.08 -38.76 83.27 Favored 'Isoleucine or valine' 0 C--O 1.269 2.114 0 C-N-CA 122.637 0.375 . . . . 0.0 110.685 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.75 -40.5 95.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.562 0.696 . . . . 0.0 110.131 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 49.7 m -62.07 -33.27 74.11 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.322 177.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -69.7 -34.57 74.1 Favored 'General case' 0 CA--C 1.562 1.415 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.451 HD12 ' HA ' ' A' ' 21' ' ' PHE . 23.8 pt . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -176.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 13.1 t70 . . . . . 0 N--CA 1.436 -1.165 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 6.2 Cg_exo -71.23 -24.59 23.06 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.99 2.46 . . . . 0.0 112.721 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.458 ' HB2' HD11 ' A' ' 69' ' ' ILE . 6.0 mm-40 -75.52 -37.83 59.83 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -59.46 -44.51 92.98 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.955 178.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.6 p -65.77 -37.36 79.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.19 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -70.68 -29.17 65.41 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.175 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 64.1 mt -61.11 -39.32 89.53 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.212 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.576 ' HG2' HG23 ' A' ' 89' ' ' THR . 59.4 mtm180 -72.05 -27.19 62.53 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.082 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 . . . . . 0 C--N 1.318 -0.767 0 CA-C-O 121.455 0.645 . . . . 0.0 109.736 176.758 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.9 m . . . . . 0 N--CA 1.446 -0.662 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -76.84 123.88 26.89 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -53.6 -38.37 63.92 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 123.607 0.763 . . . . 0.0 110.824 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -70.97 -31.22 67.71 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.57 -173.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.566 ' O ' HG12 ' A' ' 27' ' ' ILE . 34.8 tp -76.42 -41.71 46.68 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.695 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.454 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 62.1 t -63.11 -44.09 99.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 177.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 62.3 ttp -57.32 -35.13 69.47 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.118 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -74.64 -41.93 59.47 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.999 177.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.566 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.62 -49.93 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-O 121.488 0.661 . . . . 0.0 109.314 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 78.6 mt -61.96 -40.5 95.78 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.548 -1.205 . . . . 0.0 110.406 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -64.3 -47.38 79.7 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.781 0.801 . . . . 0.0 110.827 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -62.28 -42.69 99.56 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.992 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.404 HG21 HD13 ' A' ' 45' ' ' ILE . 32.8 pt -71.87 -38.38 64.86 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.481 175.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.87 -50.73 72.92 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.069 0.948 . . . . 0.0 111.239 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -65.21 -32.41 74.07 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.38 -179.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.42 ' N ' HD12 ' A' ' 33' ' ' LEU . 20.3 t70 -75.73 -48.5 21.61 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.141 0.496 . . . . 0.0 111.08 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.545 HD22 ' HB ' ' A' ' 41' ' ' ILE . 57.1 tp . . . . . 0 C--N 1.317 -0.816 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.29 -178.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.545 ' HB ' HD22 ' A' ' 35' ' ' LEU . 12.7 tt . . . . . 0 C--O 1.217 -0.647 0 CA-C-O 121.073 0.463 . . . . 0.0 109.892 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.473 ' O ' HG13 ' A' ' 46' ' ' ILE . 10.2 ptmm? -59.35 -36.45 75.74 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.195 176.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 19.0 m -79.62 -35.61 39.2 Favored 'General case' 0 N--CA 1.417 -2.09 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.286 -178.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.8 m -59.22 -43.48 92.31 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 41' ' ' ILE . 29.8 mm -55.44 -41.29 62.17 Favored 'Isoleucine or valine' 0 C--N 1.346 0.419 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.008 177.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 42' ' ' LYS . 70.4 mt -57.37 -51.06 74.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.557 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -62.35 -52.44 63.62 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.564 0.697 . . . . 0.0 110.258 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.9 t -62.0 -46.95 95.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 114.585 -1.189 . . . . 0.0 112.084 -174.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -66.46 -36.44 82.78 Favored 'General case' 0 C--O 1.212 -0.888 0 C-N-CA 121.173 -0.211 . . . . 0.0 111.545 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.1 m -72.73 -25.4 61.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.979 0.418 . . . . 0.0 111.444 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.6 t -83.65 -40.39 19.04 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-O 121.167 0.508 . . . . 0.0 110.561 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.474 ' O ' HG12 ' A' ' 56' ' ' ILE . 64.1 m-70 -103.21 35.52 2.53 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.445 -175.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.1 mt -47.14 -43.17 20.62 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -175.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -53.99 -51.12 64.93 Favored 'General case' 0 C--N 1.318 -0.781 0 O-C-N 123.557 0.536 . . . . 0.0 112.226 -175.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 58' ' ' LYS . 12.8 tp10 -73.9 -34.36 64.36 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.044 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.474 HG12 ' O ' ' A' ' 52' ' ' HIS . 46.3 mm -61.19 -37.44 77.49 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -73.56 -43.15 60.57 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.682 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 55' ' ' GLU . 53.6 mtpt -58.33 -50.24 74.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.248 0.547 . . . . 0.0 111.565 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -120.02 54.14 1.04 Allowed 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 122.035 0.921 . . . . 0.0 110.39 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -53.47 -37.53 62.76 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 113.764 -1.562 . . . . 0.0 112.932 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -60.98 -46.82 89.2 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 120.954 0.406 . . . . 0.0 110.59 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -63.36 -51.02 67.63 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.056 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.508 ' HA ' HG12 ' A' ' 66' ' ' ILE . 85.9 m-85 -70.4 -28.16 64.86 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -175.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -75.68 -44.34 42.74 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.134 177.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.7 mtm -62.76 -45.77 91.13 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.038 178.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.508 HG12 ' HA ' ' A' ' 63' ' ' TYR . 44.0 pt -64.82 -36.9 78.82 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.217 0 C-N-CA 119.354 -0.938 . . . . 0.0 111.276 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.545 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -53.53 -46.63 70.22 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.351 0.407 . . . . 0.0 112.006 -177.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -76.3 -35.61 58.77 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.144 -0.622 . . . . 0.0 112.014 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.458 HD11 ' HB2' ' A' ' 8' ' ' GLU . 82.3 mt -64.05 -45.29 97.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 177.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.582 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.9 mt -52.88 -45.95 67.71 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 123.461 0.704 . . . . 0.0 110.988 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.545 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.0 mt-30 -66.29 -48.39 70.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.472 0.653 . . . . 0.0 110.52 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 39.5 ttm180 -59.19 -50.95 72.05 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.245 1.418 . . . . 0.0 111.436 -177.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -86.56 -15.44 39.93 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -176.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.582 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.37 -34.8 78.04 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.2 174.419 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -74.88 -39.58 61.42 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.008 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -75.26 -47.06 29.82 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -174.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.8 pt -123.39 -30.72 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 O-C-N 121.721 -0.612 . . . . 0.0 112.569 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.504 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.95 142.5 5.89 Favored Glycine 0 C--N 1.309 -0.929 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.409 ' HB ' ' HB2' ' A' ' 74' ' ' TYR . 8.2 tp -61.14 -38.45 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 117.096 0.448 . . . . 0.0 111.876 -174.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -53.47 -45.75 69.68 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.713 0.768 . . . . 0.0 110.475 179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.469 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 42.6 m-80 -65.59 -45.68 82.28 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.189 -1.368 . . . . 0.0 110.195 -178.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 78' ' ' GLY . 15.0 t -65.01 -45.66 93.92 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.12 -176.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -55.56 -43.75 76.18 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.335 0.588 . . . . 0.0 110.844 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -45.49 83.7 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 98.7 mt -62.39 -39.67 93.97 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.669 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.473 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.5 mm -62.89 -40.48 88.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-O 120.847 0.356 . . . . 0.0 110.073 177.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 98.6 mt -63.71 -38.62 91.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.867 0.842 . . . . 0.0 110.32 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.7 m -67.07 -34.36 77.5 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.033 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.576 HG23 ' HG2' ' A' ' 13' ' ' ARG . 56.4 m -64.95 -46.21 82.53 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 124.324 1.05 . . . . 0.0 110.805 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.9 pt . . . . . 0 C--O 1.239 0.506 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -177.481 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.449 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 7.1 t70 . . . . . 0 C--O 1.247 0.964 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 2.9 Cg_exo -72.1 -30.36 13.52 Favored 'Trans proline' 0 C--O 1.241 0.638 0 C-N-CA 122.848 2.366 . . . . 0.0 113.108 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -76.2 -28.73 57.35 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -64.43 -41.82 96.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.389 178.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 7' ' ' PRO . 10.3 p -63.44 -34.86 69.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -59.18 -43.85 92.17 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.358 171.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.71 -35.48 78.17 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 122.907 0.483 . . . . 0.0 110.962 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -61.5 -36.78 81.45 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.185 0.594 . . . . 0.0 110.641 177.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 . . . . . 0 C--N 1.313 -1.02 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.996 179.153 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.402 HG21 HG21 ' A' ' 24' ' ' VAL . 31.0 m . . . . . 0 N--CA 1.448 -0.526 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.417 ' O ' HG23 ' A' ' 24' ' ' VAL . 79.5 m-20 -84.32 110.54 18.67 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 120.072 -0.651 . . . . 0.0 109.671 173.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.411 ' CE1' HD22 ' A' ' 87' ' ' LEU . 52.5 t80 -48.82 -47.94 41.98 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.319 1.048 . . . . 0.0 112.888 -178.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -64.65 -31.88 73.29 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -176.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.628 ' O ' HG12 ' A' ' 27' ' ' ILE . 31.1 tp -76.79 -40.63 47.48 Favored 'General case' 0 N--CA 1.426 -1.648 0 C-N-CA 119.819 -0.752 . . . . 0.0 110.067 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 20' ' ' ASN . 53.9 t -60.55 -42.3 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 177.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -57.2 -44.38 83.58 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.356 176.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -68.24 -38.13 81.53 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.943 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.628 HG12 ' O ' ' A' ' 23' ' ' LEU . 49.6 mm -56.81 -51.71 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.02 -40.98 97.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.493 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -66.02 -47.52 74.17 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.509 0.671 . . . . 0.0 111.35 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -62.02 -39.71 93.2 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.703 -176.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.473 HG23 HG21 ' A' ' 48' ' ' VAL . 31.0 pt -73.01 -39.21 57.33 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.234 175.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.99 -52.93 63.31 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.7 0.8 . . . . 0.0 111.406 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -66.6 -28.78 68.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -178.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -76.09 -49.71 16.7 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.633 0.73 . . . . 0.0 109.816 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 63.8 tp . . . . . 0 C--N 1.318 -0.766 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.276 -178.871 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.509 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.8 tt . . . . . 0 N--CA 1.451 -0.378 0 N-CA-C 111.506 0.187 . . . . 0.0 111.506 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -66.46 -31.72 72.64 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.834 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.2 m -73.12 -41.61 63.81 Favored 'General case' 0 N--CA 1.426 -1.67 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 177.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.458 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 15.6 m -59.63 -39.71 85.21 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.783 177.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 41' ' ' ILE . 23.8 mm -52.39 -46.74 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 124.054 0.942 . . . . 0.0 110.278 175.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 60.2 mt -57.69 -47.66 85.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.986 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.458 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 19.5 m-85 -59.75 -42.59 93.58 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.812 0.815 . . . . 0.0 110.299 -177.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.473 HG21 HG23 ' A' ' 31' ' ' ILE . 46.5 t -71.85 -49.22 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.75 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.364 -176.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.417 ' HA ' HG13 ' A' ' 56' ' ' ILE . 4.1 m-30 -62.98 -40.39 97.58 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.764 -178.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.5 t -66.78 -31.25 71.76 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 122.58 0.352 . . . . 0.0 111.665 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.7 t -84.68 -27.57 26.96 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.136 0.493 . . . . 0.0 111.008 -178.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.56 ' O ' HG12 ' A' ' 56' ' ' ILE . 83.1 m-70 -117.15 35.36 4.68 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -174.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 81.6 mt -47.13 -40.0 14.65 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 -174.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -56.78 -51.27 69.58 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -174.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -72.99 -32.61 65.29 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.185 0.517 . . . . 0.0 109.648 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.56 HG12 ' O ' ' A' ' 52' ' ' HIS . 44.9 mm -62.7 -45.4 98.93 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.786 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.623 -178.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.3 ptp85 -77.22 -28.06 53.67 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.224 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.504 ' HD2' ' ND2' ' A' ' 59' ' ' ASN . 0.0 OUTLIER -69.33 -32.6 71.81 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -175.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.504 ' ND2' ' HD2' ' A' ' 58' ' ' LYS . 55.8 m-80 -128.47 55.34 1.7 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.357 174.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -63.7 -24.08 67.63 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.522 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -63.86 -57.53 9.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 175.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -59.53 -51.21 70.83 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.692 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.455 ' HA ' HG12 ' A' ' 66' ' ' ILE . 72.6 m-85 -67.59 -26.12 66.11 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -176.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -77.07 -46.05 24.96 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.611 176.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.5 mtm -59.09 -50.59 73.48 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.664 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.7 pt -63.31 -41.69 93.66 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.698 0 C-N-CA 119.617 -0.833 . . . . 0.0 112.038 -178.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.54 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.85 -39.65 74.65 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.046 0.45 . . . . 0.0 110.91 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.56 -52.49 31.26 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.578 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.8 mt -60.34 -42.91 92.45 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.6 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 98.0 mt -52.66 -46.72 67.29 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 123.277 0.631 . . . . 0.0 111.265 178.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 63.7 mt-30 -68.57 -43.31 76.86 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.015 0.436 . . . . 0.0 110.565 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -62.07 -47.56 84.12 Favored 'General case' 0 N--CA 1.428 -1.534 0 C-N-CA 123.755 0.822 . . . . 0.0 111.556 -178.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -85.75 -15.48 42.01 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 -177.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.551 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.01 -33.3 75.27 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 174.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -73.46 -34.71 65.51 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.483 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -85.35 -51.46 6.55 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.161 0.801 . . . . 0.0 113.161 -175.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.0 pt -118.48 -29.11 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -173.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.543 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.95 143.91 6.21 Favored Glycine 0 N--CA 1.438 -1.186 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.0 tp -61.33 -37.16 76.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 122.44 0.296 . . . . 0.0 111.243 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -65.02 -35.5 81.38 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.627 -177.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.627 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.4 t-20 -67.73 -45.53 74.74 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.824 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.1 t -66.77 -38.22 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.626 -177.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.462 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 47.3 t-20 -50.78 -50.0 56.99 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.126 0.97 . . . . 0.0 108.898 177.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -40.84 81.96 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.109 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 81.5 mt -61.16 -42.01 97.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.528 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.6 mm -64.42 -44.47 97.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 177.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 80.9 mt -61.38 -34.71 75.78 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.267 0.556 . . . . 0.0 110.948 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.8 m -66.47 -46.33 76.72 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.235 177.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.6 m -64.27 -35.28 80.32 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.436 0.694 . . . . 0.0 111.864 -175.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.5 pt . . . . . 0 C--O 1.242 0.694 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -179.23 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.433 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 18.2 t70 . . . . . 0 C--O 1.244 0.801 0 N-CA-C 112.727 0.639 . . . . 0.0 112.727 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.485 ' O ' HG12 ' A' ' 10' ' ' VAL . 7.2 Cg_exo -71.85 -24.6 21.0 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.462 2.774 . . . . 0.0 113.866 176.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.34 -38.52 74.87 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -178.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -59.81 -38.84 83.13 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.581 176.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 7' ' ' PRO . 8.6 p -69.49 -33.85 59.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.171 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.12 -36.42 79.67 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 175.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.421 HD21 ' HB2' ' A' ' 65' ' ' MET . 98.0 mt -63.71 -41.93 98.02 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.139 0.495 . . . . 0.0 110.424 176.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -64.04 -30.65 71.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.7 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.71 178.112 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.518 HG11 ' CD2' ' A' ' 62' ' ' PHE . 24.7 m . . . . . 0 C--O 1.25 1.124 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.465 ' O ' HG23 ' A' ' 24' ' ' VAL . 18.3 t-20 -87.86 115.87 25.62 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -51.76 -38.44 55.47 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.462 0.476 . . . . 0.0 111.665 -178.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -72.88 -36.06 67.26 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.406 -172.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.618 ' O ' HG12 ' A' ' 27' ' ' ILE . 25.8 tp -76.64 -39.1 53.4 Favored 'General case' 0 N--CA 1.415 -2.196 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.987 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.469 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 72.8 t -57.84 -46.65 87.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 174.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 54.6 ttp -58.13 -40.0 80.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.055 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 -68.91 -41.06 78.73 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.229 175.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.618 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.3 mm -57.02 -51.93 62.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 177.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.7 mt -62.39 -38.09 88.28 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 114.515 -1.221 . . . . 0.0 110.541 -179.099 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -69.09 -46.16 68.45 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.136 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -61.86 -43.29 99.15 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.159 -176.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.416 ' CD1' HD13 ' A' ' 70' ' ' LEU . 39.4 pt -71.5 -38.73 69.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.599 177.103 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -59.03 -52.97 63.45 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 123.082 0.553 . . . . 0.0 111.363 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.426 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.6 pp -58.36 -37.35 75.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 120.823 0.344 . . . . 0.0 111.527 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.426 ' N ' HD12 ' A' ' 33' ' ' LEU . 27.8 t70 -73.78 -45.96 48.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.208 0.528 . . . . 0.0 110.328 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 C--N 1.315 -0.927 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.513 -177.346 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.513 HD13 ' HA ' ' A' ' 71' ' ' GLN . 9.7 tt . . . . . 0 N--CA 1.447 -0.599 0 CA-C-O 120.455 0.169 . . . . 0.0 111.274 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.536 ' O ' HG13 ' A' ' 46' ' ' ILE . 20.5 ptmt -67.94 -33.66 75.1 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 119.464 -0.895 . . . . 0.0 110.372 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.6 m -72.9 -33.69 66.18 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.463 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 14.0 m -62.05 -44.95 95.58 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 173.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.495 ' HB ' ' O ' ' A' ' 42' ' ' LYS . 27.6 mm -52.94 -48.45 51.6 Favored 'Isoleucine or valine' 0 C--N 1.344 0.351 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.468 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 42' ' ' LYS . 72.0 mt -55.38 -49.73 70.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.726 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.463 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 13.1 m-85 -58.43 -45.16 89.03 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 122.256 1.027 . . . . 0.0 110.481 -178.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 44' ' ' SER . 57.8 t -73.12 -49.26 39.66 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.771 0 CA-C-N 114.248 -1.342 . . . . 0.0 111.308 -173.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -63.5 -35.91 82.02 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.522 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.7 p -73.59 -22.18 60.12 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.068 0.461 . . . . 0.0 111.718 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.6 t -90.45 -25.95 20.08 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.651 0.739 . . . . 0.0 110.134 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.5 ' O ' HG12 ' A' ' 56' ' ' ILE . 81.2 m-70 -118.7 36.61 4.35 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 121.911 -0.493 . . . . 0.0 109.894 -175.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.5 mt -48.7 -44.11 37.74 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -175.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -56.61 -45.35 81.49 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 123.27 0.356 . . . . 0.0 111.936 -175.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -67.36 -44.77 78.18 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.621 0.724 . . . . 0.0 109.625 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 52' ' ' HIS . 45.6 mm -59.59 -46.57 92.99 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.862 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.294 -176.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -72.61 -24.56 61.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.898 0.38 . . . . 0.0 111.095 -178.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -72.78 -46.52 52.9 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.553 0.692 . . . . 0.0 109.47 -177.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.497 ' HB2' ' CE2' ' A' ' 63' ' ' TYR . 4.6 m120 -117.37 46.33 1.73 Allowed 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 -177.105 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.66 -34.59 18.84 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.114 1.366 . . . . 0.0 114.56 -173.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -67.09 -48.28 68.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.394 0.616 . . . . 0.0 110.311 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.518 ' CD2' HG11 ' A' ' 19' ' ' VAL . 85.4 t80 -64.03 -51.3 64.85 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.811 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.509 ' HA ' HG12 ' A' ' 66' ' ' ILE . 82.1 m-85 -66.22 -26.15 67.25 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -175.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.42 -47.24 17.95 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 119.442 -0.903 . . . . 0.0 111.051 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.421 ' HB2' HD21 ' A' ' 12' ' ' LEU . 76.3 mtm -65.74 -36.09 82.58 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.073 -178.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.509 HG12 ' HA ' ' A' ' 63' ' ' TYR . 41.2 pt -67.19 -38.33 80.87 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.669 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.33 175.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -57.27 -42.02 80.83 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.918 0.39 . . . . 0.0 110.139 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -62.04 -56.47 18.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.013 176.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 99.2 mt -60.97 -40.87 86.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.686 0.795 . . . . 0.0 112.403 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.505 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 88.2 mt -55.1 -49.64 71.21 Favored 'General case' 0 C--O 1.212 -0.906 0 C-N-CA 123.208 0.603 . . . . 0.0 112.015 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.523 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 49.4 mt-30 -69.02 -50.25 50.45 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 122.101 0.953 . . . . 0.0 109.361 -178.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -55.88 -47.13 77.94 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.137 -1.847 . . . . 0.0 111.901 -176.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -88.87 -15.93 33.21 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.505 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.79 -32.95 73.88 Favored 'General case' 0 N--CA 1.439 -0.989 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.775 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -69.15 -28.21 66.23 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.427 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -90.81 -52.17 5.0 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.9 pt -119.2 -27.67 2.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.51 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 120.62 144.12 6.98 Favored Glycine 0 C--N 1.305 -1.161 0 C-N-CA 120.411 -0.899 . . . . 0.0 110.872 178.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.3 tp -61.56 -38.5 80.36 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 C-N-CA 122.44 0.296 . . . . 0.0 111.739 -174.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -55.84 -44.28 77.83 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 122.541 1.162 . . . . 0.0 109.706 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.52 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 51.0 m-80 -67.64 -44.34 78.18 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 113.557 -1.656 . . . . 0.0 110.982 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.9 t -67.69 -39.87 82.92 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.175 -177.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -55.76 -45.37 78.09 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.276 0.56 . . . . 0.0 110.779 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -41.75 95.5 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 89.1 mt -62.13 -42.14 98.95 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.423 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 82' ' ' VAL . 51.1 mm -63.96 -39.12 84.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.887 0.375 . . . . 0.0 110.094 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.88 -39.44 94.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.404 0.621 . . . . 0.0 110.109 176.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 27.3 m -66.89 -33.82 76.44 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.103 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 47.3 m -60.76 -42.88 98.34 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.905 0.882 . . . . 0.0 111.12 -178.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 23.7 pt . . . . . 0 C--N 1.311 -1.088 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.398 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.1 t70 . . . . . 0 N--CA 1.439 -1.001 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.538 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 26.5 Cg_exo -63.12 -30.6 75.45 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 123.067 2.512 . . . . 0.0 113.23 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.39 -41.75 46.76 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -178.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -57.29 -46.21 83.38 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.684 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.0 p -64.42 -34.57 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.67 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 64.1 mttp -62.63 -44.66 95.72 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 175.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.7 mt -58.45 -42.11 86.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.804 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -59.67 -37.19 78.08 Favored 'General case' 0 N--CA 1.476 0.838 0 O-C-N 123.444 0.465 . . . . 0.0 111.21 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 . . . . . 0 C--N 1.314 -0.976 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.817 -179.297 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 6.5 m . . . . . 0 CA--C 1.503 -0.844 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -67.85 133.53 49.33 Favored 'General case' 0 C--N 1.309 -1.194 0 O-C-N 124.109 0.881 . . . . 0.0 109.1 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -57.16 -39.76 75.9 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.417 0.627 . . . . 0.0 110.63 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -72.09 -29.19 63.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.552 -175.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.52 HD21 ' CD ' ' A' ' 55' ' ' GLU . 61.0 tp -70.24 -45.26 66.84 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.676 178.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.86 -40.84 88.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.407 ' HA ' HD21 ' A' ' 87' ' ' LEU . 41.5 ttm -57.31 -41.54 80.09 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.23 174.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -66.85 -43.05 84.65 Favored 'General case' 0 C--O 1.208 -1.126 0 O-C-N 123.217 0.323 . . . . 0.0 110.92 177.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.463 HD11 ' OE2' ' A' ' 55' ' ' GLU . 47.3 mm -56.97 -50.04 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.319 0.58 . . . . 0.0 109.839 178.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.8 mt -63.56 -42.07 98.38 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.893 -1.048 . . . . 0.0 110.534 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -62.96 -46.23 88.73 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 123.719 0.808 . . . . 0.0 110.458 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -63.68 -47.79 79.82 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.77 -177.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.418 ' CD1' HD13 ' A' ' 70' ' ' LEU . 38.2 pt -66.67 -40.4 86.07 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.077 178.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.04 -46.45 89.5 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 123.585 0.754 . . . . 0.0 111.641 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.413 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.3 pp -60.07 -37.32 79.54 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -177.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.413 ' N ' HD12 ' A' ' 33' ' ' LEU . 20.1 t70 -76.06 -51.09 13.01 Favored 'General case' 0 CA--C 1.508 -0.646 0 O-C-N 123.412 0.445 . . . . 0.0 110.306 177.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.445 HD21 ' CD2' ' A' ' 74' ' ' TYR . 57.0 tp . . . . . 0 N--CA 1.473 0.695 0 C-N-CA 124.683 1.193 . . . . 0.0 113.322 -175.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.528 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.7 tt . . . . . 0 C--O 1.214 -0.786 0 CA-C-O 120.725 0.297 . . . . 0.0 110.764 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.501 ' O ' HG13 ' A' ' 46' ' ' ILE . 21.0 ptmt -63.44 -34.45 77.77 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.182 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.1 m -76.65 -33.09 58.32 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.498 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 13.2 m -63.52 -40.38 96.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 41' ' ' ILE . 36.1 mm -54.87 -48.37 74.33 Favored 'Isoleucine or valine' 0 C--N 1.346 0.446 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.199 174.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 42' ' ' LYS . 72.7 mt -53.89 -48.69 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.438 -178.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.498 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 18.5 m-85 -58.89 -53.01 63.27 Favored 'General case' 0 C--O 1.244 0.788 0 CA-C-O 121.225 0.536 . . . . 0.0 109.844 -177.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.4 t -62.44 -49.81 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.543 -176.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -65.55 -33.96 77.15 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 39.9 m -75.42 -21.93 57.81 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.918 0.389 . . . . 0.0 111.917 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.9 t -93.53 -8.81 40.31 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.973 0.892 . . . . 0.0 109.429 179.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.562 ' O ' HG12 ' A' ' 56' ' ' ILE . 35.6 m-70 -126.46 30.96 5.46 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.158 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.2 mt -48.85 -56.55 8.4 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -170.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.623 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 17.3 t70 -62.27 -44.08 97.36 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.42 -175.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.535 ' HB3' ' O ' ' A' ' 52' ' ' HIS . 26.7 tt0 -53.81 -51.22 64.2 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 124.819 1.248 . . . . 0.0 110.111 175.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 52' ' ' HIS . 51.7 mm -58.57 -44.25 88.97 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.721 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.241 177.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 -65.12 -33.66 76.54 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 178.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.623 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 66.4 mttm -56.85 -47.52 80.18 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.074 0.464 . . . . 0.0 109.778 178.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -127.67 65.42 1.34 Allowed 'General case' 0 C--N 1.317 -0.848 0 CA-C-O 121.982 0.896 . . . . 0.0 110.429 -178.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -66.09 -33.66 76.3 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 114.534 -1.212 . . . . 0.0 112.605 -176.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -65.03 -47.1 78.61 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.279 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -62.5 -52.14 64.65 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.294 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 56' ' ' ILE . 45.0 m-85 -66.82 -30.54 70.75 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -176.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -78.6 -40.12 35.43 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.975 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.6 mtm -63.63 -43.16 97.65 Favored 'General case' 0 CA--C 1.502 -0.886 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.654 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 36.8 pt -64.68 -38.54 82.93 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.246 0 C-N-CA 119.39 -0.924 . . . . 0.0 111.369 178.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.55 -34.0 68.7 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 121.205 0.526 . . . . 0.0 111.368 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -69.1 -54.49 14.7 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.2 mt -59.95 -44.1 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.269 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.578 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.2 mt -53.31 -51.76 61.33 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 123.451 0.701 . . . . 0.0 111.588 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.494 ' HG2' HG23 ' A' ' 41' ' ' ILE . 46.4 mt-30 -65.41 -43.48 90.43 Favored 'General case' 0 C--O 1.257 1.458 0 CA-C-O 121.377 0.608 . . . . 0.0 110.802 -178.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -60.26 -49.03 79.21 Favored 'General case' 0 N--CA 1.426 -1.647 0 C-N-CA 124.538 1.135 . . . . 0.0 111.767 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -91.61 -15.1 29.08 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.578 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.07 -32.24 73.58 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.829 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -72.83 -24.26 60.87 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.531 175.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -98.01 -51.79 3.92 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -172.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.3 pt -110.75 -29.52 2.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.254 0 C-N-CA 119.898 -0.721 . . . . 0.0 112.478 -176.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.512 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 123.19 147.53 7.37 Favored Glycine 0 C--N 1.306 -1.106 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.5 tp -63.81 -35.62 73.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.949 0.374 . . . . 0.0 111.637 -176.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.98 -44.52 94.44 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 122.282 1.039 . . . . 0.0 109.966 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.476 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 18.1 m120 -64.47 -45.71 86.2 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.772 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.4 t -66.72 -38.1 80.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.404 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 43.1 t-20 -52.92 -50.17 64.5 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.416 1.087 . . . . 0.0 109.38 177.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -44.24 81.47 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.208 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.7 mt -61.41 -44.39 97.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.14 -178.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.0 mm -62.96 -37.84 80.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 120.853 0.359 . . . . 0.0 110.343 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.407 HD21 ' HA ' ' A' ' 25' ' ' MET . 81.8 mt -62.31 -44.95 95.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.525 0.679 . . . . 0.0 110.399 176.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.3 m -64.31 -33.34 75.6 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.073 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.7 m -58.77 -45.7 89.18 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.668 0.787 . . . . 0.0 111.581 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 33.9 pt . . . . . 0 C--O 1.242 0.673 0 CA-C-O 120.967 0.413 . . . . 0.0 111.869 -178.086 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.545 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 10.2 t70 . . . . . 0 C--O 1.246 0.884 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.47 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 17.3 Cg_exo -64.34 -31.75 62.2 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.42 2.08 . . . . 0.0 113.094 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.83 -32.62 61.99 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.833 -175.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -69.59 -42.92 73.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.577 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.52 -34.19 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.322 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.7 mttt -60.23 -45.39 93.38 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.394 175.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.7 mt -56.55 -40.84 75.81 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.566 0.541 . . . . 0.0 111.871 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -71.0 -29.77 65.82 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.492 -177.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 . . . . . 0 C--N 1.313 -0.998 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.327 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.4 m . . . . . 0 N--CA 1.441 -0.922 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -63.5 130.26 43.62 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 122.632 0.373 . . . . 0.0 110.961 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -56.62 -39.45 73.63 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 123.461 0.704 . . . . 0.0 110.451 177.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.439 ' N ' HD22 ' A' ' 22' ' ' ASN . 0.8 OUTLIER -71.47 -28.82 64.2 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.193 -176.05 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.544 ' O ' HG12 ' A' ' 27' ' ' ILE . 59.3 tp -71.48 -49.43 41.33 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.33 178.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.445 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 47.5 t -63.03 -42.3 96.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.6 ttp -57.19 -39.85 76.18 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.056 177.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -69.82 -41.64 74.72 Favored 'General case' 0 C--O 1.215 -0.729 0 O-C-N 123.292 0.37 . . . . 0.0 111.11 177.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.7 mm -56.87 -47.6 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 177.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 79.5 mt -66.58 -42.49 86.88 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.469 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.05 -43.28 96.01 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 123.27 0.628 . . . . 0.0 110.639 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -61.64 -44.22 97.38 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.833 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.2 pt -72.79 -35.06 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.855 177.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -60.7 -49.11 78.81 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 123.648 0.779 . . . . 0.0 110.719 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 pp -69.41 -28.89 66.55 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.972 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -76.29 -49.55 16.7 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.015 0.436 . . . . 0.0 111.951 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 43.2 tp . . . . . 0 C--N 1.314 -0.961 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.756 -176.274 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.551 HG23 ' HG2' ' A' ' 71' ' ' GLN . 13.3 tt . . . . . 0 N--CA 1.441 -0.903 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.588 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.2 ptmt -60.74 -36.42 78.85 Favored 'General case' 0 C--O 1.211 -0.921 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.274 177.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.8 m -69.84 -37.81 76.28 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.483 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 34.7 m -64.83 -40.69 95.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 175.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 41' ' ' ILE . 38.6 mm -55.46 -49.1 75.69 Favored 'Isoleucine or valine' 0 C--N 1.345 0.373 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 174.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.588 HG13 ' O ' ' A' ' 42' ' ' LYS . 78.4 mt -53.5 -50.84 46.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.702 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.483 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 15.5 m-85 -57.82 -43.39 85.73 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.79 0.805 . . . . 0.0 111.078 -176.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.0 t -73.95 -46.88 44.88 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.877 -175.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -69.74 -27.43 64.95 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 122.775 0.43 . . . . 0.0 111.86 -178.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.5 p -79.48 -22.33 44.22 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.7 t -95.08 -36.54 11.48 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.781 0.8 . . . . 0.0 109.89 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.614 ' O ' HG12 ' A' ' 56' ' ' ILE . 78.9 m-70 -92.54 42.41 1.1 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.018 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -48.82 -48.02 41.87 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 125.353 1.461 . . . . 0.0 114.403 -175.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -61.3 -45.62 93.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 120.874 0.368 . . . . 0.0 111.417 -174.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.487 ' CG ' HD21 ' A' ' 23' ' ' LEU . 1.7 mp0 -55.4 -53.12 60.2 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 123.879 0.871 . . . . 0.0 110.22 176.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 52' ' ' HIS . 34.3 mm -60.91 -47.04 95.19 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-N 113.727 -1.579 . . . . 0.0 111.289 -176.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -69.95 -28.22 65.39 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -72.59 -49.25 33.57 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.24 0.543 . . . . 0.0 111.168 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -118.93 60.34 0.81 Allowed 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 122.071 0.938 . . . . 0.0 109.742 -176.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -55.35 -37.63 67.74 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 113.466 -1.697 . . . . 0.0 112.487 -176.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.481 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER -78.44 -31.73 48.21 Favored 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -176.307 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -68.04 -51.15 50.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.479 ' HA ' HG12 ' A' ' 66' ' ' ILE . 84.9 m-85 -69.08 -31.25 69.86 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.064 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.44 -51.11 64.81 Favored 'General case' 0 C--O 1.245 0.834 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.104 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 72.8 mtm -65.43 -39.6 92.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.41 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 36.8 pt -66.93 -43.21 89.47 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 C-N-CA 118.367 -1.333 . . . . 0.0 111.024 177.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.14 -39.7 75.69 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.817 0.341 . . . . 0.0 110.756 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 14.0 tp10 -58.69 -56.2 25.23 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.607 176.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.5 mt -65.88 -39.62 85.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 123.985 0.914 . . . . 0.0 112.946 -176.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.608 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 96.6 mt -53.36 -46.98 69.8 Favored 'General case' 0 C--O 1.217 -0.614 0 C-N-CA 122.615 0.366 . . . . 0.0 111.445 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.551 ' HG2' HG23 ' A' ' 41' ' ' ILE . 44.4 mt-30 -72.53 -49.16 34.61 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 122.304 1.049 . . . . 0.0 109.784 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 68' ' ' GLU . 19.6 ttt180 -53.45 -42.03 66.74 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 127.194 2.197 . . . . 0.0 111.725 -176.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.545 ' OH ' ' HB2' ' A' ' 6' ' ' ASP . 55.6 m-85 -100.48 -14.36 18.3 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -178.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.608 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.71 -28.4 68.4 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.636 -0.826 . . . . 0.0 109.781 178.64 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -74.96 -19.45 60.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.511 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -97.79 -50.31 4.49 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -174.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.8 pt -118.73 -29.81 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.541 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 125.61 146.69 6.78 Favored Glycine 0 CA--C 1.5 -0.852 0 C-N-CA 120.299 -0.953 . . . . 0.0 110.893 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.3 tp -64.61 -38.72 83.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.972 0.386 . . . . 0.0 111.798 -175.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -59.22 -38.96 81.21 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.943 0.878 . . . . 0.0 110.133 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.448 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 1.8 m-20 -69.35 -48.57 60.97 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.354 -1.294 . . . . 0.0 109.774 -179.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.9 t -62.9 -43.09 98.71 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.294 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.581 -177.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.432 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 95.5 m-20 -56.46 -44.9 80.97 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.094 0.474 . . . . 0.0 110.778 178.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -40.36 90.48 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.2 mt -65.26 -40.26 93.73 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.336 179.055 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.5 mm -62.81 -43.64 98.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 177.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 87.7 mt -59.69 -44.52 93.61 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.62 176.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.4 m -62.08 -34.22 75.87 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 121.233 0.539 . . . . 0.0 110.877 178.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 76.7 m -70.82 -31.91 68.79 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 123.177 0.591 . . . . 0.0 111.905 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.5 pt . . . . . 0 C--N 1.315 -0.93 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.383 178.327 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 13.8 t70 . . . . . 0 C--O 1.25 1.129 0 N-CA-C 110.601 -0.148 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.537 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 38.8 Cg_exo -62.38 -34.69 76.17 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.76 2.307 . . . . 0.0 113.206 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -76.21 -34.5 59.26 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.666 0.746 . . . . 0.0 109.598 -178.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -64.47 -41.36 96.55 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.63 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.27 -33.77 65.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 C-N-CA 120.595 -0.442 . . . . 0.0 109.962 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.3 mttt -61.05 -43.27 99.14 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 174.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.0 mt -56.64 -42.58 79.14 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.014 0.525 . . . . 0.0 111.245 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.1 mmt180 -59.47 -39.37 83.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.155 178.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 . . . . . 0 C--N 1.312 -1.044 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.262 -179.137 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.424 HG11 ' CE2' ' A' ' 63' ' ' TYR . 16.5 m . . . . . 0 N--CA 1.431 -1.413 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.422 ' O ' HG23 ' A' ' 24' ' ' VAL . 49.7 t-20 -66.71 125.27 25.3 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -54.1 -37.42 64.27 Favored 'General case' 0 C--N 1.321 -0.658 0 O-C-N 123.955 0.785 . . . . 0.0 111.091 178.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -68.11 -36.62 80.04 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.137 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.64 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.3 tp -76.45 -39.13 54.2 Favored 'General case' 0 N--CA 1.416 -2.148 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.186 -177.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 20' ' ' ASN . 61.8 t -58.17 -48.07 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 176.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 48.4 ttp -58.29 -40.47 82.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.331 177.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -70.65 -36.2 73.28 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.396 178.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.64 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -58.93 -51.74 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 176.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 78.1 mt -60.66 -38.14 83.89 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.613 -179.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -71.15 -47.14 59.53 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.925 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.419 ' OE2' HG22 ' A' ' 48' ' ' VAL . 15.4 tt0 -63.46 -42.9 98.63 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.375 -176.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.4 HG21 HD13 ' A' ' 45' ' ' ILE . 32.5 pt -68.67 -37.63 77.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.696 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.931 177.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.37 -52.5 65.38 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 123.203 0.601 . . . . 0.0 111.48 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.98 -29.26 69.62 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.208 -177.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -76.21 -46.91 26.05 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.004 0.43 . . . . 0.0 110.476 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 20.7 tp . . . . . 0 C--O 1.253 1.243 0 C-N-CA 124.223 1.009 . . . . 0.0 112.451 -179.726 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.52 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.4 tt . . . . . 0 N--CA 1.446 -0.658 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.476 ' O ' HG13 ' A' ' 46' ' ' ILE . 65.2 pttt -69.28 -28.41 66.27 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.836 -178.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.0 m -71.33 -43.8 66.33 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.353 -0.84 . . . . 0.0 108.966 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.4 m -59.52 -40.61 87.68 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.092 176.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 41' ' ' ILE . 26.7 mm -51.66 -45.66 37.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.948 0.899 . . . . 0.0 110.108 175.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 42' ' ' LYS . 70.2 mt -56.85 -51.8 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.441 -177.244 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -60.57 -43.86 96.83 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.432 0.634 . . . . 0.0 110.871 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.419 HG22 ' OE2' ' A' ' 30' ' ' GLU . 46.6 t -69.15 -45.96 78.79 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.023 -174.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -68.05 -37.94 81.9 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.259 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 75.7 p -70.51 -21.46 62.74 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.119 0.485 . . . . 0.0 112.033 -178.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.3 t -92.86 -48.14 6.69 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.972 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.477 ' O ' HG12 ' A' ' 56' ' ' ILE . 86.2 m-70 -96.15 41.07 1.11 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 -174.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 85.6 mt -47.66 -41.32 22.04 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.679 1.592 . . . . 0.0 114.386 -175.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -53.56 -52.93 58.16 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.556 0.535 . . . . 0.0 112.431 -172.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -73.56 -34.06 64.97 Favored 'General case' 0 C--O 1.249 1.063 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.263 -176.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.521 ' HA ' ' CD2' ' A' ' 63' ' ' TYR . 40.1 mm -59.4 -43.45 90.37 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.66 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 50.1 mtp180 -70.84 -28.09 64.34 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -60.71 -55.83 28.57 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-O 121.676 0.75 . . . . 0.0 110.447 174.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.3 m-80 -116.14 60.88 0.72 Allowed 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.514 -174.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -56.94 -36.65 70.49 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.544 -178.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -65.22 -39.47 92.81 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.682 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -64.6 -51.49 62.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.8 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.521 ' CD2' ' HA ' ' A' ' 56' ' ' ILE . 68.7 m-85 -68.72 -34.13 75.11 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -177.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -70.21 -45.49 66.48 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.858 0.361 . . . . 0.0 110.103 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.1 mtm -67.56 -41.74 83.74 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.244 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.513 HG12 ' HA ' ' A' ' 63' ' ' TYR . 43.7 pt -65.02 -35.96 76.69 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.013 0 C-N-CA 118.695 -1.202 . . . . 0.0 111.131 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.54 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -55.67 -44.56 77.38 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 123.409 0.443 . . . . 0.0 111.734 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -74.06 -37.96 64.09 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.375 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 90.3 mt -65.4 -42.42 93.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.543 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.609 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.6 mt -54.59 -46.13 73.73 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.728 178.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 64.2 mt-30 -62.34 -52.22 64.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.629 0.728 . . . . 0.0 109.828 179.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -58.9 -52.75 64.38 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.364 1.465 . . . . 0.0 112.403 -174.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -83.99 -22.54 31.34 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -175.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.609 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.98 -30.79 71.0 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 118.993 -1.083 . . . . 0.0 109.709 176.814 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -73.89 -19.84 60.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.943 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -99.66 -51.28 3.79 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.0 pt -113.95 -29.66 2.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.053 0.454 . . . . 0.0 111.803 -174.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.497 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 122.71 146.97 7.32 Favored Glycine 0 CA--C 1.491 -1.419 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 178.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tp -63.09 -35.91 73.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.938 0.369 . . . . 0.0 111.063 -175.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -55.36 -46.8 76.43 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-O 121.255 0.55 . . . . 0.0 110.729 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.466 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.0 t-20 -63.71 -49.49 72.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.237 -177.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 78' ' ' GLY . 20.6 t -62.59 -45.87 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.712 -175.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -53.83 -43.65 69.62 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.284 0.564 . . . . 0.0 111.26 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -44.46 78.59 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 84.6 mt -62.46 -38.07 88.39 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.637 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.475 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.4 mm -61.79 -41.94 92.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.09 -41.44 99.41 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.175 178.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.9 m -61.13 -34.29 74.74 Favored 'General case' 0 CA--C 1.555 1.161 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.985 176.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 36.5 m -63.4 -39.46 94.56 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 123.205 0.602 . . . . 0.0 111.453 -176.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 27.1 pt . . . . . 0 C--N 1.315 -0.925 0 CA-C-O 121.259 0.552 . . . . 0.0 111.748 179.989 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.462 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 18.2 t70 . . . . . 0 N--CA 1.439 -1.022 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.493 ' HA ' HG12 ' A' ' 10' ' ' VAL . 31.8 Cg_exo -61.97 -29.92 82.64 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.72 2.947 . . . . 0.0 113.95 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.98 -45.63 63.72 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -177.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -61.1 -44.83 96.76 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.313 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' A' ' 7' ' ' PRO . 9.2 p -62.62 -34.32 64.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 120.936 0.398 . . . . 0.0 110.65 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HE3' ' SD ' ' A' ' 65' ' ' MET . 55.8 mtmt -65.66 -43.26 89.9 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 122.221 -0.299 . . . . 0.0 110.697 173.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 94.9 mt -57.73 -38.63 75.63 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.117 0.484 . . . . 0.0 110.893 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -59.46 -40.52 87.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.426 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 . . . . . 0 C--N 1.314 -0.94 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.192 179.552 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.407 HG21 HG21 ' A' ' 24' ' ' VAL . 29.3 m . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -86.06 128.4 34.86 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -57.08 -39.93 75.93 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 123.041 0.536 . . . . 0.0 111.998 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -72.56 -34.61 67.62 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -174.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.635 ' O ' HG12 ' A' ' 27' ' ' ILE . 38.5 tp -71.75 -41.92 67.86 Favored 'General case' 0 N--CA 1.425 -1.696 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.233 -177.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.447 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 91.0 t -66.18 -41.62 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 120.829 0.347 . . . . 0.0 110.098 178.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 50.7 ttp -61.23 -37.08 81.79 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.891 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -69.48 -40.62 76.95 Favored 'General case' 0 C--O 1.205 -1.239 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.545 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.635 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.6 mm -56.66 -47.17 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 94.1 mt -62.22 -44.79 95.77 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.996 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.92 -46.92 73.33 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.304 0.573 . . . . 0.0 110.503 -178.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -62.04 -40.84 97.09 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.102 -175.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.435 ' CD1' HD13 ' A' ' 70' ' ' LEU . 45.2 pt -72.98 -40.71 59.61 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.676 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.045 176.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.14 -49.7 76.17 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 122.98 0.512 . . . . 0.0 111.423 -178.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.47 -31.85 72.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.989 0.423 . . . . 0.0 111.154 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -75.35 -44.47 45.0 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 57.0 tp . . . . . 0 N--CA 1.477 0.916 0 C-N-CA 124.636 1.174 . . . . 0.0 112.807 179.7 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.536 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.5 tt . . . . . 0 N--CA 1.444 -0.766 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.459 ' O ' HG13 ' A' ' 46' ' ' ILE . 64.8 pttt -66.49 -34.61 78.31 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.668 178.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.2 m -64.25 -44.87 90.43 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 176.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.6 m -57.53 -41.66 81.33 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.643 176.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.0 mm -55.64 -44.78 78.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 123.476 0.71 . . . . 0.0 110.104 177.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 42' ' ' LYS . 68.3 mt -52.27 -51.05 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.372 0.669 . . . . 0.0 111.875 -178.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -63.72 -52.74 59.17 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.438 0.637 . . . . 0.0 110.716 -176.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.8 t -62.53 -43.4 98.35 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.039 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.414 ' CE2' ' HB3' ' A' ' 63' ' ' TYR . 2.1 m-85 -72.19 -31.51 65.96 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.286 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.425 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 29.2 t -73.78 -31.27 63.21 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.384 0.612 . . . . 0.0 109.377 177.182 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.6 t -73.51 -53.39 10.7 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.424 178.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.521 ' O ' HG12 ' A' ' 56' ' ' ILE . 78.8 m-70 -100.68 42.62 1.1 Allowed 'General case' 0 C--N 1.304 -1.394 0 O-C-N 122.034 -0.416 . . . . 0.0 110.642 -172.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 50' ' ' SER . 82.1 mt -48.61 -38.75 21.72 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.529 1.132 . . . . 0.0 113.022 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -53.24 -50.81 64.01 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.402 ' HG3' ' CE2' ' A' ' 63' ' ' TYR . 14.3 tp10 -75.2 -34.04 61.46 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.209 177.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 52' ' ' HIS . 42.5 mm -60.34 -42.46 90.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-O 120.969 0.414 . . . . 0.0 110.39 -178.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.475 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 34.2 ptt180 -71.63 -33.65 69.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.07 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.3 tttm -66.56 -50.41 63.21 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 123.208 0.603 . . . . 0.0 109.615 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -114.71 60.38 0.68 Allowed 'General case' 0 CA--C 1.48 -1.725 0 CA-C-O 122.168 0.985 . . . . 0.0 111.279 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.475 ' HE3' ' O ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -55.59 -37.63 68.33 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 113.627 -1.624 . . . . 0.0 112.267 -177.088 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -70.93 -41.26 71.4 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 120.698 0.285 . . . . 0.0 110.78 -178.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.436 ' O ' HG12 ' A' ' 66' ' ' ILE . 83.3 t80 -62.91 -51.48 66.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.125 -178.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.533 ' HA ' HG12 ' A' ' 66' ' ' ILE . 93.4 m-85 -73.47 -24.69 60.23 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -177.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -72.93 -50.09 25.6 Favored 'General case' 0 C--O 1.265 1.902 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.475 ' SD ' ' HE3' ' A' ' 11' ' ' LYS . 79.2 mtm -65.37 -47.93 74.69 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.421 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.533 HG12 ' HA ' ' A' ' 63' ' ' TYR . 48.5 pt -63.95 -34.5 68.81 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.525 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.69 -178.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.536 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.01 -45.47 79.08 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 123.125 0.266 . . . . 0.0 111.614 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.71 -34.3 58.16 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 118.67 -1.212 . . . . 0.0 111.789 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 65' ' ' MET . 85.0 mt -60.59 -45.08 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.619 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 87.3 mt -55.65 -45.64 77.61 Favored 'General case' 0 C--O 1.21 -1.021 0 C-N-CA 123.535 0.734 . . . . 0.0 110.89 179.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.536 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.7 mt-30 -68.86 -49.34 59.14 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 121.31 0.576 . . . . 0.0 110.566 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -61.86 -49.17 77.32 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 124.161 0.984 . . . . 0.0 111.817 -177.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.469 ' CE2' ' HD3' ' A' ' 76' ' ' LYS . 63.6 m-85 -82.38 -16.9 47.45 Favored 'General case' 0 N--CA 1.427 -1.581 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -177.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.619 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.46 -29.79 69.33 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 172.651 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -79.63 -44.11 21.57 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.904 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.469 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 65.7 tttm -72.85 -44.82 60.91 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.76 -25.92 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.589 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 122.05 141.36 6.02 Favored Glycine 0 C--N 1.311 -0.824 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 178.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.3 tp -61.06 -37.66 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 117.202 0.501 . . . . 0.0 112.061 -173.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -60.41 -43.73 96.41 Favored 'General case' 0 C--O 1.244 0.796 0 CA-C-O 122.136 0.969 . . . . 0.0 109.667 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.422 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 94.0 m-20 -67.66 -40.39 84.49 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.729 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.5 t -66.52 -41.42 88.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.428 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.9 OUTLIER -52.43 -49.58 64.27 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 121.218 0.532 . . . . 0.0 110.199 177.559 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -44.9 92.09 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.401 -177.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.7 mt -66.18 -35.96 81.83 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.8 mm -65.53 -41.64 91.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 175.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 94.8 mt -63.34 -40.1 96.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.98 176.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 94.3 m -59.07 -33.61 71.0 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 123.859 0.864 . . . . 0.0 110.914 176.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.4 m -69.14 -48.29 62.77 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.94 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.2 pt . . . . . 0 C--O 1.237 0.434 0 CA-C-O 121.037 0.446 . . . . 0.0 112.061 -178.886 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.401 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 4.8 t70 . . . . . 0 N--CA 1.447 -0.608 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -65.57 -28.92 52.84 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.624 2.216 . . . . 0.0 112.522 175.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -74.84 -39.32 61.67 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 121.765 -0.584 . . . . 0.0 109.425 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -65.51 -44.04 88.22 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.143 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.07 -34.71 70.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 121.195 0.521 . . . . 0.0 110.14 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.4 mtmp? -67.83 -36.95 81.26 Favored 'General case' 0 C--O 1.198 -1.64 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.165 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.9 mt -59.29 -40.46 86.22 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.778 0.263 . . . . 0.0 111.337 176.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -61.37 -41.18 96.66 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.273 0.559 . . . . 0.0 111.644 177.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 . . . . . 0 C--N 1.305 -1.347 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.961 -178.426 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.465 HG21 HG21 ' A' ' 24' ' ' VAL . 19.7 m . . . . . 0 C--O 1.252 1.196 0 CA-C-O 120.946 0.403 . . . . 0.0 111.059 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -85.76 119.72 26.4 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 171.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -54.62 -35.96 63.99 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 123.486 0.491 . . . . 0.0 111.552 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -70.22 -35.0 73.57 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-O 121.252 0.548 . . . . 0.0 109.964 -176.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.602 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.1 tp -76.83 -42.32 40.75 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.16 -177.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.526 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 62.9 t -61.2 -43.6 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.8 ttp -60.52 -33.68 72.99 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.236 178.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -75.4 -38.86 59.64 Favored 'General case' 0 C--O 1.206 -1.212 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.613 176.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.2 mm -56.99 -52.39 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 121.331 0.586 . . . . 0.0 110.161 -179.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.552 ' HB2' ' OD1' ' A' ' 83' ' ' ASN . 3.2 pp -71.4 -30.57 66.25 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.582 -178.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -68.38 -44.37 75.3 Favored 'General case' 0 C--N 1.299 -1.587 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.019 176.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.19 -38.19 90.16 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.75 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.6 pt -70.15 -41.43 78.97 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.188 176.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.451 ' OE1' ' HG2' ' A' ' 80' ' ' GLU . 37.2 tt0 -59.13 -54.45 46.82 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.013 0.925 . . . . 0.0 111.383 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -63.63 -34.52 78.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -178.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.48 ' N ' HD12 ' A' ' 33' ' ' LEU . 18.4 t0 -76.28 -40.73 50.94 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.139 -178.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.9 tp . . . . . 0 C--O 1.249 1.059 0 C-N-CA 124.776 1.231 . . . . 0.0 111.792 179.827 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.568 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.5 tt . . . . . 0 CA--C 1.547 0.862 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.449 ' O ' HG13 ' A' ' 46' ' ' ILE . 58.6 pttt -61.75 -33.7 74.52 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.19 0.519 . . . . 0.0 110.445 175.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.4 m -74.55 -41.65 60.21 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.235 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.401 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 12.8 m -58.45 -40.77 83.5 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.835 175.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.568 HG12 ' O ' ' A' ' 41' ' ' ILE . 32.8 mm -54.34 -46.92 69.71 Favored 'Isoleucine or valine' 0 C--N 1.349 0.555 0 C-N-CA 123.815 0.846 . . . . 0.0 110.256 176.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 42' ' ' LYS . 71.8 mt -52.13 -51.43 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 123.481 0.712 . . . . 0.0 111.789 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.401 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 25.1 m-85 -59.73 -53.26 60.09 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.676 0.75 . . . . 0.0 110.971 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.1 t -66.83 -41.91 88.42 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.665 -174.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -68.86 -38.98 80.1 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.314 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.4 t -69.96 -26.71 64.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.417 0.627 . . . . 0.0 110.292 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.8 t -82.31 -48.21 11.46 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-O 121.341 0.591 . . . . 0.0 110.696 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.487 ' O ' HG12 ' A' ' 56' ' ' ILE . 73.9 m-70 -101.19 40.9 1.23 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.73 -174.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 89.5 mt -47.04 -39.87 13.71 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.332 1.453 . . . . 0.0 113.893 -177.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -54.14 -50.79 66.12 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -175.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -73.07 -35.79 66.74 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 120.991 0.424 . . . . 0.0 109.861 -178.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 52' ' ' HIS . 43.6 mm -58.58 -51.16 75.08 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.165 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.915 -179.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -77.47 -16.09 58.95 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -74.99 -48.56 23.57 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -116.83 53.55 0.89 Allowed 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.073 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -57.23 -39.96 76.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.012 -0.995 . . . . 0.0 113.408 -174.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -62.03 -37.27 84.31 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.268 0.556 . . . . 0.0 110.957 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -69.01 -49.3 58.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.897 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.544 ' HA ' HG12 ' A' ' 66' ' ' ILE . 72.9 m-85 -68.31 -33.45 74.34 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.19 -48.12 82.99 Favored 'General case' 0 C--O 1.254 1.339 0 CA-C-O 121.209 0.528 . . . . 0.0 109.882 177.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.421 ' O ' ' HB3' ' A' ' 68' ' ' GLU . 79.2 mtm -68.9 -45.8 69.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.82 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.545 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.6 pt -69.23 -37.86 76.79 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.448 0 C-N-CA 119.014 -1.075 . . . . 0.0 112.968 -177.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.12 -38.39 76.41 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.427 0.632 . . . . 0.0 109.815 177.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 65' ' ' MET . 19.3 tp10 -63.51 -56.38 16.48 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.27 176.191 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.6 mt -59.47 -39.08 78.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.208 0.603 . . . . 0.0 112.498 -178.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.8 mt -53.98 -50.95 65.4 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 122.658 0.383 . . . . 0.0 111.771 178.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -70.84 -49.4 46.65 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 122.241 1.02 . . . . 0.0 109.385 -178.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.417 ' HD2' ' OE2' ' A' ' 68' ' ' GLU . 29.0 ttt180 -54.93 -38.95 68.34 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 127.655 2.382 . . . . 0.0 111.797 -177.047 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.401 ' OH ' ' HB2' ' A' ' 6' ' ' ASP 0.257 28.6 m-85 -99.83 -14.69 18.69 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -178.652 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.436 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.26 -26.58 66.64 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 174.374 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -78.13 -17.87 56.36 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.653 176.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.418 ' HE2' ' HB3' ' A' ' 76' ' ' LYS . 52.8 mtpt -99.93 -51.57 3.67 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.389 0.614 . . . . 0.0 112.307 179.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.4 pt -117.37 -27.23 2.45 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.072 -173.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 116.83 148.66 8.95 Favored Glycine 0 N--CA 1.434 -1.46 0 C-N-CA 120.297 -0.954 . . . . 0.0 111.076 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.41 HD13 ' CD1' ' A' ' 41' ' ' ILE . 5.5 tp -59.71 -42.41 88.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -175.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.451 ' HG2' ' OE1' ' A' ' 32' ' ' GLU . 41.6 mt-10 -64.59 -35.85 82.34 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 121.151 0.5 . . . . 0.0 111.56 -176.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -64.51 -47.3 79.4 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.552 174.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.7 t -63.83 -42.32 95.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.08 -178.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.552 ' OD1' ' HB2' ' A' ' 28' ' ' LEU . 95.3 m-20 -51.92 -47.93 64.44 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.513 0.725 . . . . 0.0 111.307 177.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -45.02 76.92 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.295 -0.866 . . . . 0.0 108.868 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.404 ' O ' ' HB ' ' A' ' 88' ' ' THR . 95.7 mt -61.98 -39.59 92.72 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.9 mm -63.56 -40.2 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 120.915 0.388 . . . . 0.0 109.958 177.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 92.6 mt -64.35 -37.09 86.28 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.801 0.81 . . . . 0.0 109.467 177.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 85' ' ' LEU . 86.4 m -66.05 -34.31 77.78 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.59 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 m -64.48 -40.9 96.55 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 120.822 0.344 . . . . 0.0 110.508 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.0 pt . . . . . 0 C--N 1.318 -0.795 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -177.048 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.6 t70 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 120.396 0.141 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.492 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 39.4 Cg_exo -61.87 -28.03 80.86 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.165 2.576 . . . . 0.0 113.664 -179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 9.4 mm-40 -72.23 -32.21 66.53 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.586 -176.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -66.86 -44.11 81.83 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.349 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.8 p -67.44 -34.21 67.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-O 121.269 0.557 . . . . 0.0 109.859 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.492 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 68.5 mttm -62.37 -42.65 99.58 Favored 'General case' 0 C--O 1.207 -1.17 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.731 174.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 92.9 mt -58.62 -34.97 71.76 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.586 0.231 . . . . 0.0 111.564 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.4 mmm180 -63.86 -32.02 73.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.117 0.484 . . . . 0.0 110.416 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 . . . . . 0 C--N 1.316 -0.869 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.356 177.987 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 m . . . . . 0 N--CA 1.445 -0.709 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.43 ' O ' HG23 ' A' ' 24' ' ' VAL . 48.7 t-20 -86.91 113.14 22.44 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 106.533 -1.654 . . . . 0.0 106.533 173.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -53.09 -36.88 61.18 Favored 'General case' 0 C--N 1.314 -0.958 0 O-C-N 123.657 0.598 . . . . 0.0 111.166 179.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -74.49 -35.17 63.23 Favored 'General case' 0 CA--C 1.487 -1.478 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.646 -172.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.622 ' O ' HG12 ' A' ' 27' ' ' ILE . 25.0 tp -76.64 -39.08 53.44 Favored 'General case' 0 N--CA 1.418 -2.051 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.162 -178.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 20' ' ' ASN . 61.2 t -62.44 -40.91 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.1 ttp -59.65 -43.18 94.0 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.722 176.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -67.2 -38.28 85.06 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.911 177.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.75 -52.08 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 176.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.5 mt -62.02 -41.42 98.07 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.961 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -66.93 -47.29 72.14 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-O 121.436 0.636 . . . . 0.0 110.472 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -64.16 -40.79 96.88 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.907 -176.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.1 pt -70.09 -40.05 77.9 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.933 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.808 176.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.63 -50.21 74.68 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.076 0.95 . . . . 0.0 111.407 -178.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.424 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.3 pp -62.59 -34.09 76.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.184 -178.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.424 ' N ' HD12 ' A' ' 33' ' ' LEU . 29.4 t70 -76.75 -50.26 14.01 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.728 176.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.0 tp . . . . . 0 C--O 1.247 0.964 0 C-N-CA 125.258 1.423 . . . . 0.0 113.05 -176.421 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.53 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.8 tt . . . . . 0 C--O 1.206 -1.231 0 CA-C-O 120.936 0.398 . . . . 0.0 110.328 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.415 ' O ' HG13 ' A' ' 46' ' ' ILE . 40.4 mtmt -56.68 -46.96 80.85 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.524 0.729 . . . . 0.0 109.764 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.6 m -71.65 -36.62 70.75 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 114.667 -1.151 . . . . 0.0 109.754 -179.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.5 m -61.4 -39.68 91.59 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.917 176.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 41' ' ' ILE . 35.7 mm -56.9 -48.75 80.9 Favored 'Isoleucine or valine' 0 C--N 1.351 0.637 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 42' ' ' LYS . 68.1 mt -52.93 -48.72 51.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 115.333 -0.848 . . . . 0.0 112.473 -177.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -60.96 -53.36 58.16 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.769 0.795 . . . . 0.0 110.312 -176.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.04 -46.04 94.96 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.634 -174.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -66.49 -37.7 85.65 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.32 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.9 t -71.81 -26.93 62.6 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-O 120.983 0.421 . . . . 0.0 110.775 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.2 t -81.79 -44.73 16.58 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.376 0.608 . . . . 0.0 109.97 178.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.494 ' O ' HG12 ' A' ' 56' ' ' ILE . 82.7 m-70 -102.14 38.97 1.55 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.349 -175.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 77.8 mt -47.64 -36.79 11.5 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 -177.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.547 ' O ' ' HD3' ' A' ' 58' ' ' LYS . 26.1 t70 -54.43 -51.55 64.58 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -176.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -73.55 -29.72 62.61 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.65 -177.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 52' ' ' HIS . 37.8 mm -64.19 -45.74 95.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.054 179.336 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -74.3 -32.71 62.98 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.537 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' A' ' 54' ' ' ASP . 2.1 mptm? -63.8 -43.44 96.27 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 120.769 0.319 . . . . 0.0 110.87 177.145 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -123.92 60.99 1.1 Allowed 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.864 0.84 . . . . 0.0 111.076 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -64.06 -25.88 68.31 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.156 -176.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -69.41 -52.16 29.5 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -59.41 -50.66 73.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.778 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.531 ' HA ' HG12 ' A' ' 66' ' ' ILE . 74.2 m-85 -67.05 -32.29 73.38 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -67.74 -44.94 76.38 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.17 0.51 . . . . 0.0 110.297 177.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 88.2 mtp -67.55 -45.8 74.61 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.694 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.533 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 48.0 pt -66.64 -36.36 77.06 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.566 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.681 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.78 -40.7 80.43 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.112 0.415 . . . . 0.0 110.424 178.012 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -62.71 -51.38 67.39 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.268 177.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 82.0 mt -63.64 -41.29 92.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.956 -178.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 86.5 mt -58.51 -48.71 79.92 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.85 0.46 . . . . 0.0 111.554 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.47 ' HG2' HG23 ' A' ' 41' ' ' ILE . 46.6 mt-30 -64.43 -48.7 74.33 Favored 'General case' 0 C--O 1.251 1.17 0 CA-C-O 122.192 0.996 . . . . 0.0 109.815 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -60.0 -45.7 91.88 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 113.833 -1.531 . . . . 0.0 110.905 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.5 ' CE2' ' HD3' ' A' ' 76' ' ' LYS 0.252 31.5 m-85 -91.81 -21.28 20.75 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -174.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -67.5 -31.19 71.15 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 118.37 -1.332 . . . . 0.0 108.543 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -74.26 -38.16 63.53 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.177 0.513 . . . . 0.0 110.141 176.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.5 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 87.1 tttt -75.66 -51.02 13.72 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.711 -175.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.5 pt -122.27 -30.7 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.542 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 127.58 143.8 5.8 Favored Glycine 0 C--N 1.315 -0.602 0 C-N-CA 120.347 -0.93 . . . . 0.0 111.997 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tp -60.87 -40.55 85.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -175.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -59.58 -39.6 84.66 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.678 0.752 . . . . 0.0 110.225 -178.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.498 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.3 m-20 -66.24 -50.26 64.38 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.291 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 78' ' ' GLY . 25.3 t -63.88 -38.34 82.1 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.885 -176.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 -52.94 -50.11 64.68 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.024 0.929 . . . . 0.0 109.715 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -39.47 80.6 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.009 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 91.7 mt -66.22 -38.4 87.86 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -178.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.7 mm -66.11 -39.44 84.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.06 -39.25 93.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.325 176.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 86.0 m -58.87 -34.03 71.15 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.426 0.69 . . . . 0.0 110.193 176.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 65.1 m -65.18 -45.94 82.83 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.825 -178.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.1 pt . . . . . 0 C--N 1.32 -0.717 0 CA-C-O 121.288 0.566 . . . . 0.0 112.095 -177.977 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.482 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 13.8 t70 . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 9.1 Cg_exo -72.16 -28.73 15.31 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.042 2.494 . . . . 0.0 113.19 178.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -76.23 -31.33 58.31 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 122.038 0.923 . . . . 0.0 109.052 -177.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -59.4 -43.06 93.05 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.512 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 7' ' ' PRO . 7.5 p -68.05 -33.8 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 C-N-CA 120.171 -0.611 . . . . 0.0 110.19 178.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.27 -38.09 79.24 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.868 0.365 . . . . 0.0 110.08 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.67 -38.72 90.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.689 176.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -61.9 -38.57 88.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.576 177.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 . . . . . 0 C--N 1.317 -0.806 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.915 178.354 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.447 HG21 HG21 ' A' ' 24' ' ' VAL . 27.2 m . . . . . 0 C--O 1.249 1.047 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.474 ' O ' HG23 ' A' ' 24' ' ' VAL . 48.9 m-80 -72.95 107.09 5.14 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -51.91 -48.29 64.25 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -68.56 -29.45 68.0 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-O 121.155 0.502 . . . . 0.0 110.341 -175.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.56 ' O ' HG12 ' A' ' 27' ' ' ILE . 32.7 tp -77.34 -41.83 38.97 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.934 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 20' ' ' ASN . 60.8 t -61.81 -43.96 98.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.4 ttp -56.37 -36.64 69.05 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.682 177.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -75.62 -38.44 58.98 Favored 'General case' 0 C--O 1.211 -0.942 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.221 177.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.56 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.8 mm -57.0 -50.62 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.459 ' HB3' ' CG ' ' A' ' 83' ' ' ASN . 86.3 mt -61.61 -42.92 99.57 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.325 -1.307 . . . . 0.0 110.273 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -62.05 -48.29 80.89 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.65 178.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -62.53 -39.89 95.02 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.516 -175.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.439 HG21 HD13 ' A' ' 45' ' ' ILE . 38.7 pt -73.54 -37.9 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.807 176.226 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -59.54 -52.7 64.44 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.943 0.897 . . . . 0.0 110.844 -178.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.414 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.4 pp -68.12 -28.6 67.47 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.414 ' N ' HD12 ' A' ' 33' ' ' LEU . 26.9 t70 -70.74 -44.02 67.65 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.011 0.434 . . . . 0.0 110.357 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.0 tt . . . . . 0 C--O 1.248 1.005 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 176.081 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.514 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.0 tt . . . . . 0 N--CA 1.434 -1.23 0 N-CA-C 111.472 0.175 . . . . 0.0 111.472 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.536 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.5 ptmt -64.48 -32.64 74.36 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.356 -179.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.6 m -67.31 -45.77 75.51 Favored 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.7 m -61.24 -40.64 94.8 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.608 177.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.514 HG12 ' O ' ' A' ' 41' ' ' ILE . 30.1 mm -53.67 -44.3 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.904 0.881 . . . . 0.0 109.948 176.087 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 42' ' ' LYS . 77.2 mt -54.75 -52.46 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.87 -177.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.38 -46.07 90.3 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-O 121.35 0.595 . . . . 0.0 111.349 -176.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.54 -46.21 71.14 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.581 -172.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.404 ' HA ' HG13 ' A' ' 56' ' ' ILE . 4.2 m-30 -65.18 -38.81 91.71 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.232 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 82.9 p -73.81 -21.77 60.03 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.379 0.609 . . . . 0.0 111.692 -177.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.7 t -93.58 -20.33 20.32 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-O 121.1 0.476 . . . . 0.0 110.99 -178.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.522 ' O ' HG12 ' A' ' 56' ' ' ILE . 62.5 m-70 -123.8 39.27 4.0 Favored 'General case' 0 C--N 1.317 -0.805 0 O-C-N 121.804 -0.56 . . . . 0.0 109.738 -176.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 93.8 mt -49.32 -36.79 22.19 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -174.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -56.59 -51.51 68.34 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -176.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -73.14 -36.91 66.75 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 52' ' ' HIS . 42.4 mm -62.36 -49.3 84.48 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.648 -177.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -77.18 -26.58 53.07 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.254 0.55 . . . . 0.0 111.398 -175.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -71.41 -43.49 66.67 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.561 0.696 . . . . 0.0 109.681 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -116.32 46.54 1.57 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 114.909 -1.041 . . . . 0.0 108.479 -177.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -59.97 -32.64 71.01 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.561 -174.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -64.14 -43.36 95.44 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -66.07 -51.57 56.9 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.999 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.496 ' HA ' HG12 ' A' ' 66' ' ' ILE . 68.3 m-85 -67.82 -28.95 68.01 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -74.05 -44.47 54.11 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.467 177.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.8 mtm -65.07 -45.85 83.6 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.664 179.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.7 pt -63.38 -41.96 94.6 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.028 0 C-N-CA 119.519 -0.872 . . . . 0.0 111.912 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.524 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.88 -36.69 65.39 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.193 0.52 . . . . 0.0 111.433 -178.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.51 -54.9 10.37 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.602 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 78.9 mt -60.57 -40.73 85.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.146 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.1 mt -55.22 -46.89 75.95 Favored 'General case' 0 C--O 1.213 -0.854 0 C-N-CA 123.129 0.571 . . . . 0.0 111.436 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.524 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 63.2 mt-30 -69.33 -41.37 76.75 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.314 0.578 . . . . 0.0 110.15 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -59.97 -47.04 87.44 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.214 1.006 . . . . 0.0 110.308 -178.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -87.14 -15.51 38.18 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.494 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.81 -29.65 69.64 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 176.369 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -78.76 -28.11 44.76 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.404 176.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -90.18 -51.31 5.51 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -174.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.3 pt -121.47 -19.07 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -176.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.592 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 109.0 140.6 9.08 Favored Glycine 0 C--N 1.305 -1.188 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 178.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.404 HD13 HD12 ' A' ' 41' ' ' ILE . 7.2 tp -57.26 -40.47 73.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -174.023 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -57.69 -41.77 82.33 Favored 'General case' 0 C--O 1.251 1.142 0 CA-C-O 122.252 1.025 . . . . 0.0 109.993 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.524 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 49.0 m-80 -70.51 -43.53 69.45 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 113.971 -1.468 . . . . 0.0 111.379 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 78' ' ' GLY . 12.6 t -63.51 -46.21 95.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 O-C-N 123.231 0.332 . . . . 0.0 110.293 -177.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.459 ' CG ' ' HB3' ' A' ' 28' ' ' LEU . 95.1 m-20 -52.31 -47.06 66.17 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.818 0.699 . . . . 0.0 110.83 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -60.84 -41.33 95.61 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.378 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 65.7 mt -74.34 -31.24 62.36 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.368 -177.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.7 mm -63.2 -37.49 79.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 84.9 mt -63.31 -39.52 94.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.549 176.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 17.3 m -66.39 -33.67 76.23 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.556 0.693 . . . . 0.0 110.056 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 78.6 m -64.72 -48.62 73.98 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.102 -178.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 36.6 pt . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.44 -179.576 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.2 t70 . . . . . 0 N--CA 1.435 -1.221 0 CA-C-O 120.325 0.107 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.526 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 26.8 Cg_exo -63.02 -34.67 69.65 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.652 2.235 . . . . 0.0 113.018 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 5.6 mm-40 -77.64 -30.13 52.05 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.309 0.576 . . . . 0.0 111.528 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -66.35 -38.71 88.23 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.762 176.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG12 ' O ' ' A' ' 7' ' ' PRO . 9.3 p -68.6 -33.43 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.817 177.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 7' ' ' PRO . 40.1 mmtm -55.04 -36.03 65.09 Favored 'General case' 0 C--N 1.361 1.104 0 CA-C-O 121.054 0.454 . . . . 0.0 110.038 173.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.34 -38.41 81.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.068 179.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -65.28 -32.89 74.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.569 0.699 . . . . 0.0 109.708 176.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 . . . . . 0 C--N 1.309 -1.165 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.079 177.522 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.42 HG21 HG21 ' A' ' 24' ' ' VAL . 15.7 m . . . . . 0 C--O 1.247 0.972 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -78.78 118.64 21.03 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 173.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -55.37 -35.51 65.35 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 123.643 0.777 . . . . 0.0 111.657 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -74.24 -31.52 62.62 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.12 -174.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.607 ' O ' HG12 ' A' ' 27' ' ' ILE . 31.4 tp -76.48 -41.95 45.3 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.434 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.42 HG21 HG21 ' A' ' 19' ' ' VAL . 59.3 t -61.54 -42.17 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 176.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 38.1 ttm -55.61 -44.65 77.24 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 175.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -67.12 -40.84 86.9 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.133 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.2 mm -56.74 -52.03 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.05 -40.88 99.03 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.683 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -65.22 -49.02 71.3 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.418 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -60.95 -42.5 98.36 Favored 'General case' 0 C--O 1.246 0.891 0 C-N-CA 124.643 1.177 . . . . 0.0 110.471 -176.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.41 ' CD1' HD13 ' A' ' 70' ' ' LEU . 41.2 pt -72.69 -38.99 59.77 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.96 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.542 177.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -61.94 -48.72 79.12 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 123.523 0.729 . . . . 0.0 112.022 -176.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.408 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -69.89 -27.0 64.44 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.996 0.427 . . . . 0.0 111.711 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.408 ' N ' HD12 ' A' ' 33' ' ' LEU . 19.0 t70 -75.78 -43.4 46.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.286 0.565 . . . . 0.0 109.6 177.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 41' ' ' ILE . 58.6 tp . . . . . 0 C--N 1.316 -0.888 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.885 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.633 HG23 ' HG2' ' A' ' 71' ' ' GLN . 6.7 tt . . . . . 0 N--CA 1.445 -0.69 0 CA-C-O 120.168 0.032 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.529 ' O ' HG13 ' A' ' 46' ' ' ILE . 60.4 pttt -56.49 -38.62 72.0 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-O 120.712 0.291 . . . . 0.0 111.142 176.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.0 m -69.55 -42.05 75.09 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.684 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.433 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 22.8 m -62.15 -38.19 88.06 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.496 176.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 41' ' ' ILE . 33.5 mm -56.55 -48.96 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.53 0.732 . . . . 0.0 110.055 176.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 42' ' ' LYS . 77.1 mt -52.89 -47.58 52.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.537 -177.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.433 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 23.9 m-85 -61.07 -53.36 58.1 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.661 0.744 . . . . 0.0 109.939 -175.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -64.77 -44.77 96.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-N 114.295 -1.321 . . . . 0.0 111.481 -174.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -63.41 -39.28 94.06 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.265 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.42 ' HA ' ' CD2' ' A' ' 53' ' ' LEU . 21.9 t -73.52 -21.82 60.28 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 120.677 0.275 . . . . 0.0 111.165 -179.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.1 t -94.1 -3.96 50.17 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.433 0.635 . . . . 0.0 110.333 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.544 ' O ' HG12 ' A' ' 56' ' ' ILE . 91.6 m-70 -140.48 37.47 1.86 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.42 ' CD2' ' HA ' ' A' ' 50' ' ' SER . 84.0 mt -47.62 -45.18 27.42 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -172.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -60.1 -48.94 79.62 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -172.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -67.38 -33.95 76.28 Favored 'General case' 0 C--O 1.245 0.819 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 52' ' ' HIS . 39.3 mm -63.94 -42.14 94.81 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.25 0 CA-C-N 115.19 -0.913 . . . . 0.0 108.969 178.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.476 ' NE ' ' HA ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -65.15 -50.05 67.51 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 123.351 0.661 . . . . 0.0 111.06 -177.386 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -57.75 -33.78 68.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.461 -178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.437 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 30.6 m-80 -127.3 46.52 2.51 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -175.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -53.45 -36.6 61.77 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.774 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -71.32 -42.04 69.09 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.437 ' HB3' ' HB3' ' A' ' 59' ' ' ASN . 85.8 t80 -62.18 -49.6 75.14 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.895 178.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.497 ' HA ' HG12 ' A' ' 66' ' ' ILE . 61.5 m-85 -67.7 -32.89 73.85 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -178.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -69.2 -47.41 64.91 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.142 -0.623 . . . . 0.0 109.966 174.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.8 mtm -59.18 -46.54 88.13 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.92 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.535 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 37.9 pt -66.71 -41.03 87.44 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.974 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.231 178.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.18 -41.63 93.3 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.102 0.477 . . . . 0.0 110.191 179.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -58.71 -55.99 27.94 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.002 177.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.5 mt -61.8 -40.62 87.6 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.838 0 C-N-CA 124.173 0.989 . . . . 0.0 112.301 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 89.7 mt -55.8 -46.02 78.12 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.556 0.343 . . . . 0.0 111.321 177.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.633 ' HG2' HG23 ' A' ' 41' ' ' ILE . 44.7 mt-30 -69.99 -51.67 30.59 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.934 0.873 . . . . 0.0 109.792 179.295 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.8 ttt85 -54.84 -43.82 73.39 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 125.709 1.604 . . . . 0.0 111.506 -179.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -95.92 -14.87 22.77 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 115.601 1.704 . . . . 0.0 115.601 -176.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.51 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -64.84 -31.45 72.69 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 174.058 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 71' ' ' GLN . 91.3 mttt -70.47 -46.25 64.13 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.05 177.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -76.66 -50.53 13.49 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -173.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.7 pt -121.23 -29.64 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -174.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.529 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.33 145.13 6.6 Favored Glycine 0 C--N 1.317 -0.488 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.8 tp -62.69 -39.26 84.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -175.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -62.83 -36.22 82.49 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-O 121.29 0.567 . . . . 0.0 111.808 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.576 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 16.3 m120 -65.54 -48.26 73.06 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.632 178.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 78' ' ' GLY . 19.5 t -64.42 -44.98 97.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.415 -177.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -50.82 -49.94 57.61 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.618 1.167 . . . . 0.0 110.137 179.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -43.31 79.48 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.604 -178.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 81.3 mt -64.85 -35.4 80.99 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.9 mm -64.97 -43.06 96.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.3 mt -62.0 -42.12 98.8 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.797 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.1 m -62.58 -32.16 73.1 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 123.911 0.885 . . . . 0.0 110.78 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.6 m -69.57 -43.95 71.82 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.279 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.7 pt . . . . . 0 C--N 1.317 -0.837 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.518 -179.346 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 C--O 1.241 0.614 0 CA-C-O 121.564 0.697 . . . . 0.0 110.025 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.2 m -138.6 179.89 6.21 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.1 tp -156.26 14.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 84.0 mt -97.87 -14.88 20.46 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 113.79 -1.55 . . . . 0.0 111.833 -168.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.37 -18.61 61.97 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -177.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -112.06 131.55 22.45 Favored Pre-proline 0 C--N 1.314 -0.973 0 C-N-CA 118.779 -1.169 . . . . 0.0 113.648 -174.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.09 -23.69 62.37 Favored 'Trans proline' 0 CA--C 1.548 1.218 0 C-N-CA 123.804 3.002 . . . . 0.0 115.274 175.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.441 ' OE1' ' HG2' ' A' ' 65' ' ' MET . 32.8 mm-40 -65.14 -34.57 78.72 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.382 0.992 . . . . 0.0 109.917 179.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -67.36 -42.78 82.9 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.753 -177.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.487 ' O ' ' HG3' ' A' ' 14' ' ' GLN . 11.5 p -65.02 -34.59 71.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.123 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -65.69 -38.03 88.12 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.914 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.53 -44.58 93.15 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.503 0.668 . . . . 0.0 109.614 174.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -39.09 90.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.672 178.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.487 ' HG3' ' O ' ' A' ' 10' ' ' VAL . 26.4 mt-30 -63.92 -41.14 97.74 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 122.73 0.412 . . . . 0.0 111.516 178.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -74.46 -13.98 60.77 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt 69.7 2.58 3.87 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.736 1.214 . . . . 0.0 111.473 177.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 95.43 -80.26 0.83 Allowed Glycine 0 N--CA 1.435 -1.378 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt 63.71 10.76 5.31 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.976 1.311 . . . . 0.0 113.11 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.454 HG21 HG21 ' A' ' 24' ' ' VAL . 34.3 m -100.62 169.69 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 C-N-CA 123.321 0.648 . . . . 0.0 110.773 -176.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -76.69 113.25 14.12 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -58.31 -34.8 70.97 Favored 'General case' 0 C--N 1.308 -1.239 0 O-C-N 123.557 0.536 . . . . 0.0 110.607 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -74.94 -37.8 61.9 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.809 -173.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.554 ' O ' HG12 ' A' ' 27' ' ' ILE . 19.3 tp -77.44 -40.81 42.09 Favored 'General case' 0 N--CA 1.423 -1.817 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.747 -177.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.454 HG21 HG21 ' A' ' 19' ' ' VAL . 86.1 t -65.13 -39.1 84.44 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 59.9 ttp -57.86 -37.11 73.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.711 176.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -75.86 -40.13 55.27 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.431 177.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.554 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.4 mm -56.99 -51.75 64.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.05 -41.54 98.23 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-N 115.047 -0.978 . . . . 0.0 110.247 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -63.31 -45.12 92.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.412 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -62.9 -44.96 94.68 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.847 -175.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.515 ' CD1' HD13 ' A' ' 70' ' ' LEU . 46.0 pt -70.31 -37.01 69.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 119.875 -0.73 . . . . 0.0 109.74 176.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.613 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 35.9 tt0 -62.19 -53.4 55.8 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 123.017 0.527 . . . . 0.0 111.223 -178.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.47 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.1 pp -59.45 -33.69 71.59 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.47 ' N ' HD12 ' A' ' 33' ' ' LEU . 14.9 t70 -71.04 -47.89 55.94 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.3 tp -65.56 -23.78 66.94 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.429 0.692 . . . . 0.0 112.266 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.613 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 20.3 mtm180 -71.02 -33.12 70.05 Favored 'General case' 0 C--N 1.314 -0.946 0 O-C-N 121.725 -0.609 . . . . 0.0 110.625 176.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -91.15 -38.25 6.04 Favored Glycine 0 C--N 1.315 -0.632 0 C-N-CA 120.571 -0.824 . . . . 0.0 111.268 177.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.8 m -94.52 -170.35 2.23 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 123.324 0.65 . . . . 0.0 110.119 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -128.17 -7.63 5.37 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -113.3 106.09 14.19 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 120.59 -0.444 . . . . 0.0 109.961 -172.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.528 ' O ' HG12 ' A' ' 45' ' ' ILE . 14.4 tt -75.05 -27.63 20.09 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.892 -176.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.522 ' HG2' ' OE1' ' A' ' 71' ' ' GLN . 42.7 mtmt -59.36 -48.67 80.75 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 177.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.1 m -65.21 -38.74 91.4 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.589 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.8 m -58.81 -41.09 85.96 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 120.863 0.363 . . . . 0.0 110.405 175.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.5 mm -58.77 -46.31 90.84 Favored 'Isoleucine or valine' 0 C--N 1.343 0.314 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 176.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 42' ' ' LYS . 67.6 mt -51.76 -49.61 35.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.208 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -61.14 -53.72 53.5 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.408 0.623 . . . . 0.0 110.71 -176.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 51.7 t -66.79 -42.82 89.82 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.891 -172.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -70.95 -37.63 72.82 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.44 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.533 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 36.2 t -73.47 -31.41 63.76 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.567 0.699 . . . . 0.0 109.798 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.3 t -73.54 -43.83 59.0 Favored 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.52 ' O ' HG12 ' A' ' 56' ' ' ILE . 68.9 m-70 -103.34 37.42 2.0 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 -176.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 50' ' ' SER . 80.0 mt -47.11 -41.66 17.7 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -57.46 -46.65 83.4 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.554 ' HA ' ' OE1' ' A' ' 55' ' ' GLU . 2.2 tp10 -74.58 -34.31 62.86 Favored 'General case' 0 N--CA 1.432 -1.325 0 C-N-CA 119.626 -0.83 . . . . 0.0 111.312 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 52' ' ' HIS . 47.1 mm -61.26 -45.28 98.92 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.174 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -71.76 -22.97 61.53 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.79 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.446 ' HB2' ' NZ ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER -68.53 -52.72 28.95 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.641 ' HB2' ' CE2' ' A' ' 63' ' ' TYR . 16.9 m120 -112.53 52.66 0.77 Allowed 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.8 pttp -60.7 -31.55 70.82 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -66.44 -47.53 72.86 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 121.457 0.646 . . . . 0.0 109.396 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -63.12 -51.5 66.27 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 114.412 -1.267 . . . . 0.0 110.714 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.641 ' CE2' ' HB2' ' A' ' 59' ' ' ASN . 79.0 m-85 -68.99 -26.44 65.02 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -176.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -71.23 -50.72 30.0 Favored 'General case' 0 C--O 1.245 0.852 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.146 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.441 ' HG2' ' OE1' ' A' ' 8' ' ' GLU . 73.6 mtm -66.0 -43.27 88.2 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.54 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.555 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 46.2 pt -65.93 -41.71 90.44 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.634 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.195 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.26 -39.0 71.9 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 117.893 0.315 . . . . 0.0 110.909 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -64.33 -56.6 13.33 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 177.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 95.2 mt -56.63 -44.33 80.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.446 1.099 . . . . 0.0 112.514 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.561 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 82.5 mt -54.57 -50.45 67.95 Favored 'General case' 0 C--O 1.212 -0.876 0 C-N-CA 123.531 0.732 . . . . 0.0 111.826 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.522 ' OE1' ' HG2' ' A' ' 42' ' ' LYS . 46.3 mt-30 -70.16 -45.67 66.27 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 121.984 0.897 . . . . 0.0 109.917 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 46.4 ttt85 -57.91 -45.41 86.54 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 126.62 1.968 . . . . 0.0 111.319 -176.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -94.48 -16.54 23.26 Favored 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.561 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.23 -33.91 77.12 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.054 178.601 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -68.12 -25.61 65.38 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.384 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -99.38 -47.61 5.09 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.9 pt -115.88 -20.79 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -177.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 111.15 142.43 9.01 Favored Glycine 0 CA--C 1.501 -0.795 0 N-CA-C 110.999 -0.841 . . . . 0.0 110.999 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.416 HG13 ' ND2' ' A' ' 83' ' ' ASN . 10.2 tp -62.45 -37.43 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 117.203 0.502 . . . . 0.0 111.559 -174.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -53.19 -48.09 68.34 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.858 0.837 . . . . 0.0 109.455 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.436 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 85.4 m-20 -68.0 -42.97 79.91 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 113.787 -1.551 . . . . 0.0 112.204 -178.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 78' ' ' GLY . 16.8 t -65.49 -45.8 91.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.3 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.416 ' ND2' HG13 ' A' ' 79' ' ' ILE . 94.0 m-20 -56.64 -42.81 79.52 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.435 0.636 . . . . 0.0 111.075 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -45.7 86.84 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.9 mt -63.09 -36.28 83.06 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.632 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.6 mm -64.44 -41.08 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.7 mt -62.41 -38.74 90.84 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-O 121.363 0.601 . . . . 0.0 110.558 176.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.4 m -64.91 -33.44 76.02 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.473 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 29.5 m -72.1 -31.7 66.3 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.488 0.715 . . . . 0.0 111.479 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.6 pt -92.71 -9.11 10.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.621 -178.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -99.57 128.71 45.68 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.7 mp -78.68 144.66 35.12 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 106.004 -1.85 . . . . 0.0 106.004 167.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . 0.266 8.3 tm-20 -46.73 -80.5 0.01 OUTLIER 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -172.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 61.6 m80 -143.57 1.42 1.18 Allowed 'General case' 0 N--CA 1.483 1.188 0 O-C-N 120.914 -1.116 . . . . 0.0 111.728 177.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -96.92 95.15 7.64 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 34.9 m-70 -123.21 -63.59 1.24 Allowed 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.507 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 12.7 p-80 -67.68 -29.07 68.26 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.639 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 27.8 t60 -121.56 87.86 2.83 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 172.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 . . . . . 0 C--N 1.29 -2.002 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 -178.465 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 CA--C 1.513 -0.459 0 CA-C-O 120.926 0.393 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.4 m -113.78 139.47 49.1 Favored 'General case' 0 N--CA 1.423 -1.817 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -178.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.5 tt -92.77 -2.72 10.7 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-O 122.487 1.137 . . . . 0.0 108.964 177.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 86.4 mt -72.56 9.93 0.95 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 114.784 -1.098 . . . . 0.0 112.363 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.432 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 34.1 mt-10 -77.44 -21.18 53.37 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 178.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.401 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 14.3 t70 -87.36 135.45 34.54 Favored Pre-proline 0 C--N 1.313 -1.01 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.03 -173.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.441 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 13.9 Cg_exo -70.82 -31.53 15.65 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.665 2.243 . . . . 0.0 113.088 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.67 -35.95 57.61 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -61.32 -42.72 99.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.434 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.73 -34.26 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 CA-C-O 121.055 0.455 . . . . 0.0 109.988 178.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 63.5 mttp -63.08 -37.02 85.54 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 174.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.5 mt -63.31 -37.33 86.82 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.115 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.465 HH11 ' HA ' ' A' ' 89' ' ' THR . 24.9 tpt180 -67.5 -35.25 78.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.362 0.601 . . . . 0.0 109.76 -179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -73.65 -31.01 63.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.084 178.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -74.77 -33.31 62.27 Favored 'General case' 0 C--O 1.251 1.183 0 C-N-CA 123.762 0.825 . . . . 0.0 109.004 177.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.536 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 86.9 tttt 72.97 -67.61 0.26 Allowed 'General case' 0 C--O 1.208 -1.083 0 C-N-CA 126.727 2.011 . . . . 0.0 111.617 178.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 156.6 104.92 0.22 Allowed Glycine 0 N--CA 1.427 -1.937 0 C-N-CA 120.628 -0.796 . . . . 0.0 111.654 -178.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.408 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 26.3 mtpp -112.05 21.7 15.62 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 123.103 1.43 . . . . 0.0 107.743 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 30.1 m -110.3 164.37 6.54 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 CA-C-N 112.868 -1.969 . . . . 0.0 109.444 -176.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -81.16 119.63 23.83 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 174.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CE1' HD22 ' A' ' 87' ' ' LEU . 86.2 t80 -53.25 -47.89 68.68 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.683 0.615 . . . . 0.0 111.692 -179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -59.15 -36.01 74.51 Favored 'General case' 0 CA--C 1.497 -1.09 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.173 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.599 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.2 tp -76.51 -42.62 42.68 Favored 'General case' 0 N--CA 1.419 -2.006 0 C-N-CA 119.441 -0.904 . . . . 0.0 111.248 -178.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.603 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 65.0 t -59.22 -44.71 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 118.205 0.457 . . . . 0.0 109.874 177.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 52.1 ttp -58.76 -38.03 77.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.991 177.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -72.69 -38.59 67.52 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.123 176.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.599 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.1 mm -57.25 -49.61 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 66.8 mt -63.96 -35.23 79.99 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.743 -1.117 . . . . 0.0 110.496 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.73 -44.64 63.77 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 124.139 0.976 . . . . 0.0 110.092 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.568 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 17.3 tt0 -69.7 -39.5 76.88 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.611 -1.177 . . . . 0.0 110.759 -177.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.432 HG21 HD13 ' A' ' 45' ' ' ILE . 41.7 pt -68.34 -37.05 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 119.832 -0.747 . . . . 0.0 109.185 176.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -58.73 -46.28 87.75 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.589 0.555 . . . . 0.0 111.086 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 30' ' ' GLU . 4.4 pp -63.88 -32.85 74.52 Favored 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -177.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.53 -48.74 18.41 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.364 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.42 HD13 ' HB ' ' A' ' 41' ' ' ILE . 51.8 tp -56.86 -38.63 72.97 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.748 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.5 ttp180 -63.46 97.83 0.15 Allowed 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 175.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.23 -20.07 3.59 Favored Glycine 0 N--CA 1.438 -1.229 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.254 -176.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.7 p -147.11 -159.43 1.02 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -132.98 12.69 4.31 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 173.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -90.8 63.02 5.2 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.233 -173.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.552 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.8 tt -61.71 -31.2 50.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.333 -178.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -63.21 -34.36 77.48 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.925 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.9 m -79.24 -33.86 43.22 Favored 'General case' 0 N--CA 1.419 -2.007 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.403 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 15.3 m -59.59 -41.26 89.89 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.571 176.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 41' ' ' ILE . 43.1 mm -53.76 -48.87 60.57 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.853 176.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 69.6 mt -53.5 -49.12 56.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.228 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.403 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 20.0 m-85 -63.63 -53.01 58.15 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.124 0.487 . . . . 0.0 110.417 -176.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.3 t -60.29 -46.03 95.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.449 -174.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -65.7 -37.54 86.74 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.06 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.0 m -72.85 -22.16 60.83 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.116 0.484 . . . . 0.0 111.092 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.1 t -90.09 -9.99 46.38 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.686 -178.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.463 ' O ' HG12 ' A' ' 56' ' ' ILE . 87.2 m-70 -138.46 36.33 2.26 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 -178.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 80.9 mt -47.64 -38.62 15.15 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -174.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -53.79 -50.26 66.48 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.256 0.622 . . . . 0.0 112.275 -175.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.458 ' OE2' ' HD3' ' A' ' 58' ' ' LYS . 9.2 tp10 -73.69 -35.41 65.16 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.286 0.565 . . . . 0.0 109.654 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.5 mm -60.12 -50.0 81.9 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.301 -176.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 13.6 ptt180 -77.6 -24.73 49.6 Favored 'General case' 0 C--N 1.312 -1.041 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.533 -178.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.458 ' HD3' ' OE2' ' A' ' 55' ' ' GLU . 62.7 tttt -60.1 -43.28 95.66 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 123.204 0.601 . . . . 0.0 109.457 177.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.408 ' OD1' ' HB2' ' A' ' 18' ' ' LYS . 49.1 m-80 -126.32 57.24 1.41 Allowed 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.898 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -60.77 -28.54 68.81 Favored 'General case' 0 C--O 1.211 -0.97 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.341 -175.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -61.52 -53.25 58.87 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.39 -50.6 73.33 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.08 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.507 ' HA ' HG12 ' A' ' 66' ' ' ILE . 71.2 m-85 -68.94 -30.4 68.84 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -176.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -75.03 -37.97 61.61 Favored 'General case' 0 C--O 1.248 1.0 0 C-N-CA 119.506 -0.877 . . . . 0.0 109.101 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.6 mtm -69.49 -48.08 61.8 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.142 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.515 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.6 pt -64.11 -38.84 83.49 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.713 0 C-N-CA 119.404 -0.919 . . . . 0.0 111.573 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.531 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.28 -39.74 67.21 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.884 0.373 . . . . 0.0 110.978 178.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.1 -55.69 11.57 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.377 178.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.4 mt -58.12 -41.3 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.805 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.623 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 94.5 mt -56.44 -47.93 78.08 Favored 'General case' 0 C--O 1.213 -0.837 0 C-N-CA 122.633 0.373 . . . . 0.0 111.11 179.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.531 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.0 mt-30 -65.08 -50.01 67.81 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.726 0.774 . . . . 0.0 109.714 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -57.9 -52.95 63.39 Favored 'General case' 0 N--CA 1.422 -1.849 0 CA-C-N 114.009 -1.45 . . . . 0.0 112.076 -177.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.432 ' OH ' ' HB2' ' A' ' 5' ' ' GLU . 29.5 m-85 -83.41 -19.88 35.18 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.623 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.36 -34.41 77.24 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.509 -0.876 . . . . 0.0 109.708 175.714 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HG3' ' CE2' ' A' ' 74' ' ' TYR . 55.2 mttp -81.62 -16.76 50.46 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 174.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -86.84 -51.33 6.13 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.564 177.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.8 pt -121.23 -30.5 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.535 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 128.65 138.83 4.61 Favored Glycine 0 C--N 1.314 -0.676 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.237 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.5 tp -58.39 -39.34 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 122.968 0.507 . . . . 0.0 112.112 -174.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -57.9 -43.99 86.5 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.581 0.705 . . . . 0.0 110.609 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.444 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 40.4 m-80 -67.26 -46.83 72.52 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.34 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 78' ' ' GLY . 23.5 t -61.96 -47.69 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.129 -176.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.4 ' CG ' ' HB3' ' A' ' 28' ' ' LEU . 96.4 m-20 -56.86 -42.06 79.06 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 123.58 0.55 . . . . 0.0 111.339 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -47.7 79.48 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 179.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 88.3 mt -62.74 -29.6 70.8 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.8 mm -64.82 -42.28 94.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.401 HD22 ' CE1' ' A' ' 21' ' ' PHE . 85.4 mt -64.01 -38.67 91.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.936 178.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.1 m -61.53 -33.92 74.64 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.146 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.465 ' HA ' HH11 ' A' ' 13' ' ' ARG . 23.0 m -73.61 -40.17 64.03 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 120.592 0.235 . . . . 0.0 111.425 -178.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.536 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 42.3 pt -85.68 -42.5 16.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -99.42 -39.56 8.31 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -172.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.5 tt -84.0 120.9 26.67 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.334 1.064 . . . . 0.0 112.181 -172.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.508 ' HG3' ' H ' ' A' ' 95' ' ' HIS . 14.5 pt-20 -149.18 -145.01 0.16 Allowed 'General case' 0 C--N 1.287 -2.115 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 177.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -99.62 22.15 11.29 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 119.763 1.165 . . . . 0.0 109.989 176.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.508 ' H ' ' HG3' ' A' ' 93' ' ' GLU . 0.1 OUTLIER -66.92 -54.91 17.41 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.86 -175.589 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 37.3 p-80 -93.42 97.29 10.46 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 174.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -72.45 -14.6 61.72 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 114.064 -1.425 . . . . 0.0 110.642 -171.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -146.06 179.97 7.12 Favored 'General case' 0 C--N 1.313 -1.022 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 178.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.0 m80 . . . . . 0 C--N 1.301 -1.536 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 174.544 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.502 -0.883 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.4 m -112.42 151.88 29.32 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-O 120.943 0.402 . . . . 0.0 110.116 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.7 tt -111.31 -9.88 11.82 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 CA-C-O 121.807 0.813 . . . . 0.0 108.955 175.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 74.7 mt -69.04 -0.89 6.34 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.178 173.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -76.72 -11.78 59.89 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.633 175.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.445 ' OD2' ' HD2' ' A' ' 72' ' ' ARG . 12.1 t70 -90.54 126.8 55.04 Favored Pre-proline 0 C--O 1.245 0.838 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.761 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -68.19 -30.66 30.87 Favored 'Trans proline' 0 C--O 1.24 0.593 0 C-N-CA 122.707 2.271 . . . . 0.0 113.466 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -76.11 -38.17 57.19 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -59.29 -43.57 92.57 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.151 -1.386 . . . . 0.0 111.366 179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.6 p -65.38 -34.96 73.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.606 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.428 ' HE3' ' SD ' ' A' ' 65' ' ' MET . 56.6 mtmt -66.8 -36.45 82.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.744 176.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.8 -39.54 94.57 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -57.95 -37.79 74.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.318 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -80.09 -24.45 40.59 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.779 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.3 m-30 -80.56 -35.73 33.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.583 0.23 . . . . 0.0 110.878 177.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.0 mttt 71.67 -0.03 3.32 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.916 1.287 . . . . 0.0 113.997 175.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 132.67 -85.27 0.29 Allowed Glycine 0 N--CA 1.437 -1.283 0 C-N-CA 120.01 -1.09 . . . . 0.0 114.556 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER 69.4 11.09 7.99 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.749 1.62 . . . . 0.0 110.219 -171.57 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.4 HG21 HG21 ' A' ' 24' ' ' VAL . 27.6 m -131.11 168.83 22.92 Favored 'Isoleucine or valine' 0 C--O 1.252 1.223 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.003 -171.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -91.68 129.93 37.57 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -51.99 -41.41 62.16 Favored 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 124.034 0.934 . . . . 0.0 111.195 177.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -67.7 -37.46 82.32 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.532 -175.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.525 ' O ' HG12 ' A' ' 27' ' ' ILE . 15.9 tp -77.19 -35.93 55.38 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.119 -176.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 88.6 t -68.88 -42.57 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.565 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 56.1 ttp -60.91 -33.61 73.4 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.931 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -70.63 -42.93 70.24 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 123.085 0.24 . . . . 0.0 110.747 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.83 -49.07 80.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.6 mt -63.76 -40.09 95.87 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.713 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -67.41 -47.39 70.39 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.148 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -62.01 -38.96 90.6 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.704 -176.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.472 ' CD1' HD13 ' A' ' 70' ' ' LEU . 35.0 pt -73.06 -38.25 55.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.705 176.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -58.22 -52.85 63.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 124.124 0.97 . . . . 0.0 111.029 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -63.52 -30.07 71.25 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.179 -178.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.7 -49.51 18.09 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.391 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 53.4 tp -67.31 -58.24 5.16 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.356 -175.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 63.54 -74.47 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.956 1.302 . . . . 0.0 110.463 -174.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -158.62 28.91 0.43 Allowed Glycine 0 N--CA 1.431 -1.671 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.5 t -83.67 -175.84 6.01 Favored 'General case' 0 C--O 1.249 1.058 0 CA-C-O 121.062 0.458 . . . . 0.0 110.201 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -100.1 -24.41 14.6 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -173.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -101.95 80.62 2.02 Favored 'General case' 0 CA--C 1.502 -0.894 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.699 -175.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.519 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.5 tt -76.83 -28.08 16.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.487 ' O ' HG13 ' A' ' 46' ' ' ILE . 63.7 pttt -61.21 -36.03 78.82 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.159 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.4 m -74.01 -35.29 64.39 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.783 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.418 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 16.7 m -63.17 -39.63 95.2 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 175.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.519 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.7 mm -57.07 -46.36 84.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.698 176.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 42' ' ' LYS . 69.7 mt -53.22 -47.01 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.871 -178.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.418 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 14.4 m-85 -62.35 -52.15 64.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.555 0.693 . . . . 0.0 110.233 -177.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.0 t -66.19 -42.64 91.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.904 -173.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -67.94 -34.58 76.86 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.215 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.9 m -76.36 -24.24 54.17 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.323 0.582 . . . . 0.0 111.058 178.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.3 t -79.67 -29.31 40.82 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.037 0.446 . . . . 0.0 110.488 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.482 ' O ' HG12 ' A' ' 56' ' ' ILE . 67.4 m-70 -120.76 37.64 4.24 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -175.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 87.5 mt -47.02 -51.7 16.69 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 -175.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.592 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 3.8 p30 -59.68 -33.02 71.04 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -73.89 -46.3 45.41 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 121.193 0.52 . . . . 0.0 110.041 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 52' ' ' HIS . 47.3 mm -56.27 -40.96 68.91 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.15 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.627 179.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 82.8 mtp180 -63.38 -38.73 92.3 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 177.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.592 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 50.5 mttp -63.15 -48.37 78.74 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.861 0.838 . . . . 0.0 110.532 -176.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -123.43 51.72 1.46 Allowed 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.918 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -59.7 -19.62 50.98 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.955 -1.021 . . . . 0.0 111.986 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.401 ' H ' ' HG3' ' A' ' 61' ' ' GLU . 18.8 mt-10 -61.01 -57.81 11.05 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.374 1.083 . . . . 0.0 108.094 174.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -65.87 -51.25 60.38 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.194 -1.821 . . . . 0.0 109.969 -176.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.472 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.7 m-85 -66.99 -25.95 66.57 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -175.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -83.68 -39.43 20.21 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 118.728 -1.189 . . . . 0.0 109.896 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.468 ' O ' HG13 ' A' ' 69' ' ' ILE . 73.3 mtm -64.11 -44.27 92.77 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.476 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.6 pt -62.74 -38.59 82.1 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.302 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.938 178.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.415 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -52.68 -45.5 66.84 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.399 0.437 . . . . 0.0 111.797 178.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -74.5 -36.33 63.22 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 119.922 -0.711 . . . . 0.0 112.139 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 65' ' ' MET . 80.4 mt -63.99 -46.23 94.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-O 120.627 0.251 . . . . 0.0 110.347 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.544 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 79.6 mt -54.07 -45.33 71.69 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 123.461 0.704 . . . . 0.0 110.987 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.506 ' HG2' HG23 ' A' ' 41' ' ' ILE . 48.5 mt-30 -66.65 -49.38 66.38 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.574 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.445 ' HD2' ' OD2' ' A' ' 6' ' ' ASP . 41.4 ttm180 -61.31 -45.22 95.33 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 124.48 1.112 . . . . 0.0 111.74 -177.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -88.93 -18.09 28.19 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -176.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.544 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.49 -29.4 68.82 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 173.094 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -71.9 -31.58 66.55 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.871 175.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -86.44 -52.08 5.81 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -177.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.1 pt -121.25 -27.22 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -172.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.602 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 121.85 146.66 7.4 Favored Glycine 0 CA--C 1.496 -1.124 0 C-N-CA 119.513 -1.327 . . . . 0.0 111.804 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.1 tp -61.8 -40.14 85.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -173.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -56.16 -46.35 79.34 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-O 121.825 0.821 . . . . 0.0 110.137 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.428 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 91.4 m-20 -65.03 -44.16 90.01 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 114.051 -1.431 . . . . 0.0 111.623 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.9 t -65.45 -42.79 94.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.467 -177.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -57.33 -44.97 84.71 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.264 0.554 . . . . 0.0 110.655 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.75 -43.06 94.56 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 86.7 mt -65.95 -37.34 85.78 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.1 mm -63.87 -41.06 91.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 176.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.2 mt -62.98 -39.45 94.76 Favored 'General case' 0 C--O 1.21 -1.01 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.515 175.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 50.0 m -63.82 -33.31 75.4 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.65 177.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 41.2 m -70.49 -37.71 74.24 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.336 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.5 pt -88.61 -29.22 5.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 C-N-CA 119.884 -0.726 . . . . 0.0 111.597 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.416 ' HD2' ' HA ' ' A' ' 91' ' ' LYS . 46.0 tptt -93.01 85.33 5.08 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-O 121.982 0.896 . . . . 0.0 110.378 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 73.0 mt -101.78 165.16 11.35 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.34 -178.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.11 104.91 17.25 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -70.89 -22.91 62.21 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.132 -170.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -82.93 -22.91 33.7 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 21.2 m80 61.66 50.76 4.26 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 114.886 -1.052 . . . . 0.0 112.795 -178.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -77.4 -18.71 57.05 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 172.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 31.8 p-80 -147.72 147.58 30.08 Favored 'General case' 0 N--CA 1.432 -1.331 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 172.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 63.4 t-80 . . . . . 0 C--N 1.29 -2.009 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.933 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.508 -0.667 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m -119.12 136.78 53.99 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.019 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.49 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 19.7 tt -129.08 -14.66 2.41 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-O 121.486 0.66 . . . . 0.0 110.442 177.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.9 mt -74.98 6.11 4.46 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.468 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.14 -21.3 59.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.452 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.8 t70 -89.36 123.8 66.05 Favored Pre-proline 0 N--CA 1.44 -0.97 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.652 -174.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 7.9 Cg_exo -69.84 -29.12 23.97 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.547 2.164 . . . . 0.0 113.131 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.471 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 20.0 mm-40 -75.38 -31.34 60.43 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -178.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -62.73 -40.75 98.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.902 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -71.28 -34.35 53.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.05 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -61.75 -36.07 79.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.037 173.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 95.5 mt -60.69 -35.84 77.29 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.602 176.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 mmt85 -65.04 -29.36 70.25 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.163 0.506 . . . . 0.0 110.318 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -76.25 -36.62 58.41 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.515 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -79.0 -35.73 42.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.692 0.282 . . . . 0.0 111.43 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 48.5 mmtt 74.34 -82.83 0.03 OUTLIER 'General case' 0 C--O 1.206 -1.225 0 C-N-CA 124.766 1.227 . . . . 0.0 110.645 -171.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.5 -74.33 0.02 OUTLIER Glycine 0 N--CA 1.427 -1.922 0 C-N-CA 118.931 -1.604 . . . . 0.0 113.036 -178.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp 68.12 6.11 5.04 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.54 1.136 . . . . 0.0 111.235 -175.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.6 m -125.09 167.73 18.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.307 0 C-N-CA 125.206 1.403 . . . . 0.0 107.981 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -74.72 121.81 22.28 Favored 'General case' 0 CA--C 1.499 -0.995 0 C-N-CA 119.881 -0.728 . . . . 0.0 109.522 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -55.48 -41.54 73.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -56.68 -42.13 78.52 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.79 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.601 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.6 tp -75.64 -43.1 49.51 Favored 'General case' 0 N--CA 1.417 -2.119 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.658 -175.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.0 t -63.82 -38.97 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.2 ttp -59.81 -35.04 73.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.989 176.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -75.83 -41.7 51.85 Favored 'General case' 0 C--O 1.197 -1.667 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.449 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.601 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.5 mm -55.97 -51.2 63.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 121.456 0.646 . . . . 0.0 109.73 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 76.2 mt -64.69 -34.14 77.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.878 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -72.45 -44.87 61.76 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 122.024 0.916 . . . . 0.0 109.979 -179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -65.62 -37.84 87.73 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.893 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.403 HG21 HD13 ' A' ' 45' ' ' ILE . 33.7 pt -72.07 -37.87 61.6 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.852 176.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.442 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 37.8 tt0 -61.5 -52.53 64.13 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 124.165 0.986 . . . . 0.0 110.908 -178.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.19 -30.9 71.95 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 116.322 -0.399 . . . . 0.0 112.06 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -75.43 -46.54 32.12 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.971 0.415 . . . . 0.0 110.231 178.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.497 HD21 ' CE1' ' A' ' 74' ' ' TYR . 58.7 tp -63.11 -23.5 67.47 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.889 -178.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.442 ' HG2' ' O ' ' A' ' 32' ' ' GLU . 27.0 mmm180 -66.12 97.99 0.42 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-O 121.711 0.767 . . . . 0.0 109.016 174.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 152.96 -96.77 0.17 Allowed Glycine 0 N--CA 1.401 -3.698 0 N-CA-C 108.503 -1.839 . . . . 0.0 108.503 -174.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 36.3 p 169.24 107.99 0.01 OUTLIER 'General case' 0 C--O 1.239 0.548 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -174.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -168.55 -79.53 0.02 OUTLIER 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 167.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -177.97 143.8 0.33 Allowed 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.582 ' O ' HG12 ' A' ' 45' ' ' ILE . 14.8 tt -65.57 -29.66 47.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.073 0 O-C-N 123.157 0.286 . . . . 0.0 110.454 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.492 ' O ' HG13 ' A' ' 46' ' ' ILE . 49.7 mtpt -55.31 -50.09 70.49 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-O 121.688 0.756 . . . . 0.0 110.008 174.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.0 m -59.05 -47.12 86.39 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-N 113.707 -1.588 . . . . 0.0 110.279 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 23.1 m -58.34 -39.55 79.77 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 123.771 0.669 . . . . 0.0 111.077 177.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.3 mm -58.2 -42.54 83.66 Favored 'Isoleucine or valine' 0 C--N 1.344 0.326 0 C-N-CA 123.145 0.578 . . . . 0.0 109.812 176.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 42' ' ' LYS . 63.9 mt -59.36 -47.45 90.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.59 -175.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -61.79 -50.79 70.92 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 121.671 0.748 . . . . 0.0 109.462 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.52 -47.22 93.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.573 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -64.99 -39.57 93.66 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.837 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.9 m -70.17 -27.57 64.64 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.135 0.493 . . . . 0.0 111.457 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -82.34 -32.11 29.52 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.306 0.574 . . . . 0.0 110.42 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.548 ' O ' HG12 ' A' ' 56' ' ' ILE . 90.0 m-70 -114.97 35.52 4.28 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.447 -174.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.6 mt -47.35 -39.0 14.01 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.65 1.18 . . . . 0.0 113.734 -177.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.516 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 12.3 t70 -54.17 -50.85 66.07 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -73.79 -38.08 64.75 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.624 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.548 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.8 mm -56.5 -52.14 56.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.668 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.949 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.06 -36.8 82.84 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -176.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 33.4 mtmm -71.78 -24.79 61.81 Favored 'General case' 0 CA--C 1.51 -0.572 0 C-N-CA 119.921 -0.712 . . . . 0.0 111.277 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -130.24 49.71 2.26 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -178.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.464 ' HD3' ' H ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -57.54 -31.07 65.73 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.58 -1.191 . . . . 0.0 112.773 -177.782 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.67 -50.23 67.84 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -59.84 -50.77 72.48 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.501 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.486 ' HA ' HG12 ' A' ' 66' ' ' ILE . 69.6 m-85 -69.7 -25.6 63.95 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -177.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -75.73 -44.63 40.91 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 176.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.1 mtm -61.13 -50.83 71.61 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.33 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.597 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 44.6 pt -64.43 -38.73 83.34 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.746 0 C-N-CA 119.47 -0.892 . . . . 0.0 111.801 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.457 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -59.31 -41.02 88.04 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 117.927 0.331 . . . . 0.0 110.642 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.28 -55.32 29.47 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 89.8 mt -58.03 -42.4 82.71 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 CA-C-N 115.212 -0.903 . . . . 0.0 111.929 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.4 mt -54.55 -47.87 72.69 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 122.812 0.445 . . . . 0.0 111.284 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 64.5 mt-30 -69.73 -47.95 61.24 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.74 0.781 . . . . 0.0 109.557 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -59.47 -43.06 93.31 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 113.989 -1.459 . . . . 0.0 110.782 -176.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.49 ' CE2' ' HA ' ' A' ' 3' ' ' ILE . 40.0 m-85 -93.68 -15.5 25.22 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -177.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.497 ' CE1' HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -67.75 -29.71 69.0 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 174.291 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -77.61 -28.33 51.49 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.75 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.404 ' HD2' ' CE2' ' A' ' 73' ' ' TYR . 41.1 ttmt -87.1 -51.64 5.88 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.256 -0.577 . . . . 0.0 111.486 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.3 pt -119.52 -26.71 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -173.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.535 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 117.04 148.17 8.77 Favored Glycine 0 C--N 1.307 -1.057 0 C-N-CA 120.298 -0.953 . . . . 0.0 110.996 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.8 tp -64.87 -37.87 81.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 117.029 0.414 . . . . 0.0 111.999 -174.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -55.92 -42.84 76.7 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 122.125 0.965 . . . . 0.0 110.148 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.484 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 48.6 m-80 -67.05 -50.06 63.15 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 114.145 -1.388 . . . . 0.0 111.324 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.3 t -61.67 -39.55 83.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -177.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -51.05 -50.39 58.74 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.868 1.267 . . . . 0.0 110.129 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.11 -40.58 71.4 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.062 -177.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.7 mt -64.9 -34.8 79.25 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.125 -178.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.8 mm -68.38 -41.96 83.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.5 mt -62.11 -40.73 96.88 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.137 0.494 . . . . 0.0 110.889 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 48.9 m -63.96 -33.38 75.6 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.786 177.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.4 m -74.19 -48.26 30.24 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.989 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.527 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 39.4 pt -74.02 -32.51 33.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -176.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.49 ' HG3' ' H ' ' A' ' 92' ' ' LEU . 20.7 tptp -104.75 -147.9 0.4 Allowed 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.49 ' H ' ' HG3' ' A' ' 91' ' ' LYS . 18.9 tp 58.76 69.32 0.74 Allowed 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.042 0.937 . . . . 0.0 110.218 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -96.21 124.35 40.18 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.805 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -137.19 165.07 26.98 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.817 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 75.8 m-70 69.17 -170.21 0.18 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.515 1.126 . . . . 0.0 108.207 -176.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 -70.77 -61.38 1.79 Allowed 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 119.319 -0.952 . . . . 0.0 108.79 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 53.3 t60 34.09 62.58 0.45 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 126.361 1.864 . . . . 0.0 113.479 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -156.57 138.53 14.42 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.217 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 . . . . . 0 C--N 1.31 -1.151 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 175.525 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.357 0 CA-C-O 120.942 0.401 . . . . 0.0 110.515 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.5 m -168.36 149.34 4.9 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 178.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.5 pt -76.08 81.9 0.65 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.412 0 CA-C-O 122.265 1.031 . . . . 0.0 111.253 176.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.9 mt -87.4 11.99 13.2 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 114.792 -1.094 . . . . 0.0 110.997 -176.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -71.41 -11.45 60.89 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.2 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 15.0 t70 -111.59 130.95 22.6 Favored Pre-proline 0 N--CA 1.448 -0.562 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.745 -176.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.518 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 17.3 Cg_exo -69.76 -28.26 25.48 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.947 2.432 . . . . 0.0 113.9 177.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -75.16 -33.27 61.48 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -60.17 -44.57 94.92 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.484 -1.234 . . . . 0.0 110.552 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -66.78 -34.09 67.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.235 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.2 mttt -62.77 -37.2 85.7 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.38 -38.17 88.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.151 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.6 mtp180 -72.4 -25.43 61.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.31 0.576 . . . . 0.0 110.339 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -80.51 -20.73 42.91 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.212 174.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -83.81 -49.02 9.46 Favored 'General case' 0 C--O 1.246 0.907 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 91.3 mttt 72.44 -171.52 0.14 Allowed 'General case' 0 C--O 1.242 0.698 0 C-N-CA 125.35 1.46 . . . . 0.0 113.274 175.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.4 77.8 1.68 Allowed Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 114.718 0.647 . . . . 0.0 114.718 -171.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -97.23 5.95 49.22 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 122.706 1.241 . . . . 0.0 108.333 172.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 29.7 m -117.4 158.32 18.12 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 CA-C-N 113.275 -1.784 . . . . 0.0 107.939 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -74.92 121.85 22.54 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.316 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -53.43 -50.62 64.83 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.681 0.613 . . . . 0.0 111.658 -178.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -64.61 -29.54 70.55 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.359 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.617 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.2 tp -75.93 -39.6 55.85 Favored 'General case' 0 N--CA 1.425 -1.703 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.054 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 62.8 t -63.36 -43.21 98.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 175.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 60.7 ttp -57.94 -39.34 77.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.667 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.736 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 58.9 tt0 -67.63 -45.42 75.44 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.736 176.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.617 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.6 mm -55.93 -44.8 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 CA-C-O 121.403 0.621 . . . . 0.0 110.047 -179.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 68.5 mt -68.65 -33.87 74.74 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.7 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -71.63 -43.6 65.87 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.197 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.736 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.7 mm-40 -53.66 -53.99 44.19 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.664 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.461 HG21 HD13 ' A' ' 45' ' ' ILE . 31.7 pt -67.59 -34.28 67.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.37 -177.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -63.23 -51.46 66.17 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.317 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.423 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.4 pp -72.19 -30.29 64.81 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.462 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.423 ' N ' HD12 ' A' ' 33' ' ' LEU . 15.6 t70 -75.11 -45.43 41.18 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.245 -178.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.2 tt -69.45 -61.52 1.75 Allowed 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -176.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 55.04 -85.65 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.909 0 O-C-N 123.727 0.642 . . . . 0.0 109.398 -170.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -155.31 32.3 0.65 Allowed Glycine 0 N--CA 1.433 -1.531 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 174.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 51.0 p -87.03 -87.25 0.14 Allowed 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -175.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -101.42 -72.93 0.67 Allowed 'General case' 0 CA--C 1.512 -0.492 0 C-N-CA 119.946 -0.701 . . . . 0.0 112.643 -174.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.581 ' OD1' ' HG2' ' A' ' 42' ' ' LYS . 7.8 t-20 -170.29 157.59 6.28 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.464 ' O ' HG12 ' A' ' 45' ' ' ILE . 13.9 tt -68.13 -37.7 78.58 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.425 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.581 ' HG2' ' OD1' ' A' ' 40' ' ' ASN . 11.2 ptmm? -65.52 -32.33 73.87 Favored 'General case' 0 CA--C 1.509 -0.624 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.535 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.4 m -66.3 -44.61 82.99 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.065 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.42 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 48.4 m -63.68 -38.36 90.83 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.339 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 41' ' ' ILE . 25.7 mm -54.68 -43.57 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.55 0.74 . . . . 0.0 110.077 175.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 42' ' ' LYS . 74.6 mt -54.6 -50.26 60.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.597 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.42 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 20.2 m-85 -62.88 -53.1 59.34 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.511 0.672 . . . . 0.0 110.321 -177.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 44' ' ' SER . 60.2 t -58.78 -44.94 91.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.667 -176.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -71.21 -27.37 63.45 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.9 m -80.95 -25.48 37.36 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.372 0.606 . . . . 0.0 110.372 176.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.1 t -78.07 -52.94 7.98 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.489 177.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.566 ' O ' HG12 ' A' ' 56' ' ' ILE . 86.0 m-70 -98.46 48.53 0.99 Allowed 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.316 -172.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 98.2 mt -48.59 -48.04 39.34 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -175.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 3.1 t70 -54.11 -52.04 62.26 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -174.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -72.59 -32.18 65.78 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.759 -0.776 . . . . 0.0 110.031 -176.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.566 HG12 ' O ' ' A' ' 52' ' ' HIS . 44.7 mm -63.57 -49.74 81.18 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.033 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.101 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.3 ptt-85 -69.76 -29.81 67.24 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -175.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 54' ' ' ASP . 32.5 mmtp -70.98 -34.05 71.03 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.012 0.434 . . . . 0.0 110.661 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -131.36 53.91 1.95 Allowed 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -59.65 -35.04 73.63 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.208 -176.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -64.38 -40.47 95.89 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 120.955 0.407 . . . . 0.0 110.925 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -65.61 -50.13 66.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.382 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.557 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.3 m-85 -68.88 -34.26 75.14 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -177.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.61 -45.09 76.45 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.274 177.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.6 mtm -65.69 -44.0 87.54 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.998 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.596 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 45.0 pt -66.04 -39.08 83.54 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.824 0 C-N-CA 118.588 -1.245 . . . . 0.0 111.173 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.576 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.05 -40.67 73.87 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 117.99 0.359 . . . . 0.0 110.839 178.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.89 -54.15 35.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.749 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 98.1 mt -58.27 -41.47 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.289 -179.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 96.9 mt -55.97 -48.73 75.28 Favored 'General case' 0 C--O 1.216 -0.694 0 C-N-CA 122.989 0.516 . . . . 0.0 111.506 178.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 57.3 mt-30 -68.37 -45.82 71.76 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.483 0.658 . . . . 0.0 109.78 -178.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 45.3 ttm180 -57.81 -49.34 76.98 Favored 'General case' 0 N--CA 1.424 -1.76 0 C-N-CA 124.71 1.204 . . . . 0.0 111.831 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.41 ' CE2' ' HD3' ' A' ' 76' ' ' LYS . 66.1 m-85 -87.86 -15.06 37.8 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 -176.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.538 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.14 -32.37 73.44 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 174.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.43 ' NZ ' ' HB3' ' A' ' 75' ' ' LYS . 7.2 mtpm? -81.25 -18.02 47.44 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.144 176.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.41 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 64.7 tttm -94.48 -47.42 6.56 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.163 -176.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.1 pt -126.55 -30.09 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.583 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 123.77 142.89 6.13 Favored Glycine 0 CA--C 1.499 -0.908 0 C-N-CA 120.238 -0.982 . . . . 0.0 112.043 177.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.3 tp -62.03 -33.64 59.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 117.018 0.409 . . . . 0.0 111.372 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.45 ' CD ' ' H ' ' A' ' 80' ' ' GLU . 2.3 mp0 -53.59 -49.47 67.7 Favored 'General case' 0 C--O 1.248 0.979 0 CA-C-O 122.376 1.084 . . . . 0.0 109.156 177.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -68.47 -46.98 68.27 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 113.795 -1.548 . . . . 0.0 110.756 -177.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.3 t -62.99 -38.24 81.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.737 -177.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -52.92 -50.34 64.16 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.673 0.749 . . . . 0.0 109.429 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -39.33 73.71 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.234 -178.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.444 ' O ' ' HB ' ' A' ' 88' ' ' THR . 87.0 mt -68.12 -32.77 73.29 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -178.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 82' ' ' VAL . 43.7 mm -67.12 -37.69 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 CA-C-O 121.777 0.799 . . . . 0.0 108.983 175.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.36 -38.68 88.16 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.135 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 85' ' ' LEU . 90.5 m -61.3 -34.47 75.27 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.973 0.909 . . . . 0.0 110.562 175.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 28.7 m -57.32 -49.97 74.43 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.955 0.902 . . . . 0.0 110.47 -177.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.402 HG13 ' N ' ' A' ' 91' ' ' LYS . 39.5 pt -89.65 -40.76 13.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.985 -176.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.402 ' N ' HG13 ' A' ' 90' ' ' ILE . 84.7 tttt -75.09 -29.25 60.59 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -171.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.3 mt -89.57 34.55 0.82 Allowed 'General case' 0 C--O 1.24 0.557 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.984 178.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -65.93 -68.59 0.36 Allowed 'General case' 0 C--O 1.243 0.711 0 N-CA-C 104.266 -2.494 . . . . 0.0 104.266 171.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 41.4 t60 57.56 -62.41 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.787 2.035 . . . . 0.0 115.224 170.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -83.5 87.04 7.0 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -75.1 98.0 3.58 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 113.926 -1.488 . . . . 0.0 112.116 -168.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -86.55 99.02 11.4 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 176.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 43.2 t60 68.34 -65.34 0.27 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.368 1.467 . . . . 0.0 111.703 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 81.0 t60 . . . . . 0 C--N 1.297 -1.702 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 179.727 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.501 -0.909 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.436 ' O ' HG22 ' A' ' 3' ' ' ILE . 22.8 t -144.73 142.3 29.93 Favored 'General case' 0 N--CA 1.422 -1.863 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 175.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.436 HG22 ' O ' ' A' ' 2' ' ' SER 0.3 14.0 tt 69.2 -32.45 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 C-N-CA 127.424 2.29 . . . . 0.0 113.276 178.462 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.4 mt -73.41 5.06 4.0 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.917 0.865 . . . . 0.0 109.976 175.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.408 ' H ' ' C ' ' A' ' 3' ' ' ILE . 21.0 mt-10 -83.78 -6.15 59.36 Favored 'General case' 0 C--N 1.309 -1.166 0 C-N-CA 125.878 1.671 . . . . 0.0 108.312 178.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.486 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 14.3 t70 -103.06 126.93 30.98 Favored Pre-proline 0 N--CA 1.441 -0.923 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.92 -178.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.498 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 5.5 Cg_exo -71.58 -25.62 20.76 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.59 2.193 . . . . 0.0 113.426 -178.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -76.84 -40.13 48.83 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -59.49 -41.54 90.07 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.085 178.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 7' ' ' PRO . 7.8 p -66.09 -34.55 70.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-O 121.347 0.594 . . . . 0.0 110.043 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 64.4 mttp -65.04 -35.48 81.29 Favored 'General case' 0 C--O 1.217 -0.655 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 176.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.69 -42.47 98.97 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.537 ' HG2' HG23 ' A' ' 89' ' ' THR . 38.0 mtm180 -66.79 -30.2 70.34 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 121.724 0.774 . . . . 0.0 110.027 -179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -78.8 -32.02 46.21 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.621 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -77.11 -48.19 18.41 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 123.856 0.862 . . . . 0.0 110.51 -176.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 58.3 mttp 71.29 177.24 0.27 Allowed 'General case' 0 C--O 1.242 0.691 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 179.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -104.89 104.57 2.39 Favored Glycine 0 N--CA 1.418 -2.545 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.906 -173.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.82 38.3 1.12 Allowed 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 174.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 9.2 m -130.62 167.28 26.12 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.782 0 CA-C-N 112.498 -2.137 . . . . 0.0 108.192 -176.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -75.79 125.38 28.96 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -56.04 -36.12 67.66 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 123.521 0.513 . . . . 0.0 110.916 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -73.49 -31.55 63.79 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.045 -177.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.609 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.5 tp -76.61 -39.69 51.68 Favored 'General case' 0 N--CA 1.42 -1.927 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.217 -177.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.502 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 60.3 t -64.26 -44.4 97.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 176.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 14.9 tmm? -58.85 -32.4 69.4 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.465 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.685 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 63.8 tt0 -74.49 -42.13 59.5 Favored 'General case' 0 C--O 1.192 -1.933 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.483 176.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.609 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.2 mm -56.24 -44.51 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 CA-C-O 121.672 0.749 . . . . 0.0 109.255 179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 69.9 mt -67.33 -31.34 71.55 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.668 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -72.4 -48.61 40.05 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.014 0.926 . . . . 0.0 110.115 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.685 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.2 mm-40 -53.79 -53.85 46.6 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.414 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.6 pt -66.77 -38.53 81.7 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.546 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.224 -177.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -58.71 -49.21 78.42 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.269 0.628 . . . . 0.0 111.494 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -71.38 -32.66 68.74 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -75.52 -36.99 60.38 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.8 0.81 . . . . 0.0 109.653 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.413 HD21 ' CD1' ' A' ' 74' ' ' TYR . 46.0 tp -65.81 -37.94 87.62 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.265 177.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -73.55 -15.32 61.3 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.123 0.487 . . . . 0.0 111.166 173.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -70.49 -20.4 77.01 Favored Glycine 0 C--O 1.219 -0.796 0 N-CA-C 108.895 -1.682 . . . . 0.0 108.895 171.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.6 m 76.1 90.38 0.08 Allowed 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 171.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -141.2 -83.73 0.21 Allowed 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 169.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.538 ' HB2' ' OG1' ' A' ' 43' ' ' THR . 43.9 m-80 -158.4 137.98 11.88 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 106.067 -1.827 . . . . 0.0 106.067 177.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.549 ' O ' HG12 ' A' ' 45' ' ' ILE . 12.0 tt -64.38 -32.47 57.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 118.065 0.393 . . . . 0.0 110.812 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.468 ' HG2' ' HB3' ' A' ' 40' ' ' ASN . 22.5 pttp -61.86 -33.6 74.47 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.324 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.538 ' OG1' ' HB2' ' A' ' 40' ' ' ASN . 8.5 m -72.2 -43.1 65.0 Favored 'General case' 0 C--O 1.25 1.119 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.5 m -58.58 -41.92 86.83 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.125 178.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 41' ' ' ILE . 37.0 mm -52.55 -46.69 48.76 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.388 177.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 42' ' ' LYS . 64.7 mt -56.05 -50.52 69.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.448 -176.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -58.18 -53.01 63.11 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.895 0.855 . . . . 0.0 109.9 -176.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.414 HG22 ' HB3' ' A' ' 30' ' ' GLU . 40.9 t -62.06 -47.56 92.58 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.712 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.718 -176.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -68.17 -35.93 78.81 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.665 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.1 t -77.4 -24.92 50.41 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.311 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.6 t -86.8 -19.47 28.98 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.16 0.505 . . . . 0.0 111.048 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.487 ' O ' HG12 ' A' ' 56' ' ' ILE . 76.7 m-70 -124.46 36.85 4.53 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 -177.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.496 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 82.9 mt -47.21 -41.8 18.94 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -174.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -53.66 -50.07 66.59 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -175.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.567 ' OE1' ' HD3' ' A' ' 58' ' ' LYS . 3.7 tp10 -72.99 -36.04 66.97 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.4 mm -63.21 -50.62 78.34 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.141 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.566 -177.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 6.9 ptm180 -70.49 -25.83 63.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.921 0.391 . . . . 0.0 111.762 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.567 ' HD3' ' OE1' ' A' ' 55' ' ' GLU . 78.7 tttt -65.33 -42.96 92.38 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 123.604 0.761 . . . . 0.0 109.984 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -127.22 58.79 1.44 Allowed 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 177.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.457 ' HG3' ' OE2' ' A' ' 61' ' ' GLU . 14.1 ptmm? -60.32 -32.32 71.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.828 -175.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.457 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 3.4 mp0 -65.57 -41.87 92.42 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.873 0.368 . . . . 0.0 110.213 177.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -64.01 -51.74 62.83 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.692 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.512 ' HA ' HG12 ' A' ' 66' ' ' ILE . 70.9 m-85 -67.01 -34.08 76.96 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -177.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -66.22 -45.36 80.96 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.585 177.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.8 mtm -66.22 -44.5 83.65 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.872 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.514 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 45.3 pt -67.37 -40.53 84.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.682 0 C-N-CA 118.939 -1.104 . . . . 0.0 112.348 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.92 -35.35 68.92 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 118.482 0.583 . . . . 0.0 110.876 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -67.09 -54.93 16.74 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.083 177.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.4 mt -62.7 -39.55 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.235 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 96.9 mt -54.55 -49.2 70.87 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.009 0.524 . . . . 0.0 111.433 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.507 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 55.1 mt-30 -65.17 -45.4 85.07 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.677 0.751 . . . . 0.0 109.646 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -57.57 -42.72 83.65 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 125.805 1.642 . . . . 0.0 112.07 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.43 ' CE2' ' HA ' ' A' ' 3' ' ' ILE . 64.3 m-85 -97.21 -15.83 20.68 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -178.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.414 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.24 -34.42 77.41 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 118.881 0.764 . . . . 0.0 109.567 177.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -79.08 -17.68 54.74 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.533 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -99.83 -51.37 3.74 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.285 -172.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.3 pt -119.31 -20.71 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.573 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 117.32 140.25 6.58 Favored Glycine 0 C--N 1.308 -0.988 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.6 tp -64.72 -37.89 81.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.908 0.354 . . . . 0.0 111.922 -173.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.72 -45.28 82.0 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 122.021 0.915 . . . . 0.0 109.722 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.462 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 79.8 m-20 -61.55 -48.62 80.16 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 113.953 -1.476 . . . . 0.0 111.112 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.6 t -62.34 -44.77 99.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 O-C-N 123.59 0.556 . . . . 0.0 110.441 -177.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -55.1 -47.2 75.28 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.157 0.504 . . . . 0.0 111.973 -178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -40.24 86.69 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 99.0 mt -65.01 -36.92 85.93 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.665 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.3 mm -63.73 -40.25 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 121.136 0.493 . . . . 0.0 109.917 176.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 92.2 mt -65.2 -37.1 86.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.92 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 58.3 m -67.16 -33.62 75.81 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.81 0.814 . . . . 0.0 109.898 176.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.537 HG23 ' HG2' ' A' ' 13' ' ' ARG . 87.6 m -66.59 -44.54 81.88 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.927 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 41.6 pt -83.04 -34.02 10.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -176.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -92.76 120.35 33.05 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -176.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 46.8 tp -80.08 67.64 5.95 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 122.4 1.095 . . . . 0.0 110.311 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -159.63 152.49 21.69 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 102.441 -3.17 . . . . 0.0 102.441 178.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -161.38 -68.07 0.06 Allowed 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 118.977 0.808 . . . . 0.0 109.782 -175.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 46.2 t60 -80.54 98.24 7.52 Favored 'General case' 0 N--CA 1.426 -1.632 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -74.41 105.75 5.7 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.502 -173.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -147.12 77.1 1.44 Allowed 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 35.7 t-80 -99.32 -26.28 14.21 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 165.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 33.6 t-80 . . . . . 0 N--CA 1.405 -2.711 0 N-CA-C 103.202 -2.888 . . . . 0.0 103.202 176.679 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.8 ptp . . . . . 0 CA--C 1.497 -1.062 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.466 ' HB3' ' OE1' ' A' ' 5' ' ' GLU . 45.3 m 64.76 89.48 0.09 Allowed 'General case' 0 CA--C 1.533 0.303 0 O-C-N 124.6 1.188 . . . . 0.0 112.492 177.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.532 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 10.1 tp -154.58 -30.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.792 178.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.3 mt -81.82 13.97 2.95 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.403 0.621 . . . . 0.0 111.112 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.466 ' OE1' ' HB3' ' A' ' 2' ' ' SER . 39.2 mt-10 -86.65 8.66 21.45 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 123.328 0.651 . . . . 0.0 109.603 178.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.416 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.9 t70 -126.56 129.39 24.12 Favored Pre-proline 0 N--CA 1.441 -0.887 0 C-N-CA 120.411 -0.516 . . . . 0.0 111.491 -174.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 4.0 Cg_exo -72.04 -28.67 15.76 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.608 2.206 . . . . 0.0 112.813 -178.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.415 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 18.0 mm-40 -75.03 -35.69 61.93 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -61.03 -47.47 86.26 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.238 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.5 p -63.37 -34.67 68.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.472 0.653 . . . . 0.0 110.908 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -71.01 -31.82 68.44 Favored 'General case' 0 C--O 1.198 -1.61 0 O-C-N 121.951 -0.468 . . . . 0.0 112.245 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 94.0 mt -62.5 -36.79 83.67 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.277 0.56 . . . . 0.0 110.509 176.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -62.03 -38.82 90.14 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.697 177.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -80.17 -33.52 38.28 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.336 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -62.62 -43.54 98.55 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 124.589 1.155 . . . . 0.0 108.359 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.2 tttt 59.26 69.73 0.7 Allowed 'General case' 0 C--O 1.247 0.923 0 C-N-CA 125.234 1.414 . . . . 0.0 113.228 175.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 74.81 -94.94 0.89 Allowed Glycine 0 N--CA 1.437 -1.299 0 CA-C-N 114.527 -1.215 . . . . 0.0 114.832 173.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp 60.0 17.0 6.28 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.172 1.389 . . . . 0.0 111.395 -172.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.4 m -131.48 168.93 22.77 Favored 'Isoleucine or valine' 0 C--O 1.256 1.43 0 C-N-CA 124.523 1.129 . . . . 0.0 108.649 -177.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.428 ' O ' HG23 ' A' ' 24' ' ' VAL . 45.7 t-20 -81.33 117.87 22.17 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 174.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -58.31 -32.52 68.54 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 123.321 0.388 . . . . 0.0 111.09 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -66.74 -41.73 87.36 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.03 -174.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.586 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.1 tp -77.02 -38.7 52.43 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.234 -176.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 20' ' ' ASN . 56.6 t -59.86 -41.88 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 CA-C-O 121.088 0.471 . . . . 0.0 110.094 178.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 15.9 tmm? -57.92 -40.9 81.54 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.071 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -74.76 -36.26 62.58 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.005 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.5 mm -56.61 -47.12 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 81.0 mt -65.1 -41.16 95.23 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.332 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -64.56 -47.3 79.27 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.755 0.788 . . . . 0.0 110.655 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -59.57 -45.37 92.04 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.322 -177.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.416 ' CD1' HD13 ' A' ' 70' ' ' LEU . 35.4 pt -71.71 -39.67 69.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.376 178.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -54.69 -51.6 65.02 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.501 1.12 . . . . 0.0 111.347 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.38 -28.86 67.48 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -76.03 -49.94 16.19 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.746 0.784 . . . . 0.0 110.225 177.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.1 tp -62.03 -59.94 4.34 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.581 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 59.22 -83.27 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.382 1.073 . . . . 0.0 111.189 -175.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.29 20.04 2.63 Favored Glycine 0 N--CA 1.441 -0.984 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.3 m -80.1 174.61 11.42 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.566 ' HA ' ' OH ' ' A' ' 74' ' ' TYR . 6.6 p-10 -105.66 -14.64 15.2 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 121.821 -0.549 . . . . 0.0 111.62 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -85.28 53.07 2.62 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.515 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.5 tt -62.47 -34.81 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-O 121.29 0.567 . . . . 0.0 110.358 178.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.53 ' O ' HG13 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.18 -28.19 68.95 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.967 177.019 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.4 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 11.9 m -79.01 -37.58 38.8 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.46 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 16.1 m -59.96 -40.71 89.97 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 41' ' ' ILE . 44.2 mm -55.64 -49.72 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.245 175.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 42' ' ' LYS . 78.1 mt -53.59 -49.02 58.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.369 -177.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.46 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 22.9 m-85 -60.03 -52.83 63.72 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.734 0.778 . . . . 0.0 110.141 -177.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.6 t -63.83 -43.76 97.96 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.796 -174.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -68.88 -34.38 75.34 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.358 -179.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.6 m -75.99 -21.51 56.85 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.194 0.521 . . . . 0.0 110.978 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 37.5 t -86.09 -41.12 15.04 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.009 0.433 . . . . 0.0 110.701 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.515 ' O ' HG12 ' A' ' 56' ' ' ILE . 84.1 m-70 -107.22 43.31 1.19 Allowed 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -176.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 81.0 mt -47.01 -41.93 17.28 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -175.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.669 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 34.0 t70 -58.93 -50.39 74.22 Favored 'General case' 0 C--O 1.209 -1.039 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -172.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -72.0 -28.41 63.38 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.998 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 52' ' ' HIS . 40.7 mm -64.92 -45.04 95.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 53' ' ' LEU . 0.5 OUTLIER -73.67 -25.2 60.14 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.428 178.513 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.669 ' HG2' ' O ' ' A' ' 54' ' ' ASP . 74.2 mmtt -65.37 -51.39 60.79 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 176.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -123.34 65.62 1.0 Allowed 'General case' 0 CA--C 1.496 -1.121 0 CA-C-O 121.433 0.635 . . . . 0.0 111.655 -178.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.432 ' HD3' ' H ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -66.93 -17.3 64.84 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.174 179.552 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.3 mp0 -64.71 -58.19 6.96 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 173.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -60.08 -49.7 76.6 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.122 -1.399 . . . . 0.0 111.014 -176.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.458 ' HA ' HG12 ' A' ' 66' ' ' ILE . 75.1 m-85 -67.68 -30.26 69.74 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -176.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -73.87 -41.47 62.14 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 119.452 -0.899 . . . . 0.0 109.825 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 84.8 mtp -63.72 -49.24 73.86 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.162 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.9 pt -66.2 -38.6 82.29 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.316 0 C-N-CA 119.729 -0.789 . . . . 0.0 111.741 -179.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.515 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -55.62 -39.7 71.15 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.616 0.246 . . . . 0.0 111.147 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -67.85 -51.7 45.28 Favored 'General case' 0 C--O 1.251 1.155 0 CA-C-O 121.598 0.713 . . . . 0.0 109.694 178.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.3 mt -57.84 -45.01 87.36 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.317 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.567 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 85.4 mt -55.22 -46.37 75.95 Favored 'General case' 0 C--O 1.212 -0.874 0 C-N-CA 123.173 0.589 . . . . 0.0 110.97 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 75.5 mt-30 -61.53 -52.12 65.76 Favored 'General case' 0 C--O 1.256 1.418 0 CA-C-O 121.372 0.606 . . . . 0.0 110.363 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -57.7 -54.74 43.43 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.631 -176.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.532 ' CE2' ' HA ' ' A' ' 3' ' ' ILE . 88.5 m-85 -82.65 -16.36 48.56 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -173.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.567 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -63.79 -39.06 93.33 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 176.16 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -81.32 -37.05 28.97 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.422 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -72.21 -50.63 26.07 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.991 -176.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.8 pt -118.69 -29.99 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -178.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.583 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 129.67 136.02 4.0 Favored Glycine 0 C--N 1.31 -0.878 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.458 ' HB ' ' HB2' ' A' ' 74' ' ' TYR . 9.0 tp -60.01 -38.78 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 CA-C-N 117.298 0.549 . . . . 0.0 111.978 -174.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.94 -45.99 82.38 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.274 0.559 . . . . 0.0 110.197 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.45 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 94.4 m-20 -62.65 -45.92 90.61 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.962 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.5 t -63.41 -47.78 90.22 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.576 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -55.12 -45.54 75.55 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.346 0.593 . . . . 0.0 110.881 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.29 -44.48 87.83 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 115.359 -0.837 . . . . 0.0 108.866 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.2 mt -64.9 -36.24 83.72 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 82' ' ' VAL . 45.3 mm -63.09 -44.7 99.65 Favored 'Isoleucine or valine' 0 C--O 1.244 0.769 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.511 ' O ' ' HB2' ' A' ' 91' ' ' LYS . 94.2 mt -61.28 -41.56 97.16 Favored 'General case' 0 C--O 1.214 -0.794 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.303 177.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.2 m -60.37 -38.86 85.2 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.226 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.6 m -71.79 -39.6 69.8 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.281 -176.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 41.2 pt -83.78 -21.07 8.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.982 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.511 ' HB2' ' O ' ' A' ' 87' ' ' LEU . 18.8 tptm -66.02 -48.32 71.52 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 51.49 54.69 10.61 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.416 ' HB2' ' HG3' ' A' ' 91' ' ' LYS . 37.2 tt0 -110.66 123.73 50.56 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.399 -174.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -112.52 -18.82 12.32 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -123.51 -75.1 0.6 Allowed 'General case' 0 N--CA 1.442 -0.875 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -167.43 129.19 1.58 Allowed 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 125.427 1.491 . . . . 0.0 108.339 176.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -93.54 76.18 4.4 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.076 -177.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 38.6 t60 72.05 -12.76 0.65 Allowed 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 125.7 1.6 . . . . 0.0 113.044 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 1.7 m170 . . . . . 0 C--N 1.295 -1.8 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.11 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtm . . . . . 0 CA--C 1.499 -1.002 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 m -141.46 -69.55 0.37 Allowed 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.424 ' CG2' HD13 ' A' ' 85' ' ' LEU . 20.4 tt -171.12 -10.99 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.24 -175.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 73.9 mt -68.97 -11.39 60.67 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.528 0.68 . . . . 0.0 110.858 -177.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.82 -30.55 70.9 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 124.757 1.223 . . . . 0.0 109.987 173.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.481 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 22.8 t70 -78.42 132.5 65.69 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 114.017 1.118 . . . . 0.0 114.017 -171.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.49 ' O ' HG12 ' A' ' 10' ' ' VAL . 15.0 Cg_exo -70.77 -31.37 16.13 Favored 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 123.024 2.483 . . . . 0.0 113.422 177.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -75.17 -38.26 60.94 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.697 0.761 . . . . 0.0 109.021 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 67.7 t80 -63.93 -38.28 90.52 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.699 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.49 HG12 ' O ' ' A' ' 7' ' ' PRO . 4.3 p -67.29 -33.53 63.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 120.87 0.367 . . . . 0.0 110.305 178.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -58.19 -43.03 87.35 Favored 'General case' 0 C--N 1.342 0.262 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.74 -38.32 84.77 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.038 177.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.685 ' HD2' HG23 ' A' ' 89' ' ' THR . 19.8 mmm180 -60.12 -42.22 94.28 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -72.85 -38.03 67.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.023 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -63.42 -41.58 98.72 Favored 'General case' 0 C--O 1.246 0.887 0 C-N-CA 123.364 0.665 . . . . 0.0 109.406 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.528 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 0.4 OUTLIER 72.03 -84.86 0.03 OUTLIER 'General case' 0 C--O 1.204 -1.298 0 C-N-CA 124.919 1.288 . . . . 0.0 111.885 178.627 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -176.15 97.1 0.11 Allowed Glycine 0 N--CA 1.429 -1.771 0 C-N-CA 119.409 -1.376 . . . . 0.0 112.481 -176.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -105.35 26.56 9.26 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.6 m -129.28 167.96 23.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 113.926 -1.488 . . . . 0.0 109.951 -174.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 24' ' ' VAL . 55.6 t-20 -75.27 121.58 22.39 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -54.02 -39.16 65.89 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.314 0.578 . . . . 0.0 111.41 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -75.05 -33.1 61.69 Favored 'General case' 0 CA--C 1.485 -1.535 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.077 -171.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.608 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.9 tp -76.57 -36.64 57.47 Favored 'General case' 0 N--CA 1.419 -2.002 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.265 -177.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.421 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 61.0 t -65.02 -42.44 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.678 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 56.3 ttp -58.46 -41.2 84.65 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.325 177.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -68.86 -39.88 79.61 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.461 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.608 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.8 mm -57.06 -51.22 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 176.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.5 mt -63.04 -37.89 89.01 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.633 -179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -66.49 -49.06 67.86 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 123.99 0.916 . . . . 0.0 110.449 179.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.3 -41.05 97.05 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.165 -175.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.401 ' CD1' HD13 ' A' ' 70' ' ' LEU . 38.7 pt -72.86 -35.16 48.61 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.587 0 C-N-CA 120.112 -0.635 . . . . 0.0 109.499 176.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.585 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 36.0 tt0 -60.95 -54.57 43.4 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 123.018 0.527 . . . . 0.0 110.421 -179.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.428 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.5 pp -62.24 -34.76 77.13 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.922 -178.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.428 ' N ' HD12 ' A' ' 33' ' ' LEU . 25.9 t70 -75.36 -48.55 22.5 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.914 -178.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 54.1 tp -55.62 -34.93 65.33 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.662 0.785 . . . . 0.0 112.118 -179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.585 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 37.6 mtp180 -66.6 -11.92 55.57 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 111.884 0.328 . . . . 0.0 111.884 -179.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -133.01 23.18 3.94 Favored Glycine 0 N--CA 1.441 -0.982 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.9 t -129.22 172.32 11.57 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 -178.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -95.11 -42.04 8.79 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.02 126.96 49.67 Favored 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.281 -171.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.532 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.7 tt -68.64 -31.79 52.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.265 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.498 ' O ' HG13 ' A' ' 46' ' ' ILE . 21.1 pttm -62.69 -32.9 74.07 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 119.951 -0.7 . . . . 0.0 110.794 178.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 13.0 m -69.11 -43.45 74.42 Favored 'General case' 0 N--CA 1.428 -1.526 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.321 177.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.488 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 25.0 m -60.4 -37.96 82.47 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.438 176.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.1 mm -55.95 -49.19 76.71 Favored 'Isoleucine or valine' 0 C--N 1.344 0.338 0 C-N-CA 123.397 0.679 . . . . 0.0 110.035 176.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 42' ' ' LYS . 75.6 mt -52.29 -47.47 45.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 C-N-CA 123.528 0.731 . . . . 0.0 112.161 -177.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.488 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 25.9 m-85 -61.8 -53.13 60.19 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-O 121.43 0.633 . . . . 0.0 110.453 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.3 -43.6 95.04 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 CA-C-N 114.638 -1.164 . . . . 0.0 111.662 -173.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -67.31 -34.42 77.34 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.419 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 37.2 m -77.57 -21.96 51.69 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.283 0.563 . . . . 0.0 111.099 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.4 t -77.85 -49.11 14.91 Favored 'General case' 0 N--CA 1.434 -1.248 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.501 ' O ' HG12 ' A' ' 56' ' ' ILE . 79.9 m-70 -104.99 45.55 0.96 Allowed 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -175.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 50' ' ' SER . 81.1 mt -46.81 -43.75 18.65 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -175.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.419 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 7.9 t70 -53.58 -51.67 62.24 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -174.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -74.0 -32.68 63.51 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.461 -177.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 52' ' ' HIS . 41.8 mm -62.95 -35.65 72.33 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.477 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 177.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -77.66 -43.95 29.65 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.166 -179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 52.9 mtpt -60.96 -46.25 91.48 Favored 'General case' 0 CA--C 1.505 -0.771 0 C-N-CA 122.975 0.51 . . . . 0.0 110.754 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -122.34 60.33 1.0 Allowed 'General case' 0 C--N 1.302 -1.472 0 CA-C-O 121.562 0.696 . . . . 0.0 111.432 -177.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -22.94 66.13 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.762 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -63.09 -49.76 73.19 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 123.503 0.502 . . . . 0.0 109.661 175.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -63.09 -49.6 73.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.874 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.484 ' HA ' HG12 ' A' ' 66' ' ' ILE . 81.2 m-85 -68.49 -33.42 74.12 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -178.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.54 -50.04 72.93 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.164 0.507 . . . . 0.0 109.802 174.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.2 mtm -61.16 -48.88 79.55 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.364 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.556 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 46.4 pt -67.78 -39.89 82.78 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.826 -177.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.541 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.53 -39.81 68.03 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 118.348 0.522 . . . . 0.0 111.587 -178.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -63.39 -55.73 22.06 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.575 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.0 mt -60.63 -40.41 84.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.747 -176.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.584 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 93.0 mt -55.61 -50.32 70.44 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 122.929 0.492 . . . . 0.0 111.636 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.541 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 43.2 mt-30 -70.36 -46.79 63.4 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 122.297 1.046 . . . . 0.0 109.858 -176.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 72' ' ' ARG . 33.0 ttt180 -60.91 -44.55 97.02 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 113.51 -1.677 . . . . 0.0 111.43 -175.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -91.98 -15.28 28.17 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.584 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.94 -30.26 70.34 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 119.929 -0.708 . . . . 0.0 109.098 175.127 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -79.78 -17.46 53.37 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.099 176.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -97.42 -51.3 4.21 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.028 -176.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.5 pt -118.17 -25.9 2.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -176.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.534 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 120.42 143.83 6.94 Favored Glycine 0 C--N 1.308 -0.978 0 C-N-CA 120.064 -1.065 . . . . 0.0 111.213 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tp -60.68 -42.78 93.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -175.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.76 -41.84 87.53 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.554 0.692 . . . . 0.0 110.417 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.557 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 2.4 m-20 -63.07 -48.4 78.82 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.592 -1.186 . . . . 0.0 109.823 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 78' ' ' GLY . 33.9 t -62.29 -46.82 95.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.586 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -53.62 -46.7 70.54 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.203 0.525 . . . . 0.0 111.345 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -42.01 95.34 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 115.476 -0.784 . . . . 0.0 108.916 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 88.7 mt -65.44 -35.46 80.99 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.32 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 82' ' ' VAL . 49.0 mm -66.22 -45.82 89.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.56 ' O ' ' HG2' ' A' ' 91' ' ' LYS . 93.7 mt -59.53 -42.29 91.95 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.588 178.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 50.9 m -64.14 -33.69 76.36 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.127 0.489 . . . . 0.0 111.047 177.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.685 HG23 ' HD2' ' A' ' 13' ' ' ARG . 91.5 m -68.79 -37.44 79.28 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.779 179.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.528 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 39.6 pt -86.21 -5.61 10.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 87' ' ' LEU . 73.6 mmtt -62.15 103.54 0.39 Allowed 'General case' 0 C--O 1.241 0.643 0 CA-C-O 120.896 0.379 . . . . 0.0 110.97 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.2 tt -81.79 121.02 25.9 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 175.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -67.27 116.92 8.58 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.367 0.603 . . . . 0.0 110.667 -176.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -86.23 -16.27 38.22 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.639 -178.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 35.6 m80 -73.57 150.98 41.08 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 171.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -75.37 76.47 2.45 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-O 121.587 0.708 . . . . 0.0 110.832 -176.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -149.26 113.06 5.1 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.902 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -77.11 -38.04 53.0 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 105.021 -2.214 . . . . 0.0 105.021 169.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 19.3 t-80 . . . . . 0 N--CA 1.425 -1.684 0 N-CA-C 105.275 -2.12 . . . . 0.0 105.275 174.614 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.2 mmt . . . . . 0 CA--C 1.5 -0.976 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.3 m -70.0 124.65 24.6 Favored 'General case' 0 N--CA 1.437 -1.099 0 O-C-N 123.229 0.331 . . . . 0.0 111.342 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.1 tp -163.67 -34.48 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 176.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.8 mt -79.94 6.11 12.15 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 121.573 0.702 . . . . 0.0 110.885 178.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -91.9 -2.87 56.61 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.155 176.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.415 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 6.2 t70 -105.35 127.65 28.17 Favored Pre-proline 0 C--N 1.312 -1.043 0 C-N-CA 119.395 -0.922 . . . . 0.0 111.643 -173.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 16.6 Cg_exo -67.07 -27.31 42.27 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.882 2.388 . . . . 0.0 112.438 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.465 ' HB2' HD11 ' A' ' 69' ' ' ILE . 3.8 mm-40 -75.01 -25.27 58.67 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -177.081 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -70.46 -39.56 74.21 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.357 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.412 HG12 ' O ' ' A' ' 7' ' ' PRO . 9.4 p -68.4 -34.48 66.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.213 0.53 . . . . 0.0 109.574 178.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -62.68 -42.01 99.4 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 174.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.563 ' HB3' ' HE3' ' A' ' 16' ' ' LYS . 74.5 mt -57.45 -44.51 84.83 Favored 'General case' 0 C--O 1.195 -1.789 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.276 176.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -58.11 -32.84 68.49 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 118.659 0.663 . . . . 0.0 112.566 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -75.58 -32.89 60.53 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.903 0.859 . . . . 0.0 110.117 177.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -95.57 5.1 52.37 Favored 'General case' 0 CA--C 1.563 1.468 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.293 -176.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.616 ' HZ2' ' HB ' ' A' ' 89' ' ' THR . 17.4 mmtp -80.13 170.95 15.73 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 121.007 -1.058 . . . . 0.0 110.379 177.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 93.96 -34.83 4.45 Favored Glycine 0 C--O 1.221 -0.682 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.857 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.8 mtmm -80.73 11.24 3.99 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 124.092 0.957 . . . . 0.0 112.838 -178.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.0 m -134.09 168.31 24.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -177.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.418 ' O ' HG23 ' A' ' 24' ' ' VAL . 14.5 t-20 -94.23 138.94 31.67 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.451 ' HA ' HD12 ' A' ' 90' ' ' ILE . 76.0 t80 -61.37 -44.07 97.8 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 122.569 0.348 . . . . 0.0 111.761 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 -71.56 -31.22 66.75 Favored 'General case' 0 CA--C 1.492 -1.257 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -173.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.495 ' O ' HG12 ' A' ' 27' ' ' ILE . 30.8 tp -69.69 -47.86 61.7 Favored 'General case' 0 N--CA 1.427 -1.583 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.453 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.509 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 94.6 t -63.52 -42.2 95.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -56.8 -43.73 81.25 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -65.54 -43.18 90.72 Favored 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.944 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 23' ' ' LEU . 46.5 mm -58.74 -50.26 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-O 121.274 0.559 . . . . 0.0 109.811 177.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 82.7 mt -61.72 -36.24 80.37 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.325 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -71.84 -47.69 51.37 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.38 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -59.2 -41.08 87.71 Favored 'General case' 0 C--O 1.248 1.025 0 C-N-CA 124.307 1.043 . . . . 0.0 110.292 -177.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.423 ' CD1' HD13 ' A' ' 70' ' ' LEU . 45.8 pt -73.03 -40.31 58.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 120.596 -0.442 . . . . 0.0 109.996 176.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.423 ' O ' ' HB2' ' A' ' 36' ' ' ARG . 39.1 tt0 -60.95 -47.64 85.48 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 123.516 0.726 . . . . 0.0 111.051 -178.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.83 -30.1 71.23 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -75.0 -50.56 16.14 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 119.147 -1.021 . . . . 0.0 110.04 174.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 69.2 tp -60.49 -29.38 69.04 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.966 0.906 . . . . 0.0 111.692 -177.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 32' ' ' GLU . 3.0 tpt180 -58.86 -28.31 65.99 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 124.425 1.09 . . . . 0.0 109.964 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -130.82 19.98 4.9 Favored Glycine 0 N--CA 1.432 -1.598 0 C-N-CA 120.833 -0.699 . . . . 0.0 113.149 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 75.4 p -119.44 -103.26 0.41 Allowed 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.771 177.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.9 t70 178.23 -52.6 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -177.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.608 ' OD1' ' HG2' ' A' ' 42' ' ' LYS . 28.9 t-20 -101.95 112.99 25.82 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.226 -174.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.559 ' O ' HG12 ' A' ' 45' ' ' ILE . 10.9 tt -64.48 -31.94 55.66 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.102 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.608 ' HG2' ' OD1' ' A' ' 40' ' ' ASN . 64.6 pttt -71.86 -28.23 63.4 Favored 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 119.126 -1.029 . . . . 0.0 110.084 -177.214 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.2 m -73.91 -40.59 63.04 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.248 -0.887 . . . . 0.0 108.871 175.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.429 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 18.4 m -57.52 -40.7 79.32 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 121.021 0.439 . . . . 0.0 110.094 174.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.559 HG12 ' O ' ' A' ' 41' ' ' ILE . 39.8 mm -54.51 -47.19 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 123.814 0.846 . . . . 0.0 109.897 175.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 42' ' ' LYS . 63.4 mt -52.93 -50.7 42.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.364 -0.834 . . . . 0.0 112.538 -177.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.429 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 31.0 m-85 -57.91 -49.84 75.38 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 121.164 0.507 . . . . 0.0 110.436 -175.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.4 t -66.78 -47.75 81.96 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 CA-C-N 114.508 -1.224 . . . . 0.0 111.671 -174.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -65.84 -39.01 90.37 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.823 0.344 . . . . 0.0 110.85 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.9 t -69.32 -22.06 63.8 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.306 178.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.9 t -97.16 -0.92 46.1 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-O 121.346 0.593 . . . . 0.0 109.944 -178.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.573 ' O ' HG12 ' A' ' 56' ' ' ILE . 26.8 m-70 -134.42 32.79 3.33 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 95.2 mt -47.37 -51.35 19.92 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -172.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -62.53 -44.21 96.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.041 0.448 . . . . 0.0 111.104 -175.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.489 ' OE2' HD11 ' A' ' 27' ' ' ILE . 24.4 tt0 -60.76 -49.83 75.9 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 124.534 1.134 . . . . 0.0 110.17 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.573 HG12 ' O ' ' A' ' 52' ' ' HIS . 43.6 mm -55.75 -43.01 72.26 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.147 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.018 176.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 69.2 mtm180 -64.25 -34.46 78.16 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -61.35 -51.43 68.84 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 120.863 0.363 . . . . 0.0 110.947 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.424 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 48.7 m-80 -121.77 60.7 0.96 Allowed 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 121.346 0.593 . . . . 0.0 110.434 -177.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.653 ' HG2' ' OE1' ' A' ' 61' ' ' GLU . 4.3 ptpp? -65.07 -33.86 77.05 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.128 -177.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.653 ' OE1' ' HG2' ' A' ' 60' ' ' LYS . 3.1 mp0 -63.81 -45.87 87.67 Favored 'General case' 0 N--CA 1.414 -2.226 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.424 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.424 ' HB3' ' HB3' ' A' ' 59' ' ' ASN . 78.0 t80 -63.83 -52.39 60.35 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.124 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.442 ' HA ' HG12 ' A' ' 66' ' ' ILE . 51.3 m-85 -68.46 -34.61 76.25 Favored 'General case' 0 N--CA 1.432 -1.347 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -175.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.66 -43.77 65.46 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.343 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.3 mtm -67.67 -39.78 84.5 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.665 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.527 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.8 pt -67.2 -41.59 86.99 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.993 0 C-N-CA 118.342 -1.343 . . . . 0.0 110.732 177.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.526 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.2 -36.57 68.55 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 121.141 0.496 . . . . 0.0 111.144 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -68.55 -55.29 12.16 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.738 177.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.465 HD11 ' HB2' ' A' ' 8' ' ' GLU . 86.8 mt -61.53 -38.96 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.837 -178.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.597 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 93.1 mt -56.65 -48.05 78.42 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 123.069 0.548 . . . . 0.0 111.347 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 69.8 mt-30 -66.21 -46.63 76.6 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -55.51 -52.46 63.62 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.817 1.647 . . . . 0.0 112.386 -176.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -90.13 -14.83 32.82 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -175.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.597 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.36 -28.32 67.85 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.354 0.597 . . . . 0.0 109.4 174.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -73.56 -22.14 60.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.106 176.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -96.3 -51.15 4.5 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -176.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.6 pt -119.79 -30.83 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.495 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 136.53 173.66 13.02 Favored Glycine 0 C--O 1.212 -1.24 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -178.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.5 tp -91.91 -40.59 12.45 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.105 0 CA-C-N 118.362 1.081 . . . . 0.0 110.506 -174.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -59.66 -33.97 72.23 Favored 'General case' 0 N--CA 1.421 -1.876 0 C-N-CA 123.975 0.91 . . . . 0.0 110.218 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.527 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 12.2 m120 -69.39 -48.14 62.07 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.396 -1.275 . . . . 0.0 109.366 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 78' ' ' GLY . 44.2 t -66.57 -38.55 81.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.3 -178.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -56.4 -45.61 80.54 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.257 0.551 . . . . 0.0 110.392 177.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -44.92 94.63 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 87.0 mt -59.43 -42.31 91.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.452 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.6 mm -64.08 -38.76 83.27 Favored 'Isoleucine or valine' 0 C--O 1.269 2.114 0 C-N-CA 122.637 0.375 . . . . 0.0 110.685 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.75 -40.5 95.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.562 0.696 . . . . 0.0 110.131 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 49.7 m -62.07 -33.27 74.11 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.322 177.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.616 ' HB ' ' HZ2' ' A' ' 16' ' ' LYS . 1.3 m -69.7 -34.57 74.1 Favored 'General case' 0 CA--C 1.562 1.415 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.492 HG23 ' NZ ' ' A' ' 16' ' ' LYS . 23.8 pt -87.54 -39.37 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -176.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -95.62 116.23 28.56 Favored 'General case' 0 C--N 1.292 -1.929 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 -173.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 85.3 mt 64.36 85.35 0.14 Allowed 'General case' 0 C--O 1.242 0.665 0 O-C-N 124.511 1.132 . . . . 0.0 109.772 -176.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.423 ' C ' ' H ' ' A' ' 95' ' ' HIS . 31.5 tt0 -55.92 146.34 22.42 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.983 -177.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -81.2 21.84 0.7 Allowed 'General case' 0 CA--C 1.548 0.9 0 CA-C-O 122.15 0.976 . . . . 0.0 109.538 -178.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.483 ' HA ' ' OXT' ' A' ' 99' ' ' HIS . 49.1 t-80 -159.06 145.34 16.72 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -151.06 -86.86 0.07 Allowed 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 170.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -157.21 24.33 0.3 Allowed 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.426 1.107 . . . . 0.0 108.173 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -140.24 -43.71 0.42 Allowed 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.278 -178.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.483 ' OXT' ' HA ' ' A' ' 95' ' ' HIS . 9.8 t-160 . . . . . 0 N--CA 1.431 -1.393 0 N-CA-C 106.441 -1.689 . . . . 0.0 106.441 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.452 ' HB2' ' CG ' ' A' ' 5' ' ' GLU . 1.9 mpt? . . . . . 0 CA--C 1.5 -0.965 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.473 ' O ' HG22 ' A' ' 3' ' ' ILE . 50.7 m -138.13 114.88 10.63 Favored 'General case' 0 N--CA 1.424 -1.764 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.473 HG22 ' O ' ' A' ' 2' ' ' SER . 4.0 tp 76.1 -32.86 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 C-N-CA 127.014 2.126 . . . . 0.0 113.086 175.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 99.1 mt -79.27 13.87 1.73 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.027 0.531 . . . . 0.0 111.933 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.452 ' CG ' ' HB2' ' A' ' 1' ' ' MET . 19.2 mt-10 -102.5 -9.28 20.35 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 13.1 t70 -99.74 126.24 37.77 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.59 -171.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 6.2 Cg_exo -71.23 -24.59 23.06 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.99 2.46 . . . . 0.0 112.721 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.458 ' HB2' HD11 ' A' ' 69' ' ' ILE . 6.0 mm-40 -75.52 -37.83 59.83 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -59.46 -44.51 92.98 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.955 178.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.6 p -65.77 -37.36 79.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.19 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -70.68 -29.17 65.41 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.175 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 64.1 mt -61.11 -39.32 89.53 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.212 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.576 ' HG2' HG23 ' A' ' 89' ' ' THR . 59.4 mtm180 -72.05 -27.19 62.53 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.082 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -77.25 -24.17 51.16 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.455 0.645 . . . . 0.0 109.736 176.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.401 ' CE1' ' HB2' ' A' ' 62' ' ' PHE . 39.1 t80 -84.22 -37.59 21.6 Favored 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 39.2 ttmt 76.55 -33.42 0.21 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 126.742 2.017 . . . . 0.0 112.25 178.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.29 -55.94 0.7 Allowed Glycine 0 N--CA 1.42 -2.406 0 C-N-CA 120.416 -0.897 . . . . 0.0 110.964 177.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt 57.08 27.69 13.75 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.327 1.051 . . . . 0.0 110.921 -178.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.9 m -131.55 168.9 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 C-N-CA 125.169 1.387 . . . . 0.0 110.249 -175.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -76.84 123.88 26.89 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -53.6 -38.37 63.92 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 123.607 0.763 . . . . 0.0 110.824 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -70.97 -31.22 67.71 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.57 -173.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.566 ' O ' HG12 ' A' ' 27' ' ' ILE . 34.8 tp -76.42 -41.71 46.68 Favored 'General case' 0 N--CA 1.425 -1.691 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.695 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.454 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 62.1 t -63.11 -44.09 99.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 177.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 62.3 ttp -57.32 -35.13 69.47 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.118 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -74.64 -41.93 59.47 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.999 177.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.566 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.62 -49.93 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-O 121.488 0.661 . . . . 0.0 109.314 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 78.6 mt -61.96 -40.5 95.78 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.548 -1.205 . . . . 0.0 110.406 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -64.3 -47.38 79.7 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.781 0.801 . . . . 0.0 110.827 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -62.28 -42.69 99.56 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.992 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.404 HG21 HD13 ' A' ' 45' ' ' ILE . 32.8 pt -71.87 -38.38 64.86 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.481 175.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.87 -50.73 72.92 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.069 0.948 . . . . 0.0 111.239 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -65.21 -32.41 74.07 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.38 -179.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.42 ' N ' HD12 ' A' ' 33' ' ' LEU . 20.3 t70 -75.73 -48.5 21.61 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.141 0.496 . . . . 0.0 111.08 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.612 ' HG ' ' H ' ' A' ' 37' ' ' GLY . 57.1 tp -62.81 -47.72 82.2 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.29 -178.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 63.55 10.85 5.22 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.051 0.941 . . . . 0.0 112.235 -177.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.612 ' H ' ' HG ' ' A' ' 35' ' ' LEU . . . 76.21 12.82 83.85 Favored Glycine 0 N--CA 1.434 -1.467 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.243 -177.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.4 p -126.61 -47.25 1.56 Allowed 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 -174.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -79.62 -102.66 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 -171.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -141.41 106.6 4.99 Favored 'General case' 0 CA--C 1.498 -1.049 0 O-C-N 122.025 -0.422 . . . . 0.0 110.487 -176.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.545 ' HB ' HD22 ' A' ' 35' ' ' LEU . 12.7 tt -70.04 -29.05 38.52 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 CA-C-O 121.073 0.463 . . . . 0.0 109.892 -177.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.473 ' O ' HG13 ' A' ' 46' ' ' ILE . 10.2 ptmm? -59.35 -36.45 75.74 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.195 176.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 19.0 m -79.62 -35.61 39.2 Favored 'General case' 0 N--CA 1.417 -2.09 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.286 -178.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.8 m -59.22 -43.48 92.31 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 41' ' ' ILE . 29.8 mm -55.44 -41.29 62.17 Favored 'Isoleucine or valine' 0 C--N 1.346 0.419 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.008 177.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 42' ' ' LYS . 70.4 mt -57.37 -51.06 74.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.367 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.557 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -62.35 -52.44 63.62 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.564 0.697 . . . . 0.0 110.258 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.9 t -62.0 -46.95 95.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 114.585 -1.189 . . . . 0.0 112.084 -174.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -66.46 -36.44 82.78 Favored 'General case' 0 C--O 1.212 -0.888 0 C-N-CA 121.173 -0.211 . . . . 0.0 111.545 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.1 m -72.73 -25.4 61.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.979 0.418 . . . . 0.0 111.444 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.6 t -83.65 -40.39 19.04 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-O 121.167 0.508 . . . . 0.0 110.561 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.474 ' O ' HG12 ' A' ' 56' ' ' ILE . 64.1 m-70 -103.21 35.52 2.53 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.445 -175.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.1 mt -47.14 -43.17 20.62 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -175.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -53.99 -51.12 64.93 Favored 'General case' 0 C--N 1.318 -0.781 0 O-C-N 123.557 0.536 . . . . 0.0 112.226 -175.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 58' ' ' LYS . 12.8 tp10 -73.9 -34.36 64.36 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.044 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.474 HG12 ' O ' ' A' ' 52' ' ' HIS . 46.3 mm -61.19 -37.44 77.49 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -73.56 -43.15 60.57 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.682 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 55' ' ' GLU . 53.6 mtpt -58.33 -50.24 74.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.248 0.547 . . . . 0.0 111.565 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -120.02 54.14 1.04 Allowed 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 122.035 0.921 . . . . 0.0 110.39 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -53.47 -37.53 62.76 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 113.764 -1.562 . . . . 0.0 112.932 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -60.98 -46.82 89.2 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 120.954 0.406 . . . . 0.0 110.59 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.401 ' HB2' ' CE1' ' A' ' 15' ' ' PHE . 89.6 t80 -63.36 -51.02 67.63 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.056 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.508 ' HA ' HG12 ' A' ' 66' ' ' ILE . 85.9 m-85 -70.4 -28.16 64.86 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 -175.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -75.68 -44.34 42.74 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.134 177.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.7 mtm -62.76 -45.77 91.13 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.038 178.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.508 HG12 ' HA ' ' A' ' 63' ' ' TYR . 44.0 pt -64.82 -36.9 78.82 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.217 0 C-N-CA 119.354 -0.938 . . . . 0.0 111.276 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.545 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -53.53 -46.63 70.22 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.351 0.407 . . . . 0.0 112.006 -177.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -76.3 -35.61 58.77 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.144 -0.622 . . . . 0.0 112.014 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.458 HD11 ' HB2' ' A' ' 8' ' ' GLU . 82.3 mt -64.05 -45.29 97.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 177.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.582 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.9 mt -52.88 -45.95 67.71 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 123.461 0.704 . . . . 0.0 110.988 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.545 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.0 mt-30 -66.29 -48.39 70.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.472 0.653 . . . . 0.0 110.52 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 39.5 ttm180 -59.19 -50.95 72.05 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.245 1.418 . . . . 0.0 111.436 -177.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.415 ' OH ' ' HB2' ' A' ' 5' ' ' GLU . 48.5 m-85 -86.56 -15.44 39.93 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -176.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.582 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.37 -34.8 78.04 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.2 174.419 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -74.88 -39.58 61.42 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.008 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -75.26 -47.06 29.82 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -174.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.8 pt -123.39 -30.72 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 O-C-N 121.721 -0.612 . . . . 0.0 112.569 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.504 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.95 142.5 5.89 Favored Glycine 0 C--N 1.309 -0.929 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.409 ' HB ' ' HB2' ' A' ' 74' ' ' TYR . 8.2 tp -61.14 -38.45 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 117.096 0.448 . . . . 0.0 111.876 -174.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -53.47 -45.75 69.68 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.713 0.768 . . . . 0.0 110.475 179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.469 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 42.6 m-80 -65.59 -45.68 82.28 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.189 -1.368 . . . . 0.0 110.195 -178.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 78' ' ' GLY . 15.0 t -65.01 -45.66 93.92 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.12 -176.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -55.56 -43.75 76.18 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.335 0.588 . . . . 0.0 110.844 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -45.49 83.7 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 98.7 mt -62.39 -39.67 93.97 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.669 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.473 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.5 mm -62.89 -40.48 88.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-O 120.847 0.356 . . . . 0.0 110.073 177.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 98.6 mt -63.71 -38.62 91.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.867 0.842 . . . . 0.0 110.32 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.7 m -67.07 -34.36 77.5 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.033 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.576 HG23 ' HG2' ' A' ' 13' ' ' ARG . 56.4 m -64.95 -46.21 82.53 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 124.324 1.05 . . . . 0.0 110.805 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.433 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 24.9 pt -75.36 -12.71 14.91 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -177.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -101.94 22.08 13.63 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.171 0.51 . . . . 0.0 109.758 174.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.414 HD11 ' HB2' ' A' ' 95' ' ' HIS . 33.0 tp -146.32 167.34 23.78 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.422 ' HB2' ' HE2' ' A' ' 16' ' ' LYS . 32.1 tt0 -145.77 -76.4 0.2 Allowed 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 176.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.44 ' CD2' ' HB2' ' A' ' 96' ' ' HIS . 20.4 t60 -150.77 81.86 1.34 Allowed 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -174.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.414 ' HB2' HD11 ' A' ' 92' ' ' LEU . 9.4 t-80 -84.41 72.21 10.62 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -177.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.44 ' HB2' ' CD2' ' A' ' 94' ' ' HIS . 50.4 t-80 -71.07 -33.87 70.65 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.047 -178.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -77.48 95.66 4.53 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 175.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 3.8 p-80 -138.91 140.17 38.27 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-O 121.01 0.433 . . . . 0.0 111.038 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 15.1 p80 . . . . . 0 C--N 1.29 -1.996 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.632 -174.491 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.2 mtt . . . . . 0 CA--C 1.51 -0.587 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.2 t -77.85 151.5 33.87 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 121.375 0.607 . . . . 0.0 110.023 -179.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 16.3 tt -142.57 19.58 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 123.414 1.578 . . . . 0.0 107.36 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.1 mt -82.66 4.42 24.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.929 -176.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.413 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 21.8 mt-10 -79.89 -24.88 40.85 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 -178.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.449 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 7.1 t70 -86.18 131.1 47.47 Favored Pre-proline 0 C--O 1.247 0.964 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.351 -170.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 2.9 Cg_exo -72.1 -30.36 13.52 Favored 'Trans proline' 0 C--O 1.241 0.638 0 C-N-CA 122.848 2.366 . . . . 0.0 113.108 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -76.2 -28.73 57.35 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -64.43 -41.82 96.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.389 178.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 7' ' ' PRO . 10.3 p -63.44 -34.86 69.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -59.18 -43.85 92.17 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.358 171.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.71 -35.48 78.17 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 122.907 0.483 . . . . 0.0 110.962 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -61.5 -36.78 81.45 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.185 0.594 . . . . 0.0 110.641 177.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -79.76 -38.09 33.95 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.996 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.428 ' CZ ' ' HB2' ' A' ' 18' ' ' LYS . 51.1 t80 -59.56 -49.36 78.08 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.073 -0.967 . . . . 0.0 108.953 177.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.574 ' O ' ' HA ' ' A' ' 90' ' ' ILE . 87.6 tttt 64.73 -93.74 0.04 OUTLIER 'General case' 0 C--O 1.212 -0.912 0 C-N-CA 125.654 1.582 . . . . 0.0 111.378 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -144.03 108.37 0.49 Allowed Glycine 0 N--CA 1.432 -1.609 0 C-N-CA 119.549 -1.31 . . . . 0.0 112.336 -176.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.428 ' HB2' ' CZ ' ' A' ' 15' ' ' PHE . 59.3 mtpt -136.46 19.47 3.13 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.402 HG21 HG21 ' A' ' 24' ' ' VAL . 31.0 m -128.13 168.26 21.66 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 CA-C-N 114.442 -1.254 . . . . 0.0 108.835 -174.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.417 ' O ' HG23 ' A' ' 24' ' ' VAL . 79.5 m-20 -84.32 110.54 18.67 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 120.072 -0.651 . . . . 0.0 109.671 173.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.522 ' CE1' ' HD2' ' A' ' 91' ' ' LYS . 52.5 t80 -48.82 -47.94 41.98 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.319 1.048 . . . . 0.0 112.888 -178.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -64.65 -31.88 73.29 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -176.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.628 ' O ' HG12 ' A' ' 27' ' ' ILE . 31.1 tp -76.79 -40.63 47.48 Favored 'General case' 0 N--CA 1.426 -1.648 0 C-N-CA 119.819 -0.752 . . . . 0.0 110.067 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 20' ' ' ASN . 53.9 t -60.55 -42.3 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 177.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -57.2 -44.38 83.58 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.356 176.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -68.24 -38.13 81.53 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.943 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.628 HG12 ' O ' ' A' ' 23' ' ' LEU . 49.6 mm -56.81 -51.71 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.8 mt -64.02 -40.98 97.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.493 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -66.02 -47.52 74.17 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.509 0.671 . . . . 0.0 111.35 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -62.02 -39.71 93.2 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.703 -176.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.473 HG23 HG21 ' A' ' 48' ' ' VAL . 31.0 pt -73.01 -39.21 57.33 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.234 175.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.99 -52.93 63.31 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.7 0.8 . . . . 0.0 111.406 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -66.6 -28.78 68.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -178.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -76.09 -49.71 16.7 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.633 0.73 . . . . 0.0 109.816 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 63.8 tp -63.15 -24.2 67.78 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.276 -178.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -48.58 -38.24 20.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.478 1.111 . . . . 0.0 111.105 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -173.12 59.08 0.15 Allowed Glycine 0 N--CA 1.435 -1.367 0 C-N-CA 119.992 -1.099 . . . . 0.0 112.334 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 53.9 m -146.95 -80.48 0.15 Allowed 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -126.6 -160.16 0.97 Allowed 'General case' 0 C--O 1.245 0.833 0 C-N-CA 119.557 -0.857 . . . . 0.0 110.379 -172.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -82.86 146.69 28.75 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.509 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.8 tt -58.0 -38.37 66.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 O-C-N 123.144 0.278 . . . . 0.0 111.506 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -66.46 -31.72 72.64 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.834 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.2 m -73.12 -41.61 63.81 Favored 'General case' 0 N--CA 1.426 -1.67 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 177.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.458 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 15.6 m -59.63 -39.71 85.21 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.783 177.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 41' ' ' ILE . 23.8 mm -52.39 -46.74 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 124.054 0.942 . . . . 0.0 110.278 175.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 60.2 mt -57.69 -47.66 85.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.986 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.458 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 19.5 m-85 -59.75 -42.59 93.58 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.812 0.815 . . . . 0.0 110.299 -177.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.473 HG21 HG23 ' A' ' 31' ' ' ILE . 46.5 t -71.85 -49.22 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.75 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.364 -176.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.417 ' HA ' HG13 ' A' ' 56' ' ' ILE . 4.1 m-30 -62.98 -40.39 97.58 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.764 -178.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.5 t -66.78 -31.25 71.76 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 122.58 0.352 . . . . 0.0 111.665 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.7 t -84.68 -27.57 26.96 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.136 0.493 . . . . 0.0 111.008 -178.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.56 ' O ' HG12 ' A' ' 56' ' ' ILE . 83.1 m-70 -117.15 35.36 4.68 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -174.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 81.6 mt -47.13 -40.0 14.65 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 -174.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -56.78 -51.27 69.58 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -174.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -72.99 -32.61 65.29 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.185 0.517 . . . . 0.0 109.648 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.56 HG12 ' O ' ' A' ' 52' ' ' HIS . 44.9 mm -62.7 -45.4 98.93 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.786 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.623 -178.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.3 ptp85 -77.22 -28.06 53.67 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.224 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.504 ' HD2' ' ND2' ' A' ' 59' ' ' ASN . 0.0 OUTLIER -69.33 -32.6 71.81 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -175.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.504 ' ND2' ' HD2' ' A' ' 58' ' ' LYS . 55.8 m-80 -128.47 55.34 1.7 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.357 174.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -63.7 -24.08 67.63 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.522 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -63.86 -57.53 9.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 175.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -59.53 -51.21 70.83 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.692 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.455 ' HA ' HG12 ' A' ' 66' ' ' ILE . 72.6 m-85 -67.59 -26.12 66.11 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -176.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -77.07 -46.05 24.96 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.611 176.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 77.5 mtm -59.09 -50.59 73.48 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.664 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.7 pt -63.31 -41.69 93.66 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.698 0 C-N-CA 119.617 -0.833 . . . . 0.0 112.038 -178.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.54 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.85 -39.65 74.65 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.046 0.45 . . . . 0.0 110.91 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.56 -52.49 31.26 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.578 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.8 mt -60.34 -42.91 92.45 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.6 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 98.0 mt -52.66 -46.72 67.29 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 123.277 0.631 . . . . 0.0 111.265 178.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 63.7 mt-30 -68.57 -43.31 76.86 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.015 0.436 . . . . 0.0 110.565 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -62.07 -47.56 84.12 Favored 'General case' 0 N--CA 1.428 -1.534 0 C-N-CA 123.755 0.822 . . . . 0.0 111.556 -178.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.413 ' OH ' ' HB2' ' A' ' 5' ' ' GLU . 57.6 m-85 -85.75 -15.48 42.01 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 -177.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.551 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.01 -33.3 75.27 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 174.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -73.46 -34.71 65.51 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.483 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -85.35 -51.46 6.55 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.161 0.801 . . . . 0.0 113.161 -175.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.0 pt -118.48 -29.11 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -173.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.543 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.95 143.91 6.21 Favored Glycine 0 N--CA 1.438 -1.186 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.0 tp -61.33 -37.16 76.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 122.44 0.296 . . . . 0.0 111.243 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -65.02 -35.5 81.38 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.627 -177.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.627 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.4 t-20 -67.73 -45.53 74.74 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.824 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.1 t -66.77 -38.22 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.626 -177.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.462 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 47.3 t-20 -50.78 -50.0 56.99 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.126 0.97 . . . . 0.0 108.898 177.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -40.84 81.96 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.109 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 81.5 mt -61.16 -42.01 97.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.528 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.6 mm -64.42 -44.47 97.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 177.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 80.9 mt -61.38 -34.71 75.78 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.267 0.556 . . . . 0.0 110.948 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.8 m -66.47 -46.33 76.72 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.235 177.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.6 m -64.27 -35.28 80.32 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.436 0.694 . . . . 0.0 111.864 -175.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.574 ' HA ' ' O ' ' A' ' 16' ' ' LYS . 26.5 pt -82.51 -19.08 10.56 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.522 ' HD2' ' CE1' ' A' ' 21' ' ' PHE . 56.1 mtpt -104.36 -59.95 1.66 Allowed 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.271 -0.572 . . . . 0.0 112.02 179.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 96.9 mt 63.94 20.99 12.46 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.055 0.942 . . . . 0.0 111.203 -174.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -64.78 -56.71 11.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.618 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -134.02 143.86 48.35 Favored 'General case' 0 CA--C 1.503 -0.865 0 C-N-CA 120.466 -0.494 . . . . 0.0 109.684 176.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -85.96 130.9 34.4 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 123.469 0.481 . . . . 0.0 110.151 178.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -78.93 57.42 2.15 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -175.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -159.07 -60.57 0.07 Allowed 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.766 -0.774 . . . . 0.0 109.946 177.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -77.46 82.9 3.89 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.04 0.924 . . . . 0.0 111.741 179.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 . . . . . 0 C--N 1.291 -1.952 0 N-CA-C 104.98 -2.23 . . . . 0.0 104.98 178.588 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.1 mtt . . . . . 0 C--O 1.239 0.551 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.5 t -136.8 81.65 1.89 Allowed 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.3 tp -132.79 -19.15 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.634 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 98.3 mt -77.94 13.43 1.4 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.295 0.569 . . . . 0.0 111.914 -178.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -86.39 -5.57 59.14 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.84 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.433 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 18.2 t70 -113.95 131.43 23.14 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 112.727 0.639 . . . . 0.0 112.727 -177.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.485 ' O ' HG12 ' A' ' 10' ' ' VAL . 7.2 Cg_exo -71.85 -24.6 21.0 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.462 2.774 . . . . 0.0 113.866 176.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.34 -38.52 74.87 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -178.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -59.81 -38.84 83.13 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.581 176.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 7' ' ' PRO . 8.6 p -69.49 -33.85 59.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.171 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.12 -36.42 79.67 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 175.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.421 HD21 ' HB2' ' A' ' 65' ' ' MET . 98.0 mt -63.71 -41.93 98.02 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.139 0.495 . . . . 0.0 110.424 176.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -64.04 -30.65 71.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.7 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -79.62 -25.96 41.3 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.71 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -69.05 -42.95 75.62 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 178.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm 74.26 -174.36 0.14 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.928 1.291 . . . . 0.0 111.81 176.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.97 59.05 4.28 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 116.233 -0.44 . . . . 0.0 114.107 -176.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -82.87 -13.38 56.24 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.794 0.807 . . . . 0.0 109.382 174.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.518 HG11 ' CD2' ' A' ' 62' ' ' PHE . 24.7 m -90.75 164.18 2.17 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.97 -178.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.465 ' O ' HG23 ' A' ' 24' ' ' VAL . 18.3 t-20 -87.86 115.87 25.62 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.466 ' CE2' ' HD2' ' A' ' 91' ' ' LYS . 60.4 t80 -51.76 -38.44 55.47 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.462 0.476 . . . . 0.0 111.665 -178.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -72.88 -36.06 67.26 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.406 -172.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.618 ' O ' HG12 ' A' ' 27' ' ' ILE . 25.8 tp -76.64 -39.1 53.4 Favored 'General case' 0 N--CA 1.415 -2.196 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.987 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.469 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 72.8 t -57.84 -46.65 87.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 174.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 54.6 ttp -58.13 -40.0 80.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.055 178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 -68.91 -41.06 78.73 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.229 175.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.618 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.3 mm -57.02 -51.93 62.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 177.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 83.7 mt -62.39 -38.09 88.28 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 114.515 -1.221 . . . . 0.0 110.541 -179.099 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -69.09 -46.16 68.45 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.136 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -61.86 -43.29 99.15 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.159 -176.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.416 ' CD1' HD13 ' A' ' 70' ' ' LEU . 39.4 pt -71.5 -38.73 69.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.599 177.103 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.479 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 37.3 tt0 -59.03 -52.97 63.45 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 123.082 0.553 . . . . 0.0 111.363 -179.175 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.426 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.6 pp -58.36 -37.35 75.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 120.823 0.344 . . . . 0.0 111.527 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.426 ' N ' HD12 ' A' ' 33' ' ' LEU . 27.8 t70 -73.78 -45.96 48.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.208 0.528 . . . . 0.0 110.328 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 55.1 tp -66.44 -23.5 66.3 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.513 -177.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 77.3 mtp180 -69.21 -7.74 39.38 Favored 'General case' 0 C--N 1.308 -1.231 0 O-C-N 121.312 -0.867 . . . . 0.0 112.338 177.163 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -126.89 23.28 5.61 Favored Glycine 0 N--CA 1.442 -0.908 0 N-CA-C 111.597 -0.601 . . . . 0.0 111.597 174.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 t -158.81 175.1 14.01 Favored 'General case' 0 C--O 1.216 -0.673 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -175.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -121.91 -11.69 8.5 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 121.905 0.859 . . . . 0.0 108.925 173.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -81.37 67.22 7.23 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.283 -178.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.513 HD13 ' HA ' ' A' ' 71' ' ' GLN . 9.7 tt -61.5 -30.95 49.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.274 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.536 ' O ' HG13 ' A' ' 46' ' ' ILE . 20.5 ptmt -67.94 -33.66 75.1 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 119.464 -0.895 . . . . 0.0 110.372 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.6 m -72.9 -33.69 66.18 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.463 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 14.0 m -62.05 -44.95 95.58 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 173.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.495 ' HB ' ' O ' ' A' ' 42' ' ' LYS . 27.6 mm -52.94 -48.45 51.6 Favored 'Isoleucine or valine' 0 C--N 1.344 0.351 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.468 174.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 42' ' ' LYS . 72.0 mt -55.38 -49.73 70.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.726 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.463 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 13.1 m-85 -58.43 -45.16 89.03 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 122.256 1.027 . . . . 0.0 110.481 -178.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 44' ' ' SER . 57.8 t -73.12 -49.26 39.66 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.771 0 CA-C-N 114.248 -1.342 . . . . 0.0 111.308 -173.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -63.5 -35.91 82.02 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.522 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.7 p -73.59 -22.18 60.12 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.068 0.461 . . . . 0.0 111.718 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.6 t -90.45 -25.95 20.08 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.651 0.739 . . . . 0.0 110.134 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.5 ' O ' HG12 ' A' ' 56' ' ' ILE . 81.2 m-70 -118.7 36.61 4.35 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 121.911 -0.493 . . . . 0.0 109.894 -175.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.5 mt -48.7 -44.11 37.74 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -175.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -56.61 -45.35 81.49 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 123.27 0.356 . . . . 0.0 111.936 -175.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -67.36 -44.77 78.18 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.621 0.724 . . . . 0.0 109.625 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 52' ' ' HIS . 45.6 mm -59.59 -46.57 92.99 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.862 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.294 -176.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -72.61 -24.56 61.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.898 0.38 . . . . 0.0 111.095 -178.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -72.78 -46.52 52.9 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.553 0.692 . . . . 0.0 109.47 -177.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.497 ' HB2' ' CE2' ' A' ' 63' ' ' TYR . 4.6 m120 -117.37 46.33 1.73 Allowed 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 -177.105 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.66 -34.59 18.84 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.114 1.366 . . . . 0.0 114.56 -173.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -67.09 -48.28 68.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.394 0.616 . . . . 0.0 110.311 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.518 ' CD2' HG11 ' A' ' 19' ' ' VAL . 85.4 t80 -64.03 -51.3 64.85 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.811 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.509 ' HA ' HG12 ' A' ' 66' ' ' ILE . 82.1 m-85 -66.22 -26.15 67.25 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -175.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.42 -47.24 17.95 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 119.442 -0.903 . . . . 0.0 111.051 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.421 ' HB2' HD21 ' A' ' 12' ' ' LEU . 76.3 mtm -65.74 -36.09 82.58 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.073 -178.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.509 HG12 ' HA ' ' A' ' 63' ' ' TYR . 41.2 pt -67.19 -38.33 80.87 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.669 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.33 175.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -57.27 -42.02 80.83 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.918 0.39 . . . . 0.0 110.139 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -62.04 -56.47 18.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.013 176.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 99.2 mt -60.97 -40.87 86.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.686 0.795 . . . . 0.0 112.403 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.505 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 88.2 mt -55.1 -49.64 71.21 Favored 'General case' 0 C--O 1.212 -0.906 0 C-N-CA 123.208 0.603 . . . . 0.0 112.015 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.523 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 49.4 mt-30 -69.02 -50.25 50.45 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 122.101 0.953 . . . . 0.0 109.361 -178.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -55.88 -47.13 77.94 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.137 -1.847 . . . . 0.0 111.901 -176.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -88.87 -15.93 33.21 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.505 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.79 -32.95 73.88 Favored 'General case' 0 N--CA 1.439 -0.989 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.775 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -69.15 -28.21 66.23 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.427 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -90.81 -52.17 5.0 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.9 pt -119.2 -27.67 2.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.51 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 120.62 144.12 6.98 Favored Glycine 0 C--N 1.305 -1.161 0 C-N-CA 120.411 -0.899 . . . . 0.0 110.872 178.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.3 tp -61.56 -38.5 80.36 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 C-N-CA 122.44 0.296 . . . . 0.0 111.739 -174.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -55.84 -44.28 77.83 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 122.541 1.162 . . . . 0.0 109.706 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.52 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 51.0 m-80 -67.64 -44.34 78.18 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 113.557 -1.656 . . . . 0.0 110.982 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.9 t -67.69 -39.87 82.92 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.175 -177.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -55.76 -45.37 78.09 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.276 0.56 . . . . 0.0 110.779 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -41.75 95.5 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 89.1 mt -62.13 -42.14 98.95 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.423 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 82' ' ' VAL . 51.1 mm -63.96 -39.12 84.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.887 0.375 . . . . 0.0 110.094 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.88 -39.44 94.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.404 0.621 . . . . 0.0 110.109 176.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 27.3 m -66.89 -33.82 76.44 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.103 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 47.3 m -60.76 -42.88 98.34 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.905 0.882 . . . . 0.0 111.12 -178.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 23.7 pt -86.51 -15.04 10.18 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.088 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.466 ' HD2' ' CE2' ' A' ' 21' ' ' PHE . 9.3 mtpm? -89.66 76.34 7.31 Favored 'General case' 0 N--CA 1.437 -1.113 0 C-N-CA 120.026 -0.67 . . . . 0.0 112.286 179.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.56 87.88 5.72 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 104.978 -2.23 . . . . 0.0 104.978 169.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -138.64 161.44 37.11 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-N 115.039 -0.982 . . . . 0.0 108.755 -169.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 58.4 m-70 66.15 44.8 2.49 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 124.223 1.009 . . . . 0.0 109.865 -177.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -66.68 -31.77 72.65 Favored 'General case' 0 CA--C 1.501 -0.907 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 176.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -84.8 102.7 13.25 Favored 'General case' 0 N--CA 1.422 -1.87 0 N-CA-C 103.253 -2.869 . . . . 0.0 103.253 168.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -67.9 85.91 0.23 Allowed 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 122.131 0.967 . . . . 0.0 112.255 -173.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -127.2 117.9 23.23 Favored 'General case' 0 N--CA 1.409 -2.502 0 CA-C-N 113.818 -1.537 . . . . 0.0 107.408 177.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 6.9 p80 . . . . . 0 C--N 1.285 -2.216 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 178.767 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.437 ' HB3' ' HG ' ' A' ' 4' ' ' LEU . 25.1 mmt . . . . . 0 CA--C 1.521 -0.165 0 CA-C-O 120.932 0.396 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.2 m -97.41 -14.51 21.16 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.543 0.687 . . . . 0.0 110.051 177.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 18.7 tt -86.42 13.82 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.562 1.407 0 CA-C-O 122.159 0.98 . . . . 0.0 111.308 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.437 ' HG ' ' HB3' ' A' ' 1' ' ' MET . 95.4 mt -75.76 -4.06 38.4 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.232 -0.918 . . . . 0.0 110.472 178.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -74.95 -7.79 54.6 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.634 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -94.43 120.16 65.5 Favored Pre-proline 0 N--CA 1.439 -1.001 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.538 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 26.5 Cg_exo -63.12 -30.6 75.45 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 123.067 2.512 . . . . 0.0 113.23 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.39 -41.75 46.76 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -178.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -57.29 -46.21 83.38 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.684 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.0 p -64.42 -34.57 70.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.67 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 64.1 mttp -62.63 -44.66 95.72 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 175.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.7 mt -58.45 -42.11 86.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.804 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -59.67 -37.19 78.08 Favored 'General case' 0 N--CA 1.476 0.838 0 O-C-N 123.444 0.465 . . . . 0.0 111.21 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -79.68 -40.64 28.57 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.817 -179.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -73.86 -54.46 7.94 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.04 -0.982 . . . . 0.0 112.973 -174.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 88.0 tttt 66.77 124.52 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.577 1.151 . . . . 0.0 109.157 -171.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.81 -9.26 25.98 Favored Glycine 0 C--O 1.215 -1.052 0 N-CA-C 118.074 1.99 . . . . 0.0 118.074 -168.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 16' ' ' LYS . 42.8 mtpt 65.62 7.36 4.39 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 118.193 0.996 . . . . 0.0 111.805 176.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 6.5 m -109.98 168.97 3.81 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 C-N-CA 124.337 1.055 . . . . 0.0 110.39 -178.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -67.85 133.53 49.33 Favored 'General case' 0 C--N 1.309 -1.194 0 O-C-N 124.109 0.881 . . . . 0.0 109.1 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -57.16 -39.76 75.9 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.417 0.627 . . . . 0.0 110.63 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -72.09 -29.19 63.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.552 -175.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.52 HD21 ' CD ' ' A' ' 55' ' ' GLU . 61.0 tp -70.24 -45.26 66.84 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.676 178.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.86 -40.84 88.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.407 ' HA ' HD21 ' A' ' 87' ' ' LEU . 41.5 ttm -57.31 -41.54 80.09 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.23 174.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -66.85 -43.05 84.65 Favored 'General case' 0 C--O 1.208 -1.126 0 O-C-N 123.217 0.323 . . . . 0.0 110.92 177.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.463 HD11 ' OE2' ' A' ' 55' ' ' GLU . 47.3 mm -56.97 -50.04 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.319 0.58 . . . . 0.0 109.839 178.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.8 mt -63.56 -42.07 98.38 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.893 -1.048 . . . . 0.0 110.534 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -62.96 -46.23 88.73 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 123.719 0.808 . . . . 0.0 110.458 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -63.68 -47.79 79.82 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.77 -177.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.418 ' CD1' HD13 ' A' ' 70' ' ' LEU . 38.2 pt -66.67 -40.4 86.07 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.077 178.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.04 -46.45 89.5 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 123.585 0.754 . . . . 0.0 111.641 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.413 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.3 pp -60.07 -37.32 79.54 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -177.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.413 ' N ' HD12 ' A' ' 33' ' ' LEU . 20.1 t70 -76.06 -51.09 13.01 Favored 'General case' 0 CA--C 1.508 -0.646 0 O-C-N 123.412 0.445 . . . . 0.0 110.306 177.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.445 HD21 ' CD2' ' A' ' 74' ' ' TYR . 57.0 tp -57.84 -31.97 67.16 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.683 1.193 . . . . 0.0 113.322 -175.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -74.62 -12.53 60.47 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 121.185 0.516 . . . . 0.0 110.564 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -106.96 -33.61 3.2 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 110.807 -0.917 . . . . 0.0 110.807 176.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 p -95.07 -151.13 0.32 Allowed 'General case' 0 CA--C 1.558 1.278 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 178.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -142.66 -40.42 0.33 Allowed 'General case' 0 C--O 1.243 0.724 0 O-C-N 121.757 -0.59 . . . . 0.0 111.59 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -81.62 95.15 7.09 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 -178.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.528 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.7 tt -58.86 -30.91 43.85 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.786 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.764 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.501 ' O ' HG13 ' A' ' 46' ' ' ILE . 21.0 ptmt -63.44 -34.45 77.77 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.182 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.1 m -76.65 -33.09 58.32 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.498 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 13.2 m -63.52 -40.38 96.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 41' ' ' ILE . 36.1 mm -54.87 -48.37 74.33 Favored 'Isoleucine or valine' 0 C--N 1.346 0.446 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.199 174.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 42' ' ' LYS . 72.7 mt -53.89 -48.69 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.438 -178.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.498 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 18.5 m-85 -58.89 -53.01 63.27 Favored 'General case' 0 C--O 1.244 0.788 0 CA-C-O 121.225 0.536 . . . . 0.0 109.844 -177.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.4 t -62.44 -49.81 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.543 -176.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -65.55 -33.96 77.15 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 39.9 m -75.42 -21.93 57.81 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.918 0.389 . . . . 0.0 111.917 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.9 t -93.53 -8.81 40.31 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.973 0.892 . . . . 0.0 109.429 179.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.562 ' O ' HG12 ' A' ' 56' ' ' ILE . 35.6 m-70 -126.46 30.96 5.46 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.158 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 91.2 mt -48.85 -56.55 8.4 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -170.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.623 ' O ' ' HG3' ' A' ' 58' ' ' LYS . 17.3 t70 -62.27 -44.08 97.36 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.42 -175.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.535 ' HB3' ' O ' ' A' ' 52' ' ' HIS . 26.7 tt0 -53.81 -51.22 64.2 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 124.819 1.248 . . . . 0.0 110.111 175.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 52' ' ' HIS . 51.7 mm -58.57 -44.25 88.97 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.721 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.241 177.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 -65.12 -33.66 76.54 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 178.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.623 ' HG3' ' O ' ' A' ' 54' ' ' ASP . 66.4 mttm -56.85 -47.52 80.18 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.074 0.464 . . . . 0.0 109.778 178.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -127.67 65.42 1.34 Allowed 'General case' 0 C--N 1.317 -0.848 0 CA-C-O 121.982 0.896 . . . . 0.0 110.429 -178.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -66.09 -33.66 76.3 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 114.534 -1.212 . . . . 0.0 112.605 -176.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -65.03 -47.1 78.61 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.279 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -62.5 -52.14 64.65 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.294 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 56' ' ' ILE . 45.0 m-85 -66.82 -30.54 70.75 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -176.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -78.6 -40.12 35.43 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.975 178.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.6 mtm -63.63 -43.16 97.65 Favored 'General case' 0 CA--C 1.502 -0.886 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.654 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 36.8 pt -64.68 -38.54 82.93 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.246 0 C-N-CA 119.39 -0.924 . . . . 0.0 111.369 178.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.55 -34.0 68.7 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 121.205 0.526 . . . . 0.0 111.368 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -69.1 -54.49 14.7 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 66.2 mt -59.95 -44.1 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.269 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.578 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.2 mt -53.31 -51.76 61.33 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 123.451 0.701 . . . . 0.0 111.588 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.494 ' HG2' HG23 ' A' ' 41' ' ' ILE . 46.4 mt-30 -65.41 -43.48 90.43 Favored 'General case' 0 C--O 1.257 1.458 0 CA-C-O 121.377 0.608 . . . . 0.0 110.802 -178.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -60.26 -49.03 79.21 Favored 'General case' 0 N--CA 1.426 -1.647 0 C-N-CA 124.538 1.135 . . . . 0.0 111.767 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -91.61 -15.1 29.08 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.578 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.07 -32.24 73.58 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.829 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -72.83 -24.26 60.87 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.531 175.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -98.01 -51.79 3.92 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -172.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 25.3 pt -110.75 -29.52 2.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.254 0 C-N-CA 119.898 -0.721 . . . . 0.0 112.478 -176.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.512 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 123.19 147.53 7.37 Favored Glycine 0 C--N 1.306 -1.106 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.5 tp -63.81 -35.62 73.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.949 0.374 . . . . 0.0 111.637 -176.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.98 -44.52 94.44 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 122.282 1.039 . . . . 0.0 109.966 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.476 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 18.1 m120 -64.47 -45.71 86.2 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.772 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.4 t -66.72 -38.1 80.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.404 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 43.1 t-20 -52.92 -50.17 64.5 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.416 1.087 . . . . 0.0 109.38 177.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -44.24 81.47 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.208 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 94.7 mt -61.41 -44.39 97.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.14 -178.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.0 mm -62.96 -37.84 80.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 CA-C-O 120.853 0.359 . . . . 0.0 110.343 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.444 ' O ' ' HG2' ' A' ' 91' ' ' LYS . 81.8 mt -62.31 -44.95 95.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.525 0.679 . . . . 0.0 110.399 176.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.3 m -64.31 -33.34 75.6 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.073 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.7 m -58.77 -45.7 89.18 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.668 0.787 . . . . 0.0 111.581 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 33.9 pt -82.29 -9.36 11.75 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 CA-C-O 120.967 0.413 . . . . 0.0 111.869 -178.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 87' ' ' LEU . 32.0 mmmt -85.67 102.13 13.33 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 173.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -76.16 -41.48 49.68 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 46.13 99.92 0.01 OUTLIER 'General case' 0 C--O 1.239 0.502 0 C-N-CA 125.953 1.701 . . . . 0.0 115.141 173.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 37.6 m80 -74.11 164.05 27.1 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.525 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 86.2 t60 81.56 -13.96 0.84 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.621 1.168 . . . . 0.0 112.379 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -89.07 159.28 17.63 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 171.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 43.6 m-70 -79.27 99.86 7.27 Favored 'General case' 0 C--N 1.283 -2.312 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -87.92 -14.06 40.27 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 169.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 . . . . . 0 N--CA 1.43 -1.449 0 C-N-CA 127.206 2.202 . . . . 0.0 105.413 174.209 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.611 0 N-CA-C 111.388 0.144 . . . . 0.0 111.388 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m -89.51 167.42 12.99 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.1 tp -102.21 -25.01 3.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 C-N-CA 119.741 -0.783 . . . . 0.0 110.507 -178.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.5 mt -82.3 13.37 3.59 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.586 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -98.53 2.84 47.92 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 120.779 0.323 . . . . 0.0 110.818 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.545 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 10.2 t70 -111.1 131.92 21.95 Favored Pre-proline 0 C--N 1.315 -0.931 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.694 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.47 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 17.3 Cg_exo -64.34 -31.75 62.2 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.42 2.08 . . . . 0.0 113.094 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.83 -32.62 61.99 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.833 -175.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -69.59 -42.92 73.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.577 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.52 -34.19 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.322 179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.7 mttt -60.23 -45.39 93.38 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.394 175.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.7 mt -56.55 -40.84 75.81 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.566 0.541 . . . . 0.0 111.871 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -71.0 -29.77 65.82 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.492 -177.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -79.99 -35.33 37.62 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -61.52 -44.1 97.66 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 125.178 1.391 . . . . 0.0 110.224 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.4 mttm 77.16 154.27 0.15 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.242 1.417 . . . . 0.0 111.774 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -87.87 89.96 1.64 Allowed Glycine 0 N--CA 1.426 -2.024 0 C-N-CA 120.357 -0.925 . . . . 0.0 110.973 178.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.66 -1.52 56.2 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.933 0.397 . . . . 0.0 110.849 177.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 19.4 m -98.24 163.86 2.5 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 175.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -63.5 130.26 43.62 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 122.632 0.373 . . . . 0.0 110.961 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -56.62 -39.45 73.63 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 123.461 0.704 . . . . 0.0 110.451 177.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.439 ' N ' HD22 ' A' ' 22' ' ' ASN . 0.8 OUTLIER -71.47 -28.82 64.2 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.193 -176.05 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.544 ' O ' HG12 ' A' ' 27' ' ' ILE . 59.3 tp -71.48 -49.43 41.33 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.33 178.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.445 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 47.5 t -63.03 -42.3 96.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 63.6 ttp -57.19 -39.85 76.18 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.056 177.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -69.82 -41.64 74.72 Favored 'General case' 0 C--O 1.215 -0.729 0 O-C-N 123.292 0.37 . . . . 0.0 111.11 177.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.7 mm -56.87 -47.6 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 177.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 79.5 mt -66.58 -42.49 86.88 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.469 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.05 -43.28 96.01 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 123.27 0.628 . . . . 0.0 110.639 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -61.64 -44.22 97.38 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.833 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.2 pt -72.79 -35.06 48.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.855 177.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -60.7 -49.11 78.81 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 123.648 0.779 . . . . 0.0 110.719 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 pp -69.41 -28.89 66.55 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.972 -179.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -76.29 -49.55 16.7 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.015 0.436 . . . . 0.0 111.951 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 43.2 tp -75.03 -55.27 5.91 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.756 -176.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 70.37 -79.81 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 125.91 1.684 . . . . 0.0 111.545 -177.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -92.39 -66.42 1.11 Allowed Glycine 0 N--CA 1.433 -1.553 0 C-N-CA 119.984 -1.103 . . . . 0.0 112.635 -176.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.8 t 174.14 145.84 0.06 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.66 0.784 . . . . 0.0 109.571 -174.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.5 t70 179.64 -86.45 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.643 1.177 . . . . 0.0 108.7 177.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -138.55 92.65 2.65 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.551 HG23 ' HG2' ' A' ' 71' ' ' GLN . 13.3 tt -72.35 -27.87 27.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.291 -176.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.588 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.2 ptmt -60.74 -36.42 78.85 Favored 'General case' 0 C--O 1.211 -0.921 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.274 177.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.8 m -69.84 -37.81 76.28 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.483 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 34.7 m -64.83 -40.69 95.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 175.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 41' ' ' ILE . 38.6 mm -55.46 -49.1 75.69 Favored 'Isoleucine or valine' 0 C--N 1.345 0.373 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 174.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.588 HG13 ' O ' ' A' ' 42' ' ' LYS . 78.4 mt -53.5 -50.84 46.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.702 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.483 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 15.5 m-85 -57.82 -43.39 85.73 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.79 0.805 . . . . 0.0 111.078 -176.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.0 t -73.95 -46.88 44.88 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.877 -175.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -69.74 -27.43 64.95 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 122.775 0.43 . . . . 0.0 111.86 -178.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.5 p -79.48 -22.33 44.22 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.7 t -95.08 -36.54 11.48 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.781 0.8 . . . . 0.0 109.89 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.614 ' O ' HG12 ' A' ' 56' ' ' ILE . 78.9 m-70 -92.54 42.41 1.1 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.018 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 82.9 mt -48.82 -48.02 41.87 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 125.353 1.461 . . . . 0.0 114.403 -175.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -61.3 -45.62 93.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 120.874 0.368 . . . . 0.0 111.417 -174.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.487 ' CG ' HD21 ' A' ' 23' ' ' LEU . 1.7 mp0 -55.4 -53.12 60.2 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 123.879 0.871 . . . . 0.0 110.22 176.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 52' ' ' HIS . 34.3 mm -60.91 -47.04 95.19 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-N 113.727 -1.579 . . . . 0.0 111.289 -176.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -69.95 -28.22 65.39 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -72.59 -49.25 33.57 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.24 0.543 . . . . 0.0 111.168 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -118.93 60.34 0.81 Allowed 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 122.071 0.938 . . . . 0.0 109.742 -176.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -55.35 -37.63 67.74 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 113.466 -1.697 . . . . 0.0 112.487 -176.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.481 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER -78.44 -31.73 48.21 Favored 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -176.307 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -68.04 -51.15 50.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.479 ' HA ' HG12 ' A' ' 66' ' ' ILE . 84.9 m-85 -69.08 -31.25 69.86 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.064 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.44 -51.11 64.81 Favored 'General case' 0 C--O 1.245 0.834 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.104 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 72.8 mtm -65.43 -39.6 92.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.41 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 36.8 pt -66.93 -43.21 89.47 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 C-N-CA 118.367 -1.333 . . . . 0.0 111.024 177.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.14 -39.7 75.69 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.817 0.341 . . . . 0.0 110.756 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 14.0 tp10 -58.69 -56.2 25.23 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.607 176.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.5 mt -65.88 -39.62 85.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 123.985 0.914 . . . . 0.0 112.946 -176.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.608 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 96.6 mt -53.36 -46.98 69.8 Favored 'General case' 0 C--O 1.217 -0.614 0 C-N-CA 122.615 0.366 . . . . 0.0 111.445 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.551 ' HG2' HG23 ' A' ' 41' ' ' ILE . 44.4 mt-30 -72.53 -49.16 34.61 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 122.304 1.049 . . . . 0.0 109.784 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 68' ' ' GLU . 19.6 ttt180 -53.45 -42.03 66.74 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 127.194 2.197 . . . . 0.0 111.725 -176.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.545 ' OH ' ' HB2' ' A' ' 6' ' ' ASP . 55.6 m-85 -100.48 -14.36 18.3 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -178.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.608 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.71 -28.4 68.4 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.636 -0.826 . . . . 0.0 109.781 178.64 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -74.96 -19.45 60.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.511 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -97.79 -50.31 4.49 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -174.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.8 pt -118.73 -29.81 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.541 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 125.61 146.69 6.78 Favored Glycine 0 CA--C 1.5 -0.852 0 C-N-CA 120.299 -0.953 . . . . 0.0 110.893 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.3 tp -64.61 -38.72 83.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.972 0.386 . . . . 0.0 111.798 -175.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -59.22 -38.96 81.21 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.943 0.878 . . . . 0.0 110.133 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.448 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 1.8 m-20 -69.35 -48.57 60.97 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.354 -1.294 . . . . 0.0 109.774 -179.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.9 t -62.9 -43.09 98.71 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.294 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.581 -177.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.432 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 95.5 m-20 -56.46 -44.9 80.97 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.094 0.474 . . . . 0.0 110.778 178.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -40.36 90.48 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.2 mt -65.26 -40.26 93.73 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.336 179.055 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.5 mm -62.81 -43.64 98.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 177.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.554 ' O ' ' HG2' ' A' ' 91' ' ' LYS . 87.7 mt -59.69 -44.52 93.61 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.62 176.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.4 m -62.08 -34.22 75.87 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 121.233 0.539 . . . . 0.0 110.877 178.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 76.7 m -70.82 -31.91 68.79 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 123.177 0.591 . . . . 0.0 111.905 -179.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.5 pt -92.97 -2.41 10.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.383 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 87' ' ' LEU . 29.8 mmmt -73.06 68.15 0.93 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.92 0.867 . . . . 0.0 113.044 176.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -129.41 126.52 38.99 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 104.82 -2.289 . . . . 0.0 104.82 172.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.431 ' C ' ' H ' ' A' ' 95' ' ' HIS . 34.0 tt0 -65.5 145.36 56.2 Favored 'General case' 0 C--N 1.297 -1.681 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.031 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 97' ' ' HIS . 44.5 m170 -78.97 35.64 0.26 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.321 0.581 . . . . 0.0 110.404 178.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.431 ' H ' ' C ' ' A' ' 93' ' ' GLU . 3.7 t60 -68.76 109.86 4.05 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 105.912 -1.885 . . . . 0.0 105.912 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 64.77 89.09 0.1 Allowed 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -166.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 94' ' ' HIS . 8.8 p80 -105.45 123.65 48.24 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -171.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 23.9 t60 -79.12 -15.45 58.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.937 0.875 . . . . 0.0 108.703 176.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 41.5 t-80 . . . . . 0 C--N 1.303 -1.446 0 N-CA-C 104.905 -2.257 . . . . 0.0 104.905 173.988 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 120.271 0.082 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.5 m -77.09 108.05 9.9 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.431 ' CG2' HD13 ' A' ' 85' ' ' LEU . 20.4 tt -142.79 -12.6 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.161 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.785 -177.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.24 -9.53 24.53 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.193 0.521 . . . . 0.0 111.491 178.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -66.86 -25.8 66.59 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 123.938 0.895 . . . . 0.0 109.818 177.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 13.8 t70 -75.76 128.17 84.15 Favored Pre-proline 0 C--O 1.25 1.129 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.601 -175.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.537 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 38.8 Cg_exo -62.38 -34.69 76.17 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.76 2.307 . . . . 0.0 113.206 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -76.21 -34.5 59.26 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.666 0.746 . . . . 0.0 109.598 -178.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -64.47 -41.36 96.55 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.63 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.27 -33.77 65.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 C-N-CA 120.595 -0.442 . . . . 0.0 109.962 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 7' ' ' PRO . 96.3 mttt -61.05 -43.27 99.14 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 174.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.0 mt -56.64 -42.58 79.14 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.014 0.525 . . . . 0.0 111.245 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.1 mmt180 -59.47 -39.37 83.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.155 178.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -80.19 -30.99 38.82 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.262 -179.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -79.9 -46.46 16.76 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 123.837 0.855 . . . . 0.0 112.38 -175.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt 68.84 134.55 0.03 OUTLIER 'General case' 0 C--O 1.248 1.005 0 C-N-CA 124.397 1.079 . . . . 0.0 111.502 -177.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.489 ' H ' HG22 ' A' ' 90' ' ' ILE . . . -94.2 114.87 4.88 Favored Glycine 0 N--CA 1.414 -2.812 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 177.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.414 ' N ' ' HD3' ' A' ' 18' ' ' LYS . 3.6 mppt? -91.02 30.5 1.21 Allowed 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 122.547 1.165 . . . . 0.0 109.201 178.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.424 HG11 ' CE2' ' A' ' 63' ' ' TYR . 16.5 m -98.75 158.4 3.52 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.23 0 CA-C-N 113.946 -1.479 . . . . 0.0 109.543 -178.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.422 ' O ' HG23 ' A' ' 24' ' ' VAL . 49.7 t-20 -66.71 125.27 25.3 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -54.1 -37.42 64.27 Favored 'General case' 0 C--N 1.321 -0.658 0 O-C-N 123.955 0.785 . . . . 0.0 111.091 178.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -68.11 -36.62 80.04 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.137 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.64 ' O ' HG12 ' A' ' 27' ' ' ILE . 26.3 tp -76.45 -39.13 54.2 Favored 'General case' 0 N--CA 1.416 -2.148 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.186 -177.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 20' ' ' ASN . 61.8 t -58.17 -48.07 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 176.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 48.4 ttp -58.29 -40.47 82.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.331 177.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -70.65 -36.2 73.28 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.396 178.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.64 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -58.93 -51.74 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 176.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 78.1 mt -60.66 -38.14 83.89 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.613 -179.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -71.15 -47.14 59.53 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.925 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.419 ' OE2' HG22 ' A' ' 48' ' ' VAL . 15.4 tt0 -63.46 -42.9 98.63 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.375 -176.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.4 HG21 HD13 ' A' ' 45' ' ' ILE . 32.5 pt -68.67 -37.63 77.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.696 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.931 177.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.37 -52.5 65.38 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 123.203 0.601 . . . . 0.0 111.48 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.98 -29.26 69.62 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.208 -177.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -76.21 -46.91 26.05 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.004 0.43 . . . . 0.0 110.476 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 20.7 tp -60.99 -60.51 3.68 Favored 'General case' 0 C--O 1.253 1.243 0 C-N-CA 124.223 1.009 . . . . 0.0 112.451 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 66.22 -51.02 0.42 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.741 1.217 . . . . 0.0 112.171 -173.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 147.78 -26.75 1.47 Allowed Glycine 0 C--N 1.296 -1.656 0 N-CA-C 108.336 -1.906 . . . . 0.0 108.336 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.3 p -75.15 -43.33 53.03 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 114.243 -0.979 . . . . 0.0 112.624 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -91.61 -162.66 0.94 Allowed 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -176.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.484 ' HB3' ' OG1' ' A' ' 43' ' ' THR . 28.4 t-20 -107.9 127.54 53.83 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-N 118.807 0.73 . . . . 0.0 109.227 -175.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.52 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.4 tt -63.0 -35.59 72.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 O-C-N 123.481 0.488 . . . . 0.0 111.73 -178.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.476 ' O ' HG13 ' A' ' 46' ' ' ILE . 65.2 pttt -69.28 -28.41 66.27 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.836 -178.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.484 ' OG1' ' HB3' ' A' ' 40' ' ' ASN . 26.0 m -71.33 -43.8 66.33 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.353 -0.84 . . . . 0.0 108.966 177.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.4 m -59.52 -40.61 87.68 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.092 176.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 41' ' ' ILE . 26.7 mm -51.66 -45.66 37.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.948 0.899 . . . . 0.0 110.108 175.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 42' ' ' LYS . 70.2 mt -56.85 -51.8 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.441 -177.244 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -60.57 -43.86 96.83 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.432 0.634 . . . . 0.0 110.871 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.419 HG22 ' OE2' ' A' ' 30' ' ' GLU . 46.6 t -69.15 -45.96 78.79 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.023 -174.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -68.05 -37.94 81.9 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.259 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 75.7 p -70.51 -21.46 62.74 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.119 0.485 . . . . 0.0 112.033 -178.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.3 t -92.86 -48.14 6.69 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.972 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.477 ' O ' HG12 ' A' ' 56' ' ' ILE . 86.2 m-70 -96.15 41.07 1.11 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 -174.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 85.6 mt -47.66 -41.32 22.04 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.679 1.592 . . . . 0.0 114.386 -175.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -53.56 -52.93 58.16 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.556 0.535 . . . . 0.0 112.431 -172.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -73.56 -34.06 64.97 Favored 'General case' 0 C--O 1.249 1.063 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.263 -176.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.521 ' HA ' ' CD2' ' A' ' 63' ' ' TYR . 40.1 mm -59.4 -43.45 90.37 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.66 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 53' ' ' LEU . 50.1 mtp180 -70.84 -28.09 64.34 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -60.71 -55.83 28.57 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-O 121.676 0.75 . . . . 0.0 110.447 174.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.3 m-80 -116.14 60.88 0.72 Allowed 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.514 -174.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -56.94 -36.65 70.49 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.544 -178.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -65.22 -39.47 92.81 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.682 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -64.6 -51.49 62.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.8 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.521 ' CD2' ' HA ' ' A' ' 56' ' ' ILE . 68.7 m-85 -68.72 -34.13 75.11 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -177.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -70.21 -45.49 66.48 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.858 0.361 . . . . 0.0 110.103 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 78.1 mtm -67.56 -41.74 83.74 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.244 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.513 HG12 ' HA ' ' A' ' 63' ' ' TYR . 43.7 pt -65.02 -35.96 76.69 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.013 0 C-N-CA 118.695 -1.202 . . . . 0.0 111.131 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.54 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -55.67 -44.56 77.38 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 123.409 0.443 . . . . 0.0 111.734 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -74.06 -37.96 64.09 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.375 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 90.3 mt -65.4 -42.42 93.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.543 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.609 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 89.6 mt -54.59 -46.13 73.73 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.728 178.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 64.2 mt-30 -62.34 -52.22 64.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.629 0.728 . . . . 0.0 109.828 179.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -58.9 -52.75 64.38 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.364 1.465 . . . . 0.0 112.403 -174.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -83.99 -22.54 31.34 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -175.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.609 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.98 -30.79 71.0 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 118.993 -1.083 . . . . 0.0 109.709 176.814 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -73.89 -19.84 60.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.943 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -99.66 -51.28 3.79 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.0 pt -113.95 -29.66 2.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.053 0.454 . . . . 0.0 111.803 -174.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.497 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 122.71 146.97 7.32 Favored Glycine 0 CA--C 1.491 -1.419 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 178.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tp -63.09 -35.91 73.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.938 0.369 . . . . 0.0 111.063 -175.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -55.36 -46.8 76.43 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-O 121.255 0.55 . . . . 0.0 110.729 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.466 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.0 t-20 -63.71 -49.49 72.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.237 -177.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 78' ' ' GLY . 20.6 t -62.59 -45.87 97.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.712 -175.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -53.83 -43.65 69.62 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.284 0.564 . . . . 0.0 111.26 -179.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.45 -44.46 78.59 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 84.6 mt -62.46 -38.07 88.39 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.637 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.475 HG12 ' O ' ' A' ' 82' ' ' VAL . 48.4 mm -61.79 -41.94 92.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.09 -41.44 99.41 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.175 178.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 91.9 m -61.13 -34.29 74.74 Favored 'General case' 0 CA--C 1.555 1.161 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.985 176.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.441 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 36.5 m -63.4 -39.46 94.56 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 123.205 0.602 . . . . 0.0 111.453 -176.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.489 HG22 ' H ' ' A' ' 17' ' ' GLY . 27.1 pt -91.35 -8.6 10.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-O 121.259 0.552 . . . . 0.0 111.748 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -98.44 27.74 4.57 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.723 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 89' ' ' THR . 0.7 OUTLIER -74.84 67.5 1.64 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 122.838 1.304 . . . . 0.0 111.142 172.608 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -85.03 123.23 30.33 Favored 'General case' 0 C--N 1.292 -1.892 0 CA-C-N 114.051 -1.431 . . . . 0.0 110.684 -175.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -58.49 120.29 8.55 Favored 'General case' 0 CA--C 1.517 -0.316 0 O-C-N 124.146 0.904 . . . . 0.0 110.605 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -101.14 81.62 2.25 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.423 -175.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 51.2 m80 -155.66 144.76 20.73 Favored 'General case' 0 CA--C 1.487 -1.48 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 172.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -140.35 78.04 1.64 Allowed 'General case' 0 C--N 1.285 -2.222 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -169.78 128.26 0.93 Allowed 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 . . . . . 0 C--N 1.305 -1.35 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 174.966 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.3 mmm . . . . . 0 CA--C 1.498 -1.036 0 CA-C-O 121.39 0.614 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.4 m -122.82 117.71 26.28 Favored 'General case' 0 C--N 1.287 -2.152 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 175.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 3' ' ' ILE . 14.2 tt -83.64 33.36 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.355 0 CA-C-O 123.548 1.642 . . . . 0.0 111.11 -173.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 93.4 mt -88.13 13.34 11.48 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.356 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -69.61 -22.21 63.52 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.638 1.575 . . . . 0.0 109.406 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.462 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 18.2 t70 -113.61 131.04 23.21 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.088 -0.96 . . . . 0.0 113.03 -174.332 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.493 ' HA ' HG12 ' A' ' 10' ' ' VAL . 31.8 Cg_exo -61.97 -29.92 82.64 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.72 2.947 . . . . 0.0 113.95 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.98 -45.63 63.72 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -177.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -61.1 -44.83 96.76 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.313 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' A' ' 7' ' ' PRO . 9.2 p -62.62 -34.32 64.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 120.936 0.398 . . . . 0.0 110.65 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HE3' ' SD ' ' A' ' 65' ' ' MET . 55.8 mtmt -65.66 -43.26 89.9 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 122.221 -0.299 . . . . 0.0 110.697 173.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 94.9 mt -57.73 -38.63 75.63 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.117 0.484 . . . . 0.0 110.893 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -59.46 -40.52 87.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.426 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -80.2 -31.38 38.74 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.192 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.411 ' CE2' ' HB2' ' A' ' 62' ' ' PHE . 61.8 t80 -64.53 -26.82 68.59 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 125.145 1.378 . . . . 0.0 111.167 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 73.36 -47.92 0.67 Allowed 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.172 1.389 . . . . 0.0 112.209 177.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 132.71 -71.95 0.49 Allowed Glycine 0 N--CA 1.425 -2.054 0 C-N-CA 121.352 -0.451 . . . . 0.0 112.118 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.614 ' HB2' ' NZ ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER 60.11 32.28 20.9 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.533 1.133 . . . . 0.0 109.389 -173.085 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.407 HG21 HG21 ' A' ' 24' ' ' VAL . 29.3 m -120.55 168.55 12.82 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 CA-C-N 114.431 -1.259 . . . . 0.0 108.608 -178.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -86.06 128.4 34.86 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -57.08 -39.93 75.93 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 123.041 0.536 . . . . 0.0 111.998 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -72.56 -34.61 67.62 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -174.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.635 ' O ' HG12 ' A' ' 27' ' ' ILE . 38.5 tp -71.75 -41.92 67.86 Favored 'General case' 0 N--CA 1.425 -1.696 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.233 -177.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.447 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 91.0 t -66.18 -41.62 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 120.829 0.347 . . . . 0.0 110.098 178.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 50.7 ttp -61.23 -37.08 81.79 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.891 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -69.48 -40.62 76.95 Favored 'General case' 0 C--O 1.205 -1.239 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.545 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.635 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.6 mm -56.66 -47.17 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 24' ' ' VAL . 94.1 mt -62.22 -44.79 95.77 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.996 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.92 -46.92 73.33 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.304 0.573 . . . . 0.0 110.503 -178.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -62.04 -40.84 97.09 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.102 -175.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.435 ' CD1' HD13 ' A' ' 70' ' ' LEU . 45.2 pt -72.98 -40.71 59.61 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.676 0 C-N-CA 120.381 -0.527 . . . . 0.0 110.045 176.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.14 -49.7 76.17 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 122.98 0.512 . . . . 0.0 111.423 -178.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.47 -31.85 72.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.989 0.423 . . . . 0.0 111.154 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -75.35 -44.47 45.0 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 57.0 tp -50.21 -34.43 22.8 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.636 1.174 . . . . 0.0 112.807 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -69.63 -11.18 60.64 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -135.02 -8.02 1.92 Allowed Glycine 0 C--O 1.243 0.682 0 C-N-CA 120.169 -1.015 . . . . 0.0 113.201 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.6 t -87.55 -174.03 4.61 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 123.643 0.777 . . . . 0.0 109.141 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -94.05 -34.39 13.02 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -151.39 155.57 38.91 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -176.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.536 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.5 tt -67.98 -30.46 48.26 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 O-C-N 123.633 0.583 . . . . 0.0 110.628 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.459 ' O ' HG13 ' A' ' 46' ' ' ILE . 64.8 pttt -66.49 -34.61 78.31 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 120.286 -0.565 . . . . 0.0 109.668 178.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 11.2 m -64.25 -44.87 90.43 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 176.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.6 m -57.53 -41.66 81.33 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.643 176.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 41' ' ' ILE . 40.0 mm -55.64 -44.78 78.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 123.476 0.71 . . . . 0.0 110.104 177.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 42' ' ' LYS . 68.3 mt -52.27 -51.05 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.372 0.669 . . . . 0.0 111.875 -178.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -63.72 -52.74 59.17 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.438 0.637 . . . . 0.0 110.716 -176.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.8 t -62.53 -43.4 98.35 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.039 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.414 ' CE2' ' HB3' ' A' ' 63' ' ' TYR . 2.1 m-85 -72.19 -31.51 65.96 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.286 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.425 ' O ' ' HG ' ' A' ' 53' ' ' LEU . 29.2 t -73.78 -31.27 63.21 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.384 0.612 . . . . 0.0 109.377 177.182 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.6 t -73.51 -53.39 10.7 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.424 178.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.521 ' O ' HG12 ' A' ' 56' ' ' ILE . 78.8 m-70 -100.68 42.62 1.1 Allowed 'General case' 0 C--N 1.304 -1.394 0 O-C-N 122.034 -0.416 . . . . 0.0 110.642 -172.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 50' ' ' SER . 82.1 mt -48.61 -38.75 21.72 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.529 1.132 . . . . 0.0 113.022 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -53.24 -50.81 64.01 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.402 ' HG3' ' CE2' ' A' ' 63' ' ' TYR . 14.3 tp10 -75.2 -34.04 61.46 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.209 177.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 52' ' ' HIS . 42.5 mm -60.34 -42.46 90.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-O 120.969 0.414 . . . . 0.0 110.39 -178.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.475 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 34.2 ptt180 -71.63 -33.65 69.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.07 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.3 tttm -66.56 -50.41 63.21 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 123.208 0.603 . . . . 0.0 109.615 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -114.71 60.38 0.68 Allowed 'General case' 0 CA--C 1.48 -1.725 0 CA-C-O 122.168 0.985 . . . . 0.0 111.279 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.475 ' HE3' ' O ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -55.59 -37.63 68.33 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 113.627 -1.624 . . . . 0.0 112.267 -177.088 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -70.93 -41.26 71.4 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 120.698 0.285 . . . . 0.0 110.78 -178.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.436 ' O ' HG12 ' A' ' 66' ' ' ILE . 83.3 t80 -62.91 -51.48 66.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.125 -178.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.533 ' HA ' HG12 ' A' ' 66' ' ' ILE . 93.4 m-85 -73.47 -24.69 60.23 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -177.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -72.93 -50.09 25.6 Favored 'General case' 0 C--O 1.265 1.902 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.475 ' SD ' ' HE3' ' A' ' 11' ' ' LYS . 79.2 mtm -65.37 -47.93 74.69 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.421 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.533 HG12 ' HA ' ' A' ' 63' ' ' TYR . 48.5 pt -63.95 -34.5 68.81 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.525 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.69 -178.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.536 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -56.01 -45.47 79.08 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 123.125 0.266 . . . . 0.0 111.614 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.71 -34.3 58.16 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 118.67 -1.212 . . . . 0.0 111.789 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 65' ' ' MET . 85.0 mt -60.59 -45.08 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.619 ' O ' ' HB3' ' A' ' 74' ' ' TYR . 87.3 mt -55.65 -45.64 77.61 Favored 'General case' 0 C--O 1.21 -1.021 0 C-N-CA 123.535 0.734 . . . . 0.0 110.89 179.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.536 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 67.7 mt-30 -68.86 -49.34 59.14 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 121.31 0.576 . . . . 0.0 110.566 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -61.86 -49.17 77.32 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 124.161 0.984 . . . . 0.0 111.817 -177.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.469 ' CE2' ' HD3' ' A' ' 76' ' ' LYS . 63.6 m-85 -82.38 -16.9 47.45 Favored 'General case' 0 N--CA 1.427 -1.581 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 -177.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.619 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.46 -29.79 69.33 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 172.651 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -79.63 -44.11 21.57 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.904 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.469 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 65.7 tttm -72.85 -44.82 60.91 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.76 -25.92 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.589 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 122.05 141.36 6.02 Favored Glycine 0 C--N 1.311 -0.824 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 178.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 10.3 tp -61.06 -37.66 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 117.202 0.501 . . . . 0.0 112.061 -173.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -60.41 -43.73 96.41 Favored 'General case' 0 C--O 1.244 0.796 0 CA-C-O 122.136 0.969 . . . . 0.0 109.667 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.422 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 94.0 m-20 -67.66 -40.39 84.49 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.729 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 78' ' ' GLY . 17.5 t -66.52 -41.42 88.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.428 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.9 OUTLIER -52.43 -49.58 64.27 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 121.218 0.532 . . . . 0.0 110.199 177.559 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -44.9 92.09 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.401 -177.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 93.7 mt -66.18 -35.96 81.83 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.8 mm -65.53 -41.64 91.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 175.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 94.8 mt -63.34 -40.1 96.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.98 176.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 94.3 m -59.07 -33.61 71.0 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 123.859 0.864 . . . . 0.0 110.914 176.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.4 m -69.14 -48.29 62.77 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.94 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.2 pt -76.1 -24.21 16.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-O 121.037 0.446 . . . . 0.0 112.061 -178.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.646 ' HA ' ' HE2' ' A' ' 91' ' ' LYS . 9.3 mmpt? -83.13 -6.94 59.67 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 175.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.486 ' CD1' ' H ' ' A' ' 93' ' ' GLU 0.451 1.0 OUTLIER 42.43 -101.96 0.04 OUTLIER 'General case' 0 C--O 1.247 0.944 0 N-CA-C 117.115 2.265 . . . . 0.0 117.115 178.465 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.486 ' H ' ' CD1' ' A' ' 92' ' ' LEU . 71.6 mm-40 -80.84 89.85 5.85 Favored 'General case' 0 N--CA 1.425 -1.716 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -176.078 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -169.53 25.87 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 177.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 22.9 t-80 -132.77 102.3 5.61 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.69 0.757 . . . . 0.0 111.874 -177.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -129.08 143.44 50.86 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 175.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -104.92 -40.96 5.75 Favored 'General case' 0 C--N 1.306 -1.296 0 C-N-CA 119.014 -1.074 . . . . 0.0 111.84 -174.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -152.1 107.52 3.31 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.155 0.502 . . . . 0.0 112.232 177.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 . . . . . 0 C--N 1.305 -1.367 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 175.034 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtm . . . . . 0 C--O 1.25 1.079 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.3 t 66.84 -84.94 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 124.713 1.205 . . . . 0.0 111.922 174.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.468 HG21 HD13 ' A' ' 85' ' ' LEU . 18.8 tt -138.43 -12.01 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-O 120.818 0.342 . . . . 0.0 111.862 -175.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.0 mt -74.05 -1.64 20.91 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.459 0.647 . . . . 0.0 111.563 -177.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -84.27 -11.16 56.92 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.765 -178.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.401 ' HB2' ' OH ' ' A' ' 73' ' ' TYR . 4.8 t70 -92.67 133.32 29.57 Favored Pre-proline 0 C--N 1.313 -1.016 0 C-N-CA 119.901 -0.72 . . . . 0.0 112.725 -170.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -65.57 -28.92 52.84 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.624 2.216 . . . . 0.0 112.522 175.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -74.84 -39.32 61.67 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 121.765 -0.584 . . . . 0.0 109.425 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -65.51 -44.04 88.22 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.143 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.07 -34.71 70.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 121.195 0.521 . . . . 0.0 110.14 179.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.4 mtmp? -67.83 -36.95 81.26 Favored 'General case' 0 C--O 1.198 -1.64 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.165 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.9 mt -59.29 -40.46 86.22 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 117.778 0.263 . . . . 0.0 111.337 176.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -61.37 -41.18 96.66 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.273 0.559 . . . . 0.0 111.644 177.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -79.71 -27.24 40.67 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.961 -178.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -82.31 -59.28 2.6 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.871 -176.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.1 mttt 68.26 155.31 0.11 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.835 0.854 . . . . 0.0 111.609 -174.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -114.18 144.84 18.4 Favored Glycine 0 N--CA 1.424 -2.148 0 C-N-CA 119.377 -1.392 . . . . 0.0 112.523 -175.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -94.53 32.15 1.64 Allowed 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 122.089 0.947 . . . . 0.0 108.561 176.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.465 HG21 HG21 ' A' ' 24' ' ' VAL . 19.7 m -88.49 164.5 2.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.049 0 CA-C-N 113.631 -1.622 . . . . 0.0 111.059 -176.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -85.76 119.72 26.4 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 171.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -54.62 -35.96 63.99 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 123.486 0.491 . . . . 0.0 111.552 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -70.22 -35.0 73.57 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-O 121.252 0.548 . . . . 0.0 109.964 -176.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.602 ' O ' HG12 ' A' ' 27' ' ' ILE . 27.1 tp -76.83 -42.32 40.75 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.16 -177.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.526 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 62.9 t -61.2 -43.6 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.8 ttp -60.52 -33.68 72.99 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.236 178.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -75.4 -38.86 59.64 Favored 'General case' 0 C--O 1.206 -1.212 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.613 176.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 23' ' ' LEU . 47.2 mm -56.99 -52.39 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 121.331 0.586 . . . . 0.0 110.161 -179.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.552 ' HB2' ' OD1' ' A' ' 83' ' ' ASN . 3.2 pp -71.4 -30.57 66.25 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.582 -178.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -68.38 -44.37 75.3 Favored 'General case' 0 C--N 1.299 -1.587 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.019 176.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.19 -38.19 90.16 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.75 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.6 pt -70.15 -41.43 78.97 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.188 176.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.451 ' OE1' ' HG2' ' A' ' 80' ' ' GLU . 37.2 tt0 -59.13 -54.45 46.82 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.013 0.925 . . . . 0.0 111.383 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -63.63 -34.52 78.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -178.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.48 ' N ' HD12 ' A' ' 33' ' ' LEU . 18.4 t0 -76.28 -40.73 50.94 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.139 -178.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.9 tp -61.04 -23.6 65.56 Favored 'General case' 0 C--O 1.249 1.059 0 C-N-CA 124.776 1.231 . . . . 0.0 111.792 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -53.11 -24.87 11.33 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.996 0.518 . . . . 0.0 111.338 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.49 -87.16 0.1 Allowed Glycine 0 N--CA 1.434 -1.482 0 O-C-N 123.533 0.521 . . . . 0.0 112.599 179.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 51.8 m -162.17 -5.23 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -175.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -79.24 -163.22 0.47 Allowed 'General case' 0 C--O 1.251 1.144 0 CA-C-N 119.432 1.015 . . . . 0.0 112.616 -174.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.514 ' ND2' ' HE2' ' A' ' 42' ' ' LYS . 29.4 t-20 -113.68 144.48 42.87 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -173.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.568 ' O ' HG12 ' A' ' 45' ' ' ILE . 9.5 tt -57.78 -36.7 56.18 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.514 ' HE2' ' ND2' ' A' ' 40' ' ' ASN . 58.6 pttt -61.75 -33.7 74.52 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.19 0.519 . . . . 0.0 110.445 175.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.4 m -74.55 -41.65 60.21 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.235 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.401 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 12.8 m -58.45 -40.77 83.5 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.835 175.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.568 HG12 ' O ' ' A' ' 41' ' ' ILE . 32.8 mm -54.34 -46.92 69.71 Favored 'Isoleucine or valine' 0 C--N 1.349 0.555 0 C-N-CA 123.815 0.846 . . . . 0.0 110.256 176.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 42' ' ' LYS . 71.8 mt -52.13 -51.43 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 123.481 0.712 . . . . 0.0 111.789 -178.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.401 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 25.1 m-85 -59.73 -53.26 60.09 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.676 0.75 . . . . 0.0 110.971 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.1 t -66.83 -41.91 88.42 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.665 -174.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -68.86 -38.98 80.1 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.314 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.4 t -69.96 -26.71 64.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.417 0.627 . . . . 0.0 110.292 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.8 t -82.31 -48.21 11.46 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-O 121.341 0.591 . . . . 0.0 110.696 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.487 ' O ' HG12 ' A' ' 56' ' ' ILE . 73.9 m-70 -101.19 40.9 1.23 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.73 -174.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 89.5 mt -47.04 -39.87 13.71 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.332 1.453 . . . . 0.0 113.893 -177.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -54.14 -50.79 66.12 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -175.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -73.07 -35.79 66.74 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 120.991 0.424 . . . . 0.0 109.861 -178.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 52' ' ' HIS . 43.6 mm -58.58 -51.16 75.08 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.165 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.915 -179.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -77.47 -16.09 58.95 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -74.99 -48.56 23.57 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -116.83 53.55 0.89 Allowed 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.073 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -57.23 -39.96 76.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.012 -0.995 . . . . 0.0 113.408 -174.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -62.03 -37.27 84.31 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.268 0.556 . . . . 0.0 110.957 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -69.01 -49.3 58.95 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.897 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.544 ' HA ' HG12 ' A' ' 66' ' ' ILE . 72.9 m-85 -68.31 -33.45 74.34 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.19 -48.12 82.99 Favored 'General case' 0 C--O 1.254 1.339 0 CA-C-O 121.209 0.528 . . . . 0.0 109.882 177.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.421 ' O ' ' HB3' ' A' ' 68' ' ' GLU . 79.2 mtm -68.9 -45.8 69.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.82 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.545 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 40.6 pt -69.23 -37.86 76.79 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.448 0 C-N-CA 119.014 -1.075 . . . . 0.0 112.968 -177.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.12 -38.39 76.41 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.427 0.632 . . . . 0.0 109.815 177.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 65' ' ' MET . 19.3 tp10 -63.51 -56.38 16.48 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.27 176.191 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.6 mt -59.47 -39.08 78.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 123.208 0.603 . . . . 0.0 112.498 -178.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.8 mt -53.98 -50.95 65.4 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 122.658 0.383 . . . . 0.0 111.771 178.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -70.84 -49.4 46.65 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 122.241 1.02 . . . . 0.0 109.385 -178.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.417 ' HD2' ' OE2' ' A' ' 68' ' ' GLU . 29.0 ttt180 -54.93 -38.95 68.34 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 127.655 2.382 . . . . 0.0 111.797 -177.047 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.401 ' OH ' ' HB2' ' A' ' 6' ' ' ASP 0.257 28.6 m-85 -99.83 -14.69 18.69 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -178.652 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.436 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.26 -26.58 66.64 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 174.374 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -78.13 -17.87 56.36 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.653 176.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.418 ' HE2' ' HB3' ' A' ' 76' ' ' LYS . 52.8 mtpt -99.93 -51.57 3.67 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.389 0.614 . . . . 0.0 112.307 179.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.4 pt -117.37 -27.23 2.45 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.072 -173.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 116.83 148.66 8.95 Favored Glycine 0 N--CA 1.434 -1.46 0 C-N-CA 120.297 -0.954 . . . . 0.0 111.076 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.41 HD13 ' CD1' ' A' ' 41' ' ' ILE . 5.5 tp -59.71 -42.41 88.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -175.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.451 ' HG2' ' OE1' ' A' ' 32' ' ' GLU . 41.6 mt-10 -64.59 -35.85 82.34 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 121.151 0.5 . . . . 0.0 111.56 -176.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -64.51 -47.3 79.4 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.552 174.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 78' ' ' GLY . 21.7 t -63.83 -42.32 95.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.08 -178.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.552 ' OD1' ' HB2' ' A' ' 28' ' ' LEU . 95.3 m-20 -51.92 -47.93 64.44 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.513 0.725 . . . . 0.0 111.307 177.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -45.02 76.92 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.295 -0.866 . . . . 0.0 108.868 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.468 HD13 HG21 ' A' ' 3' ' ' ILE . 95.7 mt -61.98 -39.59 92.72 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.9 mm -63.56 -40.2 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 120.915 0.388 . . . . 0.0 109.958 177.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 92.6 mt -64.35 -37.09 86.28 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.801 0.81 . . . . 0.0 109.467 177.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.449 HG23 HD23 ' A' ' 92' ' ' LEU . 86.4 m -66.05 -34.31 77.78 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.59 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 m -64.48 -40.9 96.55 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-O 120.822 0.344 . . . . 0.0 110.508 -177.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.0 pt -92.75 -34.34 5.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -177.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -126.42 38.99 4.02 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 118.978 -1.089 . . . . 0.0 112.488 -174.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.449 HD23 HG23 ' A' ' 88' ' ' THR . 37.2 tp -165.19 79.54 0.33 Allowed 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 170.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -116.95 131.7 56.89 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.02 -173.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -126.81 3.59 6.66 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.025 0.916 . . . . 0.0 108.912 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.2 m80 -145.06 104.36 3.96 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -177.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 22.4 p80 -121.32 102.3 8.19 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -176.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 71.95 -39.28 0.44 Allowed 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.432 1.893 . . . . 0.0 113.465 172.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 63.2 t60 72.43 -55.99 0.66 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.857 1.663 . . . . 0.0 111.308 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 . . . . . 0 C--N 1.284 -2.25 0 N-CA-C 106.223 -1.769 . . . . 0.0 106.223 179.751 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.5 mtt . . . . . 0 CA--C 1.511 -0.552 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.6 p -154.31 -85.55 0.06 Allowed 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 121.041 0.448 . . . . 0.0 111.284 -179.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.519 ' HA ' ' CE2' ' A' ' 73' ' ' TYR . 20.3 tt 179.34 -21.56 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 124.39 1.076 . . . . 0.0 108.525 -178.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -67.82 -6.98 24.07 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-O 121.805 0.812 . . . . 0.0 110.589 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -72.36 -30.96 65.19 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 125.037 1.335 . . . . 0.0 109.773 178.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -87.19 127.56 58.74 Favored Pre-proline 0 C--O 1.249 1.057 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.773 -173.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.492 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 39.4 Cg_exo -61.87 -28.03 80.86 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.165 2.576 . . . . 0.0 113.664 -179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 9.4 mm-40 -72.23 -32.21 66.53 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.586 -176.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -66.86 -44.11 81.83 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.349 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.8 p -67.44 -34.21 67.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-O 121.269 0.557 . . . . 0.0 109.859 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.506 ' O ' ' HD1' ' A' ' 15' ' ' PHE . 68.5 mttm -62.37 -42.65 99.58 Favored 'General case' 0 C--O 1.207 -1.17 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.731 174.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 92.9 mt -58.62 -34.97 71.76 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.586 0.231 . . . . 0.0 111.564 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.4 mmm180 -63.86 -32.02 73.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.117 0.484 . . . . 0.0 110.416 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -79.65 -36.97 36.98 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.356 177.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.506 ' HD1' ' O ' ' A' ' 11' ' ' LYS . 24.3 m-85 -62.49 -36.33 82.17 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 173.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt 74.0 -34.51 0.28 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.876 1.671 . . . . 0.0 112.479 175.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.41 -80.46 0.3 Allowed Glycine 0 N--CA 1.423 -2.232 0 C-N-CA 120.438 -0.887 . . . . 0.0 113.598 175.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? 59.71 31.58 20.94 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.148 0.975 . . . . 0.0 108.842 -171.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 m -117.29 169.46 7.71 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 CA-C-N 113.685 -1.598 . . . . 0.0 108.991 -175.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.43 ' O ' HG23 ' A' ' 24' ' ' VAL . 48.7 t-20 -86.91 113.14 22.44 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 106.533 -1.654 . . . . 0.0 106.533 173.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -53.09 -36.88 61.18 Favored 'General case' 0 C--N 1.314 -0.958 0 O-C-N 123.657 0.598 . . . . 0.0 111.166 179.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -74.49 -35.17 63.23 Favored 'General case' 0 CA--C 1.487 -1.478 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.646 -172.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.622 ' O ' HG12 ' A' ' 27' ' ' ILE . 25.0 tp -76.64 -39.08 53.44 Favored 'General case' 0 N--CA 1.418 -2.051 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.162 -178.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 20' ' ' ASN . 61.2 t -62.44 -40.91 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.1 ttp -59.65 -43.18 94.0 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.722 176.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -67.2 -38.28 85.06 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.911 177.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.1 mm -56.75 -52.08 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 176.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.5 mt -62.02 -41.42 98.07 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.961 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -66.93 -47.29 72.14 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-O 121.436 0.636 . . . . 0.0 110.472 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -64.16 -40.79 96.88 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.907 -176.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 40.1 pt -70.09 -40.05 77.9 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.933 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.808 176.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.63 -50.21 74.68 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 124.076 0.95 . . . . 0.0 111.407 -178.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.424 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.3 pp -62.59 -34.09 76.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.184 -178.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 38' ' ' SER . 29.4 t70 -76.75 -50.26 14.01 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.728 176.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.0 tp -50.21 -38.85 42.17 Favored 'General case' 0 C--O 1.247 0.964 0 C-N-CA 125.258 1.423 . . . . 0.0 113.05 -176.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -48.61 -37.32 17.83 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 124.509 1.131 . . . . 0.0 111.377 -177.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -127.92 29.08 4.25 Favored Glycine 0 N--CA 1.439 -1.1 0 N-CA-C 111.54 -0.624 . . . . 0.0 111.54 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 34' ' ' ASP . 6.8 t -120.97 -29.9 4.5 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 -178.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.7 t70 69.8 -51.22 0.63 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 125.704 1.601 . . . . 0.0 113.397 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -84.51 93.5 8.35 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-O 121.523 0.678 . . . . 0.0 110.757 177.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.53 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.8 tt -60.16 -24.05 29.27 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.231 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.328 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.415 ' O ' HG13 ' A' ' 46' ' ' ILE . 40.4 mtmt -56.68 -46.96 80.85 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.524 0.729 . . . . 0.0 109.764 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.6 m -71.65 -36.62 70.75 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 114.667 -1.151 . . . . 0.0 109.754 -179.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.5 m -61.4 -39.68 91.59 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.917 176.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 41' ' ' ILE . 35.7 mm -56.9 -48.75 80.9 Favored 'Isoleucine or valine' 0 C--N 1.351 0.637 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 42' ' ' LYS . 68.1 mt -52.93 -48.72 51.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 115.333 -0.848 . . . . 0.0 112.473 -177.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -60.96 -53.36 58.16 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.769 0.795 . . . . 0.0 110.312 -176.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.04 -46.04 94.96 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.201 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.634 -174.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -66.49 -37.7 85.65 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.32 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.9 t -71.81 -26.93 62.6 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-O 120.983 0.421 . . . . 0.0 110.775 -179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.2 t -81.79 -44.73 16.58 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.376 0.608 . . . . 0.0 109.97 178.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.494 ' O ' HG12 ' A' ' 56' ' ' ILE . 82.7 m-70 -102.14 38.97 1.55 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.349 -175.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 77.8 mt -47.64 -36.79 11.5 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 -177.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.547 ' O ' ' HD3' ' A' ' 58' ' ' LYS . 26.1 t70 -54.43 -51.55 64.58 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -176.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -73.55 -29.72 62.61 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.65 -177.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 52' ' ' HIS . 37.8 mm -64.19 -45.74 95.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.054 179.336 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -74.3 -32.71 62.98 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.537 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' A' ' 54' ' ' ASP . 2.1 mptm? -63.8 -43.44 96.27 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 120.769 0.319 . . . . 0.0 110.87 177.145 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -123.92 60.99 1.1 Allowed 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.864 0.84 . . . . 0.0 111.076 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -64.06 -25.88 68.31 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.156 -176.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -69.41 -52.16 29.5 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -59.41 -50.66 73.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.778 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.531 ' HA ' HG12 ' A' ' 66' ' ' ILE . 74.2 m-85 -67.05 -32.29 73.38 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -67.74 -44.94 76.38 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.17 0.51 . . . . 0.0 110.297 177.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 88.2 mtp -67.55 -45.8 74.61 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.694 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.533 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 48.0 pt -66.64 -36.36 77.06 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.566 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.681 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.78 -40.7 80.43 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.112 0.415 . . . . 0.0 110.424 178.012 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -62.71 -51.38 67.39 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.268 177.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 82.0 mt -63.64 -41.29 92.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.956 -178.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 86.5 mt -58.51 -48.71 79.92 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.85 0.46 . . . . 0.0 111.554 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.47 ' HG2' HG23 ' A' ' 41' ' ' ILE . 46.6 mt-30 -64.43 -48.7 74.33 Favored 'General case' 0 C--O 1.251 1.17 0 CA-C-O 122.192 0.996 . . . . 0.0 109.815 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 -60.0 -45.7 91.88 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 113.833 -1.531 . . . . 0.0 110.905 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.519 ' CE2' ' HA ' ' A' ' 3' ' ' ILE 0.252 31.5 m-85 -91.81 -21.28 20.75 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -174.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -67.5 -31.19 71.15 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 118.37 -1.332 . . . . 0.0 108.543 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -74.26 -38.16 63.53 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.177 0.513 . . . . 0.0 110.141 176.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.5 ' HD3' ' CE2' ' A' ' 73' ' ' TYR . 87.1 tttt -75.66 -51.02 13.72 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.711 -175.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.5 pt -122.27 -30.7 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.542 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 127.58 143.8 5.8 Favored Glycine 0 C--N 1.315 -0.602 0 C-N-CA 120.347 -0.93 . . . . 0.0 111.997 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tp -60.87 -40.55 85.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -175.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -59.58 -39.6 84.66 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.678 0.752 . . . . 0.0 110.225 -178.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.498 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 3.3 m-20 -66.24 -50.26 64.38 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.291 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 78' ' ' GLY . 25.3 t -63.88 -38.34 82.1 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.885 -176.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 -52.94 -50.11 64.68 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.024 0.929 . . . . 0.0 109.715 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -39.47 80.6 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.009 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 91.7 mt -66.22 -38.4 87.86 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -178.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.7 mm -66.11 -39.44 84.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.06 -39.25 93.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.325 176.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 86.0 m -58.87 -34.03 71.15 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.426 0.69 . . . . 0.0 110.193 176.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 65.1 m -65.18 -45.94 82.83 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.825 -178.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.1 pt -84.99 -9.39 11.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.288 0.566 . . . . 0.0 112.095 -177.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -88.16 130.7 34.97 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 87.8 mt -69.15 -54.27 15.78 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 177.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 62.4 77.5 0.33 Allowed 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.858 -1.519 . . . . 0.0 112.201 178.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -124.59 126.52 45.92 Favored 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 173.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -79.36 150.02 31.52 Favored 'General case' 0 C--N 1.287 -2.148 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -176.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -81.07 91.82 6.15 Favored 'General case' 0 N--CA 1.432 -1.365 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 179.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 31.7 t-80 -60.41 124.45 20.37 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -178.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -144.1 139.45 28.89 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -175.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 . . . . . 0 C--N 1.3 -1.557 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 174.754 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.506 -0.749 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.9 m -79.64 105.51 10.99 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 121.176 0.513 . . . . 0.0 110.026 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 16.9 pt -64.04 88.4 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.453 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.26 12.98 27.08 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 116.011 -0.541 . . . . 0.0 112.177 -175.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -69.04 -39.46 79.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.708 0.765 . . . . 0.0 109.392 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.482 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 13.8 t70 -83.49 132.14 50.51 Favored Pre-proline 0 C--N 1.305 -1.333 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.324 -171.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 6' ' ' ASP . 9.1 Cg_exo -72.16 -28.73 15.31 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.042 2.494 . . . . 0.0 113.19 178.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -76.23 -31.33 58.31 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-O 122.038 0.923 . . . . 0.0 109.052 -177.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -59.4 -43.06 93.05 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.512 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 7' ' ' PRO . 7.5 p -68.05 -33.8 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 C-N-CA 120.171 -0.611 . . . . 0.0 110.19 178.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.27 -38.09 79.24 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.868 0.365 . . . . 0.0 110.08 174.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.67 -38.72 90.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.689 176.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -61.9 -38.57 88.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.576 177.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -75.61 -28.19 58.76 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.915 178.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -68.69 -45.18 72.33 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.521 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt 73.61 169.67 0.31 Allowed 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.471 1.108 . . . . 0.0 110.725 177.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.91 72.78 0.68 Allowed Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 114.058 0.383 . . . . 0.0 114.058 -179.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -85.25 -12.04 53.44 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.936 0.874 . . . . 0.0 109.581 174.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.447 HG21 HG21 ' A' ' 24' ' ' VAL . 27.2 m -92.93 163.42 2.24 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.296 -176.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.474 ' O ' HG23 ' A' ' 24' ' ' VAL . 48.9 m-80 -72.95 107.09 5.14 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -51.91 -48.29 64.25 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -68.56 -29.45 68.0 Favored 'General case' 0 CA--C 1.501 -0.905 0 CA-C-O 121.155 0.502 . . . . 0.0 110.341 -175.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.56 ' O ' HG12 ' A' ' 27' ' ' ILE . 32.7 tp -77.34 -41.83 38.97 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.934 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 20' ' ' ASN . 60.8 t -61.81 -43.96 98.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 58.4 ttp -56.37 -36.64 69.05 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.682 177.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -75.62 -38.44 58.98 Favored 'General case' 0 C--O 1.211 -0.942 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.221 177.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.56 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.8 mm -57.0 -50.62 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.459 ' HB3' ' CG ' ' A' ' 83' ' ' ASN . 86.3 mt -61.61 -42.92 99.57 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.325 -1.307 . . . . 0.0 110.273 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -62.05 -48.29 80.89 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.65 178.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -62.53 -39.89 95.02 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.516 -175.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.439 HG21 HD13 ' A' ' 45' ' ' ILE . 38.7 pt -73.54 -37.9 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.807 176.226 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.459 ' HG2' ' NH2' ' A' ' 36' ' ' ARG . 32.2 tt0 -59.54 -52.7 64.44 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.943 0.897 . . . . 0.0 110.844 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.414 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.4 pp -68.12 -28.6 67.47 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.414 ' N ' HD12 ' A' ' 33' ' ' LEU . 26.9 t70 -70.74 -44.02 67.65 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.011 0.434 . . . . 0.0 110.357 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.0 tt -70.24 -58.23 4.0 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 176.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.459 ' NH2' ' HG2' ' A' ' 32' ' ' GLU . 4.1 tpm_? 59.78 -71.75 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.58 1.952 . . . . 0.0 110.603 -177.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -161.37 -0.42 0.06 OUTLIER Glycine 0 N--CA 1.441 -0.974 0 C-N-CA 121.125 -0.56 . . . . 0.0 113.403 176.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.4 m -125.62 7.81 7.59 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 118.344 1.072 . . . . 0.0 113.384 -173.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -135.04 -166.19 1.79 Allowed 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 118.328 -1.349 . . . . 0.0 110.702 -176.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.445 ' HB3' ' OG1' ' A' ' 43' ' ' THR . 33.1 t-20 -110.66 138.69 46.73 Favored 'General case' 0 CA--C 1.498 -1.022 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 -174.239 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.514 ' O ' HG12 ' A' ' 45' ' ' ILE . 11.0 tt -65.56 -38.41 82.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.472 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.536 ' O ' HG13 ' A' ' 46' ' ' ILE . 22.5 ptmt -64.48 -32.64 74.36 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.356 -179.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.445 ' OG1' ' HB3' ' A' ' 40' ' ' ASN . 20.6 m -67.31 -45.77 75.51 Favored 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.7 m -61.24 -40.64 94.8 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.608 177.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.514 HG12 ' O ' ' A' ' 41' ' ' ILE . 30.1 mm -53.67 -44.3 57.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.904 0.881 . . . . 0.0 109.948 176.087 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 42' ' ' LYS . 77.2 mt -54.75 -52.46 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.87 -177.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.38 -46.07 90.3 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-O 121.35 0.595 . . . . 0.0 111.349 -176.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.54 -46.21 71.14 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.581 -172.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.404 ' HA ' HG13 ' A' ' 56' ' ' ILE . 4.2 m-30 -65.18 -38.81 91.71 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.232 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 82.9 p -73.81 -21.77 60.03 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.379 0.609 . . . . 0.0 111.692 -177.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.7 t -93.58 -20.33 20.32 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-O 121.1 0.476 . . . . 0.0 110.99 -178.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.522 ' O ' HG12 ' A' ' 56' ' ' ILE . 62.5 m-70 -123.8 39.27 4.0 Favored 'General case' 0 C--N 1.317 -0.805 0 O-C-N 121.804 -0.56 . . . . 0.0 109.738 -176.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 93.8 mt -49.32 -36.79 22.19 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -174.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -56.59 -51.51 68.34 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -176.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -73.14 -36.91 66.75 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 52' ' ' HIS . 42.4 mm -62.36 -49.3 84.48 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.648 -177.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -77.18 -26.58 53.07 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.254 0.55 . . . . 0.0 111.398 -175.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -71.41 -43.49 66.67 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.561 0.696 . . . . 0.0 109.681 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -116.32 46.54 1.57 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 114.909 -1.041 . . . . 0.0 108.479 -177.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -59.97 -32.64 71.01 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.561 -174.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -64.14 -43.36 95.44 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -66.07 -51.57 56.9 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.999 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.496 ' HA ' HG12 ' A' ' 66' ' ' ILE . 68.3 m-85 -67.82 -28.95 68.01 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -74.05 -44.47 54.11 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.467 177.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.8 mtm -65.07 -45.85 83.6 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.664 179.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 43.7 pt -63.38 -41.96 94.6 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.028 0 C-N-CA 119.519 -0.872 . . . . 0.0 111.912 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.524 ' O ' ' HG3' ' A' ' 71' ' ' GLN . . . -54.88 -36.69 65.39 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.193 0.52 . . . . 0.0 111.433 -178.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.51 -54.9 10.37 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.602 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 78.9 mt -60.57 -40.73 85.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.146 -178.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 97.1 mt -55.22 -46.89 75.95 Favored 'General case' 0 C--O 1.213 -0.854 0 C-N-CA 123.129 0.571 . . . . 0.0 111.436 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.524 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 63.2 mt-30 -69.33 -41.37 76.75 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.314 0.578 . . . . 0.0 110.15 -179.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -59.97 -47.04 87.44 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.214 1.006 . . . . 0.0 110.308 -178.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -87.14 -15.51 38.18 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.494 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -66.81 -29.65 69.64 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 176.369 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -78.76 -28.11 44.76 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.404 176.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -90.18 -51.31 5.51 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -174.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.3 pt -121.47 -19.07 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -176.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.592 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 109.0 140.6 9.08 Favored Glycine 0 C--N 1.305 -1.188 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 178.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.404 HD13 HD12 ' A' ' 41' ' ' ILE . 7.2 tp -57.26 -40.47 73.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -174.023 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -57.69 -41.77 82.33 Favored 'General case' 0 C--O 1.251 1.142 0 CA-C-O 122.252 1.025 . . . . 0.0 109.993 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.524 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 49.0 m-80 -70.51 -43.53 69.45 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 113.971 -1.468 . . . . 0.0 111.379 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 78' ' ' GLY . 12.6 t -63.51 -46.21 95.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 O-C-N 123.231 0.332 . . . . 0.0 110.293 -177.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.459 ' CG ' ' HB3' ' A' ' 28' ' ' LEU . 95.1 m-20 -52.31 -47.06 66.17 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.818 0.699 . . . . 0.0 110.83 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -60.84 -41.33 95.61 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.378 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 65.7 mt -74.34 -31.24 62.36 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.368 -177.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 82' ' ' VAL . 46.7 mm -63.2 -37.49 79.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 83' ' ' ASN . 84.9 mt -63.31 -39.52 94.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.549 176.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 17.3 m -66.39 -33.67 76.23 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.556 0.693 . . . . 0.0 110.056 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 78.6 m -64.72 -48.62 73.98 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.102 -178.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 36.6 pt -80.0 -45.26 22.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.44 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -107.76 69.7 0.75 Allowed 'General case' 0 N--CA 1.407 -2.597 0 CA-C-O 122.205 1.002 . . . . 0.0 109.976 -178.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.88 -32.63 65.53 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 105.269 -2.122 . . . . 0.0 105.269 173.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 67.04 96.02 0.06 Allowed 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 112.858 -1.973 . . . . 0.0 111.925 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -121.71 83.75 2.14 Favored 'General case' 0 C--N 1.285 -2.201 0 N-CA-C 103.384 -2.821 . . . . 0.0 103.384 175.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -48.12 118.54 2.44 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 -167.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 32.2 t60 -74.95 120.47 20.53 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 176.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 33.8 p-80 -73.39 120.02 18.43 Favored 'General case' 0 C--N 1.315 -0.925 0 O-C-N 123.401 0.438 . . . . 0.0 111.815 -177.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 80.0 t60 68.48 103.09 0.05 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.173 1.389 . . . . 0.0 112.699 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 . . . . . 0 C--N 1.305 -1.363 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 177.278 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 CA--C 1.507 -0.693 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 m -87.12 -176.29 5.64 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 174.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 19.7 pt -74.83 76.73 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.998 0.904 . . . . 0.0 112.01 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.5 mt -80.79 -5.05 56.68 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.594 -177.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.441 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 1.9 mp0 -62.45 -24.69 67.58 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 124.281 1.032 . . . . 0.0 110.538 175.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -93.0 125.12 56.19 Favored Pre-proline 0 N--CA 1.435 -1.221 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.157 -175.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.526 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 26.8 Cg_exo -63.02 -34.67 69.65 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.652 2.235 . . . . 0.0 113.018 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 5.6 mm-40 -77.64 -30.13 52.05 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.309 0.576 . . . . 0.0 111.528 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -66.35 -38.71 88.23 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.762 176.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG12 ' O ' ' A' ' 7' ' ' PRO . 9.3 p -68.6 -33.43 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.817 177.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 7' ' ' PRO . 40.1 mmtm -55.04 -36.03 65.09 Favored 'General case' 0 C--N 1.361 1.104 0 CA-C-O 121.054 0.454 . . . . 0.0 110.038 173.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.34 -38.41 81.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.068 179.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -65.28 -32.89 74.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.569 0.699 . . . . 0.0 109.708 176.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -79.83 -23.93 41.68 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.079 177.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.482 ' CE1' ' HB2' ' A' ' 62' ' ' PHE . 47.9 t80 -79.14 -41.37 28.71 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 74.01 -174.3 0.14 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.863 1.265 . . . . 0.0 112.224 177.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -86.19 83.79 1.6 Allowed Glycine 0 N--CA 1.432 -1.6 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.804 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -97.47 13.98 28.01 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.717 0.77 . . . . 0.0 109.603 175.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.42 HG21 HG21 ' A' ' 24' ' ' VAL . 15.7 m -124.14 164.55 22.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-N 114.258 -1.337 . . . . 0.0 109.304 -174.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -78.78 118.64 21.03 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 173.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -55.37 -35.51 65.35 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 123.643 0.777 . . . . 0.0 111.657 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -74.24 -31.52 62.62 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.12 -174.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.607 ' O ' HG12 ' A' ' 27' ' ' ILE . 31.4 tp -76.48 -41.95 45.3 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.434 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.42 HG21 HG21 ' A' ' 19' ' ' VAL . 59.3 t -61.54 -42.17 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 176.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 38.1 ttm -55.61 -44.65 77.24 Favored 'General case' 0 C--O 1.226 -0.159 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 175.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -67.12 -40.84 86.9 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.133 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 23' ' ' LEU . 48.2 mm -56.74 -52.03 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.05 -40.88 99.03 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.683 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -65.22 -49.02 71.3 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.418 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -60.95 -42.5 98.36 Favored 'General case' 0 C--O 1.246 0.891 0 C-N-CA 124.643 1.177 . . . . 0.0 110.471 -176.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.41 ' CD1' HD13 ' A' ' 70' ' ' LEU . 41.2 pt -72.69 -38.99 59.77 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.96 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.542 177.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -61.94 -48.72 79.12 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 123.523 0.729 . . . . 0.0 112.022 -176.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.408 HD12 ' N ' ' A' ' 34' ' ' ASP . 4.2 pp -69.89 -27.0 64.44 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.996 0.427 . . . . 0.0 111.711 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.408 ' N ' HD12 ' A' ' 33' ' ' LEU . 19.0 t70 -75.78 -43.4 46.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.286 0.565 . . . . 0.0 109.6 177.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.514 ' CD1' ' HA ' ' A' ' 38' ' ' SER . 58.6 tp -66.56 -59.94 3.18 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.885 -179.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 43.04 -83.5 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 127.198 2.199 . . . . 0.0 114.136 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.81 -25.83 64.33 Favored Glycine 0 C--N 1.346 1.113 0 N-CA-C 111.479 -0.648 . . . . 0.0 111.479 178.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.514 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 22.6 m 71.55 89.36 0.1 Allowed 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 172.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -122.61 -60.1 1.56 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.726 173.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -126.81 88.76 2.87 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.927 0.87 . . . . 0.0 111.056 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.633 HG23 ' HG2' ' A' ' 71' ' ' GLN . 6.7 tt -69.9 -28.5 36.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.065 -178.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.529 ' O ' HG13 ' A' ' 46' ' ' ILE . 60.4 pttt -56.49 -38.62 72.0 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-O 120.712 0.291 . . . . 0.0 111.142 176.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.0 m -69.55 -42.05 75.09 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.684 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.433 ' HA ' ' CD2' ' A' ' 47' ' ' TYR . 22.8 m -62.15 -38.19 88.06 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.496 176.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 41' ' ' ILE . 33.5 mm -56.55 -48.96 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.53 0.732 . . . . 0.0 110.055 176.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 42' ' ' LYS . 77.1 mt -52.89 -47.58 52.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.537 -177.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.433 ' CD2' ' HA ' ' A' ' 44' ' ' SER . 23.9 m-85 -61.07 -53.36 58.1 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.661 0.744 . . . . 0.0 109.939 -175.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -64.77 -44.77 96.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-N 114.295 -1.321 . . . . 0.0 111.481 -174.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -63.41 -39.28 94.06 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.265 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.42 ' HA ' ' CD2' ' A' ' 53' ' ' LEU . 21.9 t -73.52 -21.82 60.28 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 120.677 0.275 . . . . 0.0 111.165 -179.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.1 t -94.1 -3.96 50.17 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.433 0.635 . . . . 0.0 110.333 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.544 ' O ' HG12 ' A' ' 56' ' ' ILE . 91.6 m-70 -140.48 37.47 1.86 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.42 ' CD2' ' HA ' ' A' ' 50' ' ' SER . 84.0 mt -47.62 -45.18 27.42 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -172.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -60.1 -48.94 79.62 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -172.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -67.38 -33.95 76.28 Favored 'General case' 0 C--O 1.245 0.819 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 52' ' ' HIS . 39.3 mm -63.94 -42.14 94.81 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.25 0 CA-C-N 115.19 -0.913 . . . . 0.0 108.969 178.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.476 ' NE ' ' HA ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -65.15 -50.05 67.51 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 123.351 0.661 . . . . 0.0 111.06 -177.386 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -57.75 -33.78 68.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.461 -178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.437 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 30.6 m-80 -127.3 46.52 2.51 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -175.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -53.45 -36.6 61.77 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.774 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -71.32 -42.04 69.09 Favored 'General case' 0 N--CA 1.439 -1.025 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.482 ' HB2' ' CE1' ' A' ' 15' ' ' PHE . 85.8 t80 -62.18 -49.6 75.14 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.895 178.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.497 ' HA ' HG12 ' A' ' 66' ' ' ILE . 61.5 m-85 -67.7 -32.89 73.85 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -178.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -69.2 -47.41 64.91 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.142 -0.623 . . . . 0.0 109.966 174.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.8 mtm -59.18 -46.54 88.13 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.92 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.535 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 37.9 pt -66.71 -41.03 87.44 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.974 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.231 178.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.18 -41.63 93.3 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.102 0.477 . . . . 0.0 110.191 179.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -58.71 -55.99 27.94 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.002 177.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.5 mt -61.8 -40.62 87.6 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.838 0 C-N-CA 124.173 0.989 . . . . 0.0 112.301 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 66' ' ' ILE . 89.7 mt -55.8 -46.02 78.12 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.556 0.343 . . . . 0.0 111.321 177.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.633 ' HG2' HG23 ' A' ' 41' ' ' ILE . 44.7 mt-30 -69.99 -51.67 30.59 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.934 0.873 . . . . 0.0 109.792 179.295 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 21.8 ttt85 -54.84 -43.82 73.39 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 125.709 1.604 . . . . 0.0 111.506 -179.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -95.92 -14.87 22.77 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 115.601 1.704 . . . . 0.0 115.601 -176.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.51 ' HB3' ' O ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -64.84 -31.45 72.69 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 174.058 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 71' ' ' GLN . 91.3 mttt -70.47 -46.25 64.13 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.05 177.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -76.66 -50.53 13.49 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -173.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.7 pt -121.23 -29.64 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -174.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.529 ' O ' HG23 ' A' ' 82' ' ' VAL . . . 124.33 145.13 6.6 Favored Glycine 0 C--N 1.317 -0.488 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.8 tp -62.69 -39.26 84.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -175.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -62.83 -36.22 82.49 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-O 121.29 0.567 . . . . 0.0 111.808 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.576 ' O ' ' HG ' ' A' ' 85' ' ' LEU . 16.3 m120 -65.54 -48.26 73.06 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.632 178.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 78' ' ' GLY . 19.5 t -64.42 -44.98 97.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.415 -177.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -50.82 -49.94 57.61 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.618 1.167 . . . . 0.0 110.137 179.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -43.31 79.48 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.254 -0.885 . . . . 0.0 109.604 -178.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 81' ' ' ASN . 81.3 mt -64.85 -35.4 80.99 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 82' ' ' VAL . 47.9 mm -64.97 -43.06 96.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.3 mt -62.0 -42.12 98.8 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.797 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.1 m -62.58 -32.16 73.1 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 123.911 0.885 . . . . 0.0 110.78 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.6 m -69.57 -43.95 71.82 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.279 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.7 pt -85.03 -41.6 15.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.518 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -98.87 115.04 27.95 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.14 79.06 2.96 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.898 0.856 . . . . 0.0 111.361 -179.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.47 ' CD ' ' HA ' ' A' ' 96' ' ' HIS . 8.2 tp10 -114.9 152.43 32.29 Favored 'General case' 0 N--CA 1.422 -1.842 0 CA-C-N 114.149 -1.387 . . . . 0.0 108.912 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -154.41 109.38 3.08 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -178.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 70.22 7.1 6.08 Favored 'General case' 0 N--CA 1.501 2.085 0 C-N-CA 124.246 1.018 . . . . 0.0 111.667 178.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.47 ' HA ' ' CD ' ' A' ' 93' ' ' GLU . 52.2 t-80 67.37 113.55 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.405 1.482 . . . . 0.0 111.513 -178.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -177.63 -25.63 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.222 -179.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -73.33 108.0 5.95 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.182 0.515 . . . . 0.0 112.115 -172.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 . . . . . 0 C--N 1.306 -1.319 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 177.849 . . . . . . . . 0 0 . 1 stop_ save_